smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc([C@H](C)[NH2+]CCc2c(C)noc2C)cc1C[NH+]1CCCCC1 ZINC000182892606 1125668475 /nfs/dbraw/zinc/66/84/75/1125668475.db2.gz IRZGPSPXZLNNLG-INIZCTEOSA-N 2 0 371.525 4.179 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546895 1079671720 /nfs/dbraw/zinc/67/17/20/1079671720.db2.gz WMJZWRFBSIFUSZ-RBBKRZOGSA-N 2 0 368.496 4.382 20 0 FIADRP CCC(=O)C(C)(C)C[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001208920370 1080266143 /nfs/dbraw/zinc/26/61/43/1080266143.db2.gz CKUBJJXSJSFHBF-UHFFFAOYSA-N 2 0 356.554 4.370 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(C)cc3C)CC2)cc1 ZINC000063319682 1080371181 /nfs/dbraw/zinc/37/11/81/1080371181.db2.gz VXIVNNSPMNZHBZ-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000180459569 1080501810 /nfs/dbraw/zinc/50/18/10/1080501810.db2.gz BVNIKHMUZOBNGJ-NRFANRHFSA-N 2 0 358.913 4.369 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)cc1 ZINC000160278489 1080783752 /nfs/dbraw/zinc/78/37/52/1080783752.db2.gz PEKALXNEOVAJAY-MRXNPFEDSA-N 2 0 361.917 4.306 20 0 FIADRP CCOc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)n1 ZINC001648795672 1080804402 /nfs/dbraw/zinc/80/44/02/1080804402.db2.gz UKZHYDFNEADZOR-GOSISDBHSA-N 2 0 353.510 4.145 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccnn3C3CCC3)cc2)C1 ZINC001648808668 1081114276 /nfs/dbraw/zinc/11/42/76/1081114276.db2.gz ZITSDNQIEZDGHV-OALUTQOASA-N 2 0 366.553 4.376 20 0 FIADRP Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CC2 ZINC000655751692 1081168995 /nfs/dbraw/zinc/16/89/95/1081168995.db2.gz QESOJOWMLPHGGX-XZOQPEGZSA-N 2 0 364.533 4.037 20 0 FIADRP Cc1cc(N2CCCC[C@H]2C)ccc1NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655751868 1081169848 /nfs/dbraw/zinc/16/98/48/1081169848.db2.gz KVNJRRMHTIBUAE-WIYYLYMNSA-N 2 0 357.542 4.039 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)CC1 ZINC000655789024 1081201509 /nfs/dbraw/zinc/20/15/09/1081201509.db2.gz UAHNCFXQECIKCQ-LEOXJPRUSA-N 2 0 356.554 4.019 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1 ZINC001648817127 1081238976 /nfs/dbraw/zinc/23/89/76/1081238976.db2.gz VZHJSUNVZLHZLI-GOSISDBHSA-N 2 0 360.542 4.386 20 0 FIADRP CCSc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccn1 ZINC000547979462 1081315954 /nfs/dbraw/zinc/31/59/54/1081315954.db2.gz QYUKPSSLLQGEJC-YLJYHZDGSA-N 2 0 355.551 4.194 20 0 FIADRP CC(C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000683692952 1081392489 /nfs/dbraw/zinc/39/24/89/1081392489.db2.gz YHWZRBVNUUCJJM-YUMYIRISSA-N 2 0 356.554 4.367 20 0 FIADRP CC[NH+](CC)CCC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515653 1081620167 /nfs/dbraw/zinc/62/01/67/1081620167.db2.gz RRHVNLRYASTLRZ-LJQANCHMSA-N 2 0 372.475 4.495 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000580315326 1081834751 /nfs/dbraw/zinc/83/47/51/1081834751.db2.gz COQPSPCVPFXZLE-APWZRJJASA-N 2 0 367.518 4.184 20 0 FIADRP C[C@H](C[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)COCc1ccccc1 ZINC000580587179 1082028051 /nfs/dbraw/zinc/02/80/51/1082028051.db2.gz XDXILIXRXFESQP-OIBXWCBGSA-N 2 0 352.522 4.264 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000127420706 1082218325 /nfs/dbraw/zinc/21/83/25/1082218325.db2.gz SSMWHEIVTMVQSZ-UYAOXDASSA-N 2 0 360.542 4.160 20 0 FIADRP CCc1nc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cs1 ZINC000581087283 1082307645 /nfs/dbraw/zinc/30/76/45/1082307645.db2.gz IGWXCAIJLYJPKF-UHFFFAOYSA-N 2 0 357.567 4.281 20 0 FIADRP c1ccc2c(c1)C[NH2+][C@@H]2Cc1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000656559933 1082578352 /nfs/dbraw/zinc/57/83/52/1082578352.db2.gz AWTGJWLYLULFJP-OAQYLSRUSA-N 2 0 374.488 4.110 20 0 FIADRP C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001167472763 1082691443 /nfs/dbraw/zinc/69/14/43/1082691443.db2.gz CQFSMJQXTVXWGE-FQEVSTJZSA-N 2 0 352.522 4.056 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cccs1 ZINC000090971320 1083096372 /nfs/dbraw/zinc/09/63/72/1083096372.db2.gz FLTSWZBCHQVUBV-KRWDZBQOSA-N 2 0 355.551 4.131 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000581973060 1083120255 /nfs/dbraw/zinc/12/02/55/1083120255.db2.gz VVVHOVOPPBZOAK-YTBHAWNYSA-N 2 0 352.469 4.401 20 0 FIADRP C[C@H](c1ccccc1F)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430923396 1083237938 /nfs/dbraw/zinc/23/79/38/1083237938.db2.gz DKQZXKQFIUWPSC-GOSISDBHSA-N 2 0 361.549 4.015 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000430949515 1083250388 /nfs/dbraw/zinc/25/03/88/1083250388.db2.gz CVLSFQKWLFBKJQ-LBPRGKRZSA-N 2 0 369.456 4.388 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000510733606 1083282597 /nfs/dbraw/zinc/28/25/97/1083282597.db2.gz LWRIISGVVLUGAF-SFHVURJKSA-N 2 0 351.332 4.146 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H]3CC[C@@H]3C3CCC3)CC2)cc1 ZINC000510745885 1083287230 /nfs/dbraw/zinc/28/72/30/1083287230.db2.gz BCZCFSAYIPZEKG-PKTZIBPZSA-N 2 0 356.554 4.226 20 0 FIADRP C[C@@H](CC1CCOCC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320171 1083405816 /nfs/dbraw/zinc/40/58/16/1083405816.db2.gz PHEBTDGCLWULMO-SIKLNZKXSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]C3CCC4(CCCO4)CC3)C3(CCC3)C2)cc1 ZINC000658318918 1083406085 /nfs/dbraw/zinc/40/60/85/1083406085.db2.gz UXEGCWXXHFVRBI-ZLHNRXBCSA-N 2 0 368.565 4.370 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCSCC1 ZINC000658319167 1083406703 /nfs/dbraw/zinc/40/67/03/1083406703.db2.gz XWYDAVIWOOFKDC-RXVVDRJESA-N 2 0 358.595 4.410 20 0 FIADRP Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000658352657 1083424455 /nfs/dbraw/zinc/42/44/55/1083424455.db2.gz HPCXAKJXUBCVTB-KNQAVFIVSA-N 2 0 360.517 4.005 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000658358039 1083427403 /nfs/dbraw/zinc/42/74/03/1083427403.db2.gz XWIGLZJFAIIJEO-HOTGVXAUSA-N 2 0 357.567 4.500 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658357106 1083428463 /nfs/dbraw/zinc/42/84/63/1083428463.db2.gz QZRQVHIIINLIGW-OAHLLOKOSA-N 2 0 370.566 4.286 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)c1ccccc1 ZINC000548483539 1083467564 /nfs/dbraw/zinc/46/75/64/1083467564.db2.gz GOBWWXLAMJMSNF-JAXLGGSGSA-N 2 0 351.538 4.012 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000510980638 1083557026 /nfs/dbraw/zinc/55/70/26/1083557026.db2.gz YMVBCEVJQZTXKJ-NBCNXNJRSA-N 2 0 368.496 4.322 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181345871 1083878391 /nfs/dbraw/zinc/87/83/91/1083878391.db2.gz PYIXNXQDQKGJMU-QGZVFWFLSA-N 2 0 371.525 4.050 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000657310866 1084407621 /nfs/dbraw/zinc/40/76/21/1084407621.db2.gz QLTRATKLFJINSA-QGZVFWFLSA-N 2 0 358.551 4.416 20 0 FIADRP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)C2)c1 ZINC000414068138 1084420453 /nfs/dbraw/zinc/42/04/53/1084420453.db2.gz AWJSQCUFNMDAJQ-HGHGUNKESA-N 2 0 362.945 4.067 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000537972718 1084437855 /nfs/dbraw/zinc/43/78/55/1084437855.db2.gz ZGGIXZSMAIWYDK-CXAGYDPISA-N 2 0 351.332 4.460 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c(C)n1 ZINC000157660965 1084443029 /nfs/dbraw/zinc/44/30/29/1084443029.db2.gz IGVQEQOECPLIIT-DLBZAZTESA-N 2 0 352.526 4.319 20 0 FIADRP CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523638 1084449516 /nfs/dbraw/zinc/44/95/16/1084449516.db2.gz OMTYIDWRVXRFNI-ZWKOTPCHSA-N 2 0 359.558 4.191 20 0 FIADRP CCC1(C[NH2+][C@@H](C)c2cc3n(n2)CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000414090833 1084519442 /nfs/dbraw/zinc/51/94/42/1084519442.db2.gz CUMDQNPCYJUDDJ-IBGZPJMESA-N 2 0 366.553 4.172 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1)C[NH+]1CCCC1 ZINC000613263101 1084520452 /nfs/dbraw/zinc/52/04/52/1084520452.db2.gz CFWNSIQILQOWMV-GOSISDBHSA-N 2 0 356.485 4.226 20 0 FIADRP CCOc1ccc([C@H](CC)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OCC ZINC000414189209 1084776649 /nfs/dbraw/zinc/77/66/49/1084776649.db2.gz RDUHAEIMAPGKGF-IBGZPJMESA-N 2 0 353.466 4.373 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cs1 ZINC000548712098 1084792784 /nfs/dbraw/zinc/79/27/84/1084792784.db2.gz SJZUKOCZNGLQHV-ILWGZMRPSA-N 2 0 369.578 4.274 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cnn1-c1cccc(Cl)c1 ZINC000414202361 1084800063 /nfs/dbraw/zinc/80/00/63/1084800063.db2.gz ZCDNGXYTROYBRL-DOTOQJQBSA-N 2 0 360.933 4.217 20 0 FIADRP CCOc1ccc(Oc2cc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)ccn2)cc1 ZINC000124980677 1084903895 /nfs/dbraw/zinc/90/38/95/1084903895.db2.gz DWQAPIIHPXTALH-QGZVFWFLSA-N 2 0 369.509 4.093 20 0 FIADRP Clc1cc(Br)ccc1CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000559913996 1084914068 /nfs/dbraw/zinc/91/40/68/1084914068.db2.gz DYZFQJOCJUBAJS-UHFFFAOYSA-N 2 0 371.750 4.109 20 0 FIADRP CC(C)Sc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000511142775 1085078828 /nfs/dbraw/zinc/07/88/28/1085078828.db2.gz GFEBIDDVTWAEKY-UHFFFAOYSA-N 2 0 362.583 4.264 20 0 FIADRP CCCCOc1ccc(C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)cc1Cl ZINC000657448760 1085087945 /nfs/dbraw/zinc/08/79/45/1085087945.db2.gz YOKJWKDNAXGWPP-UHFFFAOYSA-N 2 0 370.884 4.389 20 0 FIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(OC4CC[NH+](C)CC4)cc3)[nH]c2c1 ZINC000657459930 1085119338 /nfs/dbraw/zinc/11/93/38/1085119338.db2.gz MDRNTDQPAUZCBI-UHFFFAOYSA-N 2 0 363.505 4.239 20 0 FIADRP COc1ncc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1Cl ZINC000560250818 1085176869 /nfs/dbraw/zinc/17/68/69/1085176869.db2.gz QDWXELYCGUNYCW-HNNXBMFYSA-N 2 0 361.917 4.435 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCCCNC(=O)OC(C)(C)C)C[C@@H]1C ZINC001167589960 1085248219 /nfs/dbraw/zinc/24/82/19/1085248219.db2.gz KZHNGQVLPGPAHZ-RBUKOAKNSA-N 2 0 369.594 4.266 20 0 FIADRP Cc1ccc(C(=O)Nc2cccc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)c2)cc1 ZINC000125442640 1085268586 /nfs/dbraw/zinc/26/85/86/1085268586.db2.gz ORBZZGKAJYCBJZ-SFHVURJKSA-N 2 0 365.521 4.067 20 0 FIADRP C[NH+]1CCN(C(C)(C)C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000684953841 1085302753 /nfs/dbraw/zinc/30/27/53/1085302753.db2.gz NTROCDDOCOGALQ-FQEVSTJZSA-N 2 0 363.977 4.187 20 0 FIADRP c1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)cc2)cc1 ZINC000657536480 1085453542 /nfs/dbraw/zinc/45/35/42/1085453542.db2.gz JYPLSHGFTJOWGA-UHFFFAOYSA-N 2 0 364.533 4.334 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2csc(Cl)c2Cl)C[C@H](C)O1 ZINC000432229641 1085687300 /nfs/dbraw/zinc/68/73/00/1085687300.db2.gz SPHSWGFJXDZCSO-RYUDHWBXSA-N 2 0 351.343 4.034 20 0 FIADRP FC(F)(F)C1CCC(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)CC1 ZINC000657612590 1085689933 /nfs/dbraw/zinc/68/99/33/1085689933.db2.gz AQYSTUYAWVULKH-UHFFFAOYSA-N 2 0 369.475 4.252 20 0 FIADRP CCc1cc(N(c2cc(OC)cc3cccnc32)[C@H](C)CCC[NH3+])cc[nH+]1 ZINC001167615174 1085713501 /nfs/dbraw/zinc/71/35/01/1085713501.db2.gz RGPMRCCMYHKKMU-MRXNPFEDSA-N 2 0 364.493 4.466 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@@H](C)C2CC[NH+](C)CC2)c2ccccc2OC)cc1 ZINC000090772241 1085882725 /nfs/dbraw/zinc/88/27/25/1085882725.db2.gz HERVJGPRHBBXKN-GAJHUEQPSA-N 2 0 368.521 4.113 20 0 FIADRP Cc1ccc(-c2nnc(CN3CCC(C[NH+]4CCCCCC4)CC3)o2)cc1 ZINC000048564803 1085903134 /nfs/dbraw/zinc/90/31/34/1085903134.db2.gz ASUWZRBBXSJAGW-UHFFFAOYSA-N 2 0 368.525 4.133 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347824 1085919655 /nfs/dbraw/zinc/91/96/55/1085919655.db2.gz MVCNFROEBZHNDE-OSDKZWGASA-N 2 0 357.325 4.273 20 0 FIADRP COc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(C)c1OC ZINC000582991539 1085999423 /nfs/dbraw/zinc/99/94/23/1085999423.db2.gz UPSFKMYEMYOWLT-UHFFFAOYSA-N 2 0 360.542 4.100 20 0 FIADRP CN(CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)c1ccccc1 ZINC001167646580 1086009992 /nfs/dbraw/zinc/00/99/92/1086009992.db2.gz FKJDLBKNWSNSFQ-UPVQGACJSA-N 2 0 363.549 4.109 20 0 FIADRP Clc1ccccc1C1CC([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000511954416 1086052777 /nfs/dbraw/zinc/05/27/77/1086052777.db2.gz KDJAXCKQLCVPKW-UHFFFAOYSA-N 2 0 355.913 4.487 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cnc2ccsc2c1 ZINC000162518162 1086236958 /nfs/dbraw/zinc/23/69/58/1086236958.db2.gz ILDVXCOMQRMXKJ-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cnc2ccsc2c1 ZINC000162580523 1086311687 /nfs/dbraw/zinc/31/16/87/1086311687.db2.gz ZMOMFAQXWNRINZ-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP c1cnn(C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)c2ccccc2)c1 ZINC000663301610 1086388673 /nfs/dbraw/zinc/38/86/73/1086388673.db2.gz YBQBVOBUKBRMHP-XMMPIXPASA-N 2 0 374.532 4.400 20 0 FIADRP CCc1nc2ccccc2n1C1CC[NH+](Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000662278754 1086391072 /nfs/dbraw/zinc/39/10/72/1086391072.db2.gz LZMXGWHVTRSGQN-UHFFFAOYSA-N 2 0 374.532 4.082 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297821 1086400862 /nfs/dbraw/zinc/40/08/62/1086400862.db2.gz SGXWCTUGXKNSKY-UYAOXDASSA-N 2 0 371.569 4.157 20 0 FIADRP CC[C@H](c1ccccc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327119 1086414885 /nfs/dbraw/zinc/41/48/85/1086414885.db2.gz JTTOIHAHNRBLDN-JOCHJYFZSA-N 2 0 352.526 4.207 20 0 FIADRP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327514 1086418246 /nfs/dbraw/zinc/41/82/46/1086418246.db2.gz QEJNVBJENCAIBY-QFIPXVFZSA-N 2 0 370.516 4.347 20 0 FIADRP FC(F)c1cccc(C[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c1 ZINC000662327359 1086418347 /nfs/dbraw/zinc/41/83/47/1086418347.db2.gz OKNSVJOAFFIFJE-UHFFFAOYSA-N 2 0 374.479 4.194 20 0 FIADRP FC(F)Oc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663346573 1086448070 /nfs/dbraw/zinc/44/80/70/1086448070.db2.gz VNMBIEFBQJBEAL-OAHLLOKOSA-N 2 0 358.860 4.153 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000663466292 1086563882 /nfs/dbraw/zinc/56/38/82/1086563882.db2.gz QPCUAOJBWIOXRU-CRAIPNDOSA-N 2 0 367.459 4.189 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1OC(F)F ZINC000663467006 1086569630 /nfs/dbraw/zinc/56/96/30/1086569630.db2.gz CIXFMAVQVREVOC-HOCLYGCPSA-N 2 0 368.468 4.069 20 0 FIADRP c1ccc(CC2CC[NH+](CCCC[NH2+][C@H]3CCC34CCOCC4)CC2)cc1 ZINC000548793796 1086660863 /nfs/dbraw/zinc/66/08/63/1086660863.db2.gz DVKQKGKAHUORIX-QHCPKHFHSA-N 2 0 370.581 4.270 20 0 FIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000150979627 1086663324 /nfs/dbraw/zinc/66/33/24/1086663324.db2.gz KXNVVISUWFNVBR-HNNXBMFYSA-N 2 0 373.522 4.003 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167833454 1086666124 /nfs/dbraw/zinc/66/61/24/1086666124.db2.gz BHTZUCORNZFWOM-FYYLOGMGSA-N 3 0 357.586 4.095 20 0 FIADRP COc1cccc(OC)c1C[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000512044825 1086699969 /nfs/dbraw/zinc/69/99/69/1086699969.db2.gz ICOXYVGPPOBXJR-ICSRJNTNSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167837221 1086711534 /nfs/dbraw/zinc/71/15/34/1086711534.db2.gz JOROIKBTWYHZSS-RBUKOAKNSA-N 2 0 369.594 4.076 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001167838207 1086712245 /nfs/dbraw/zinc/71/22/45/1086712245.db2.gz RPEVCQAYSATKFC-NRFANRHFSA-N 3 0 357.586 4.095 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001167837773 1086712263 /nfs/dbraw/zinc/71/22/63/1086712263.db2.gz MKQKQMZNWROWML-OAQYLSRUSA-N 3 0 359.602 4.341 20 0 FIADRP COc1ccc([C@H](CC(C)C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000647294545 1086724372 /nfs/dbraw/zinc/72/43/72/1086724372.db2.gz GNXKAUSKIRJREU-RJGXRXQPSA-N 2 0 374.569 4.140 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 ZINC001167841617 1086738519 /nfs/dbraw/zinc/73/85/19/1086738519.db2.gz NDJQVMKAMNNORW-WIYYLYMNSA-N 2 0 369.594 4.218 20 0 FIADRP CC(C)(C)OC1CC(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000432425780 1086753241 /nfs/dbraw/zinc/75/32/41/1086753241.db2.gz NPYAXAZCRNXDNI-BUNPMSMLSA-N 2 0 370.581 4.470 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H](C(=O)OC)C[C@H]1c1ccccc1 ZINC001167842567 1086754079 /nfs/dbraw/zinc/75/40/79/1086754079.db2.gz YKLNLLKBCZTUGG-TYPHKJRUSA-N 2 0 360.542 4.123 20 0 FIADRP Cc1ccc(-c2cccc(C[N@@H+]3CCC[C@H]([C@H]4C[C@@H]([NH3+])CCO4)C3)c2)cc1 ZINC000650706826 1086761156 /nfs/dbraw/zinc/76/11/56/1086761156.db2.gz TWQWFAWCDMZIPZ-KMDXXIMOSA-N 2 0 364.533 4.380 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650713579 1086787955 /nfs/dbraw/zinc/78/79/55/1086787955.db2.gz WWQVENYFNIPOFD-UHFFFAOYSA-N 2 0 357.361 4.168 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)CC(=O)Nc1ccc(C(C)C)cc1 ZINC000650719331 1086802750 /nfs/dbraw/zinc/80/27/50/1086802750.db2.gz MAWRJKVZIUQAOW-KRWDZBQOSA-N 2 0 353.510 4.036 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Br)ccc1Cl ZINC000650719615 1086805434 /nfs/dbraw/zinc/80/54/34/1086805434.db2.gz WENDHDHFUAXKDE-UHFFFAOYSA-N 2 0 353.691 4.112 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000650721803 1086826032 /nfs/dbraw/zinc/82/60/32/1086826032.db2.gz BQPGLOWTVJRWND-YZGWKJHDSA-N 2 0 374.525 4.415 20 0 FIADRP CC(C)(Cc1ccc(Br)cc1)[NH2+]CCC[NH+]1CCCCC1 ZINC001167853225 1086860217 /nfs/dbraw/zinc/86/02/17/1086860217.db2.gz YAODCCBBWKIYIF-UHFFFAOYSA-N 2 0 353.348 4.236 20 0 FIADRP COc1cc2cc[nH+]c(NC3CC[NH+](C4CCCC4)CC3)c2cc1OC ZINC000663691613 1086878992 /nfs/dbraw/zinc/87/89/92/1086878992.db2.gz KMSUONCLYMMQDQ-UHFFFAOYSA-N 2 0 355.482 4.071 20 0 FIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000278364230 1086907796 /nfs/dbraw/zinc/90/77/96/1086907796.db2.gz JERSJROPSNRHTG-UHFFFAOYSA-N 2 0 353.441 4.044 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000583720317 1086929796 /nfs/dbraw/zinc/92/97/96/1086929796.db2.gz CQLNEHYPPWXYTM-IYBDPMFKSA-N 2 0 352.404 4.129 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000650745974 1086931575 /nfs/dbraw/zinc/93/15/75/1086931575.db2.gz SMWPWAXWSYAPPE-GOSISDBHSA-N 2 0 359.311 4.257 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278411236 1086952062 /nfs/dbraw/zinc/95/20/62/1086952062.db2.gz HOTBKBUZLPFTRP-CQSZACIVSA-N 2 0 356.539 4.039 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(OCC(F)(F)F)cc1 ZINC000650753775 1086958055 /nfs/dbraw/zinc/95/80/55/1086958055.db2.gz VLEHWQODGKAZSJ-LBPRGKRZSA-N 2 0 356.363 4.076 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(SCC(F)F)cc1 ZINC000650753754 1086958074 /nfs/dbraw/zinc/95/80/74/1086958074.db2.gz VAZSDEGYQWANRG-GFCCVEGCSA-N 2 0 354.441 4.492 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650764266 1086994819 /nfs/dbraw/zinc/99/48/19/1086994819.db2.gz UWKAWFSESZFOOQ-SFHVURJKSA-N 2 0 371.550 4.175 20 0 FIADRP COc1ccc(-c2nc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cs2)cc1 ZINC000657811799 1087078392 /nfs/dbraw/zinc/07/83/92/1087078392.db2.gz GUCDDYWAQVLSGX-UHFFFAOYSA-N 2 0 371.550 4.030 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cn1 ZINC000657812835 1087085486 /nfs/dbraw/zinc/08/54/86/1087085486.db2.gz GSRJKMRRAMHYEF-UHFFFAOYSA-N 2 0 364.537 4.061 20 0 FIADRP c1c[nH]c([C@H]2CCC[N@@H+](Cc3c(-c4ccccc4)nc4ccccn43)C2)n1 ZINC000080974636 1087290846 /nfs/dbraw/zinc/29/08/46/1087290846.db2.gz MSZDLTBYJNUCKN-SFHVURJKSA-N 2 0 357.461 4.104 20 0 FIADRP CC(C)CN(C(=O)c1ccc(Nc2cc[nH+]cc2)cc1)C1CC[NH+](C)CC1 ZINC000081046756 1087292937 /nfs/dbraw/zinc/29/29/37/1087292937.db2.gz NSLWLIPDMLOPFM-UHFFFAOYSA-N 2 0 366.509 4.018 20 0 FIADRP c1ccc([C@H](C[C@@H]2CCOC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089214757 1087380346 /nfs/dbraw/zinc/38/03/46/1087380346.db2.gz GLZOBDYGTKHJMD-REWPJTCUSA-N 2 0 365.521 4.056 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(CN3CCOCC3)cc2)C2CC2)cc1 ZINC000091265916 1087426289 /nfs/dbraw/zinc/42/62/89/1087426289.db2.gz SLTUYXOVZGJCIC-QHCPKHFHSA-N 2 0 350.506 4.068 20 0 FIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000657865615 1087430055 /nfs/dbraw/zinc/43/00/55/1087430055.db2.gz BLCVGFLQNXZXOZ-GOSISDBHSA-N 2 0 372.475 4.117 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000563920251 1087524825 /nfs/dbraw/zinc/52/48/25/1087524825.db2.gz CTOXLEVRJYRQEG-HSZRJFAPSA-N 2 0 352.522 4.441 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]C3CC[NH+](C(C)C)CC3)cc2cc1OC ZINC000657908087 1087613385 /nfs/dbraw/zinc/61/33/85/1087613385.db2.gz HDMQYGPUQSBYBL-INIZCTEOSA-N 2 0 356.510 4.380 20 0 FIADRP CC[NH+](C[C@H](C)C[N@@H+](CC)[C@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685590226 1087635025 /nfs/dbraw/zinc/63/50/25/1087635025.db2.gz NAAGKURMOCFGEF-ACDBMABISA-N 2 0 368.606 4.182 20 0 FIADRP CC(C)[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(F)cc(Br)c1 ZINC000657936532 1087662973 /nfs/dbraw/zinc/66/29/73/1087662973.db2.gz FSECQCUQVLROKZ-KRWDZBQOSA-N 2 0 355.295 4.137 20 0 FIADRP Cc1ccc(C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)cc1 ZINC000658068667 1087710312 /nfs/dbraw/zinc/71/03/12/1087710312.db2.gz XZPVDAIESYANTD-HSZRJFAPSA-N 2 0 358.570 4.043 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068543 1087710527 /nfs/dbraw/zinc/71/05/27/1087710527.db2.gz FYMGNFNSVKTAGV-IBGZPJMESA-N 2 0 358.570 4.427 20 0 FIADRP CCCC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccccc1 ZINC000658141738 1087733753 /nfs/dbraw/zinc/73/37/53/1087733753.db2.gz UKWXQBOTAHKLDG-GOTSBHOMSA-N 2 0 352.522 4.274 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](c3ccc(Cl)cc3)C3CC3)cc2)C1 ZINC000658137308 1087741452 /nfs/dbraw/zinc/74/14/52/1087741452.db2.gz GLCRBVPOYFJVAR-VXKWHMMOSA-N 2 0 370.924 4.148 20 0 FIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658139910 1087743268 /nfs/dbraw/zinc/74/32/68/1087743268.db2.gz NZXVBPPOEODDBD-YLJYHZDGSA-N 2 0 364.489 4.159 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc2c(s1)CCC2 ZINC000658166265 1087762756 /nfs/dbraw/zinc/76/27/56/1087762756.db2.gz NLUVNLILHAAEAZ-MRXNPFEDSA-N 2 0 355.551 4.195 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+][C@@H]2CCC23CCOCC3)C1 ZINC000548861106 1087770730 /nfs/dbraw/zinc/77/07/30/1087770730.db2.gz GYYMNLUFYOGXFK-WOIUINJBSA-N 2 0 356.554 4.213 20 0 FIADRP CC(C)n1cncc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000424137941 1087787307 /nfs/dbraw/zinc/78/73/07/1087787307.db2.gz CPDKMZVDQQVILG-UHFFFAOYSA-N 2 0 360.933 4.119 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[NH+]3CCC(C)CC3)C[C@H]2C1 ZINC000424263025 1087884955 /nfs/dbraw/zinc/88/49/55/1087884955.db2.gz GVAKWIFVQAZXQX-MESAYYPLSA-N 2 0 356.554 4.212 20 0 FIADRP Brc1ccccc1-c1ccc(C[NH2+]C2CC[NH2+]CC2)s1 ZINC000414782536 1087924494 /nfs/dbraw/zinc/92/44/94/1087924494.db2.gz FAUVVLNMBKPXHE-UHFFFAOYSA-N 2 0 351.313 4.019 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000186614336 1087948579 /nfs/dbraw/zinc/94/85/79/1087948579.db2.gz LCVYUVCHCMMGTP-OAHLLOKOSA-N 2 0 374.912 4.066 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000414787661 1087987187 /nfs/dbraw/zinc/98/71/87/1087987187.db2.gz VSFQMCXWUGXRRC-RTWAWAEBSA-N 2 0 350.506 4.184 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CN[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000423233541 1088076844 /nfs/dbraw/zinc/07/68/44/1088076844.db2.gz DQCXVFRYTRLTEQ-ZRBLBEILSA-N 2 0 351.538 4.235 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CN[C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000423233540 1088077693 /nfs/dbraw/zinc/07/76/93/1088077693.db2.gz DQCXVFRYTRLTEQ-ZLNRFVROSA-N 2 0 351.538 4.235 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000414810344 1088200632 /nfs/dbraw/zinc/20/06/32/1088200632.db2.gz HXWRXNBWFNJYCY-HUUCEWRRSA-N 2 0 359.901 4.175 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000414810342 1088201415 /nfs/dbraw/zinc/20/14/15/1088201415.db2.gz HXWRXNBWFNJYCY-GJZGRUSLSA-N 2 0 359.901 4.175 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000163558368 1088212986 /nfs/dbraw/zinc/21/29/86/1088212986.db2.gz INUUZNMBMPZSOD-GKVSMKOHSA-N 2 0 358.551 4.117 20 0 FIADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC[C@H]1[NH3+] ZINC000647938486 1088453103 /nfs/dbraw/zinc/45/31/03/1088453103.db2.gz OLXVMDPKFIWWDK-CSODHUTKSA-N 2 0 351.494 4.059 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4F)cc2)C[C@H](C)O1 ZINC000513859849 1088455086 /nfs/dbraw/zinc/45/50/86/1088455086.db2.gz QMBYOWGDEIOFGA-MFEFFIJZSA-N 2 0 368.496 4.212 20 0 FIADRP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@H](N)c1ccc(C(C)C)cc1 ZINC000414843644 1088503252 /nfs/dbraw/zinc/50/32/52/1088503252.db2.gz JWXRMOFSRPIJGA-UTKZUKDTSA-N 2 0 367.537 4.379 20 0 FIADRP COc1ccccc1C[C@@H](C)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000311395654 1088619633 /nfs/dbraw/zinc/61/96/33/1088619633.db2.gz OVWADUDAWLKEAT-XXBNENTESA-N 2 0 352.522 4.128 20 0 FIADRP C[C@@]1(C[NH2+]Cc2c[nH]nc2-c2cccs2)CC[N@H+](Cc2ccccc2)C1 ZINC000311546342 1088720723 /nfs/dbraw/zinc/72/07/23/1088720723.db2.gz VBVZHOFERXHKBX-NRFANRHFSA-N 2 0 366.534 4.140 20 0 FIADRP CCOCOc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000782969811 1088771711 /nfs/dbraw/zinc/77/17/11/1088771711.db2.gz XNPOGKFTAGYDJF-KNQAVFIVSA-N 2 0 368.521 4.060 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000312390442 1089060745 /nfs/dbraw/zinc/06/07/45/1089060745.db2.gz CTQUTUVUNQEUCI-AZUAARDMSA-N 2 0 366.505 4.021 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000415022928 1089061362 /nfs/dbraw/zinc/06/13/62/1089061362.db2.gz MCWYHWBOZFSUIX-LJQANCHMSA-N 2 0 362.521 4.124 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415032691 1089068913 /nfs/dbraw/zinc/06/89/13/1089068913.db2.gz IDOCVIFOGYUVKS-NZQKXSOJSA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnn(-c2ccc(Cl)cc2)c1)c1ccccc1 ZINC000415045417 1089089031 /nfs/dbraw/zinc/08/90/31/1089089031.db2.gz BQKNPSPYJNWBTO-HXUWFJFHSA-N 2 0 354.885 4.096 20 0 FIADRP C[C@@H](CC(=O)Nc1cccc(Cl)c1)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415057610 1089093426 /nfs/dbraw/zinc/09/34/26/1089093426.db2.gz RTWUPNPNYHSRKC-HNAYVOBHSA-N 2 0 359.901 4.127 20 0 FIADRP Cc1cccc(NC(=O)C[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c1C ZINC000415055385 1089098567 /nfs/dbraw/zinc/09/85/67/1089098567.db2.gz ORDRDRBNUXOTKQ-LAUBAEHRSA-N 2 0 353.510 4.090 20 0 FIADRP Cc1cc(Br)c(C[NH2+][C@H](CCC[NH3+])c2ccccc2)s1 ZINC000415054916 1089098605 /nfs/dbraw/zinc/09/86/05/1089098605.db2.gz OBQQZSDXMWODMY-OAHLLOKOSA-N 2 0 353.329 4.389 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)ccc1Oc1cccnc1 ZINC000415075517 1089123983 /nfs/dbraw/zinc/12/39/83/1089123983.db2.gz BQFBVJOJCGPGAE-DFQSSKMNSA-N 2 0 355.457 4.023 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415085886 1089146591 /nfs/dbraw/zinc/14/65/91/1089146591.db2.gz IYJODWJZXWIHNT-MSOLQXFVSA-N 2 0 369.509 4.140 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CC2)c1 ZINC000415121679 1089184331 /nfs/dbraw/zinc/18/43/31/1089184331.db2.gz ZEOYVVFPGXQXSM-FGTMMUONSA-N 2 0 352.444 4.247 20 0 FIADRP C[C@@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000415127889 1089193071 /nfs/dbraw/zinc/19/30/71/1089193071.db2.gz IURLJQAFZHXQLE-SFHVURJKSA-N 2 0 371.956 4.027 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3)CC2)C1 ZINC000415130256 1089195792 /nfs/dbraw/zinc/19/57/92/1089195792.db2.gz WOKSBOWIKROKAL-DHIUTWEWSA-N 2 0 350.506 4.072 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CC2([NH3+])CCCCCC2)c(Cl)c1 ZINC000414862624 1089197135 /nfs/dbraw/zinc/19/71/35/1089197135.db2.gz VRFCEFDXYCIYGY-OAHLLOKOSA-N 2 0 351.922 4.007 20 0 FIADRP [NH3+]CC1(O)CC[NH+](Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 ZINC000415145967 1089210440 /nfs/dbraw/zinc/21/04/40/1089210440.db2.gz XSHJTZUQGCMEHZ-UHFFFAOYSA-N 2 0 371.333 4.008 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1cccc2c1OCC[C@H]2[NH+](C)C ZINC000435041541 1089218907 /nfs/dbraw/zinc/21/89/07/1089218907.db2.gz JOQKLURLHLTZOX-ZPMCFJSWSA-N 2 0 365.521 4.004 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C[C@H](C)O1 ZINC000549236936 1089310592 /nfs/dbraw/zinc/31/05/92/1089310592.db2.gz IQBLJMBOHYODJC-NFVALVNTSA-N 2 0 356.554 4.080 20 0 FIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(C)c1 ZINC000514827879 1089505267 /nfs/dbraw/zinc/50/52/67/1089505267.db2.gz DUGAWLIYUNPBHT-GOTSBHOMSA-N 2 0 351.538 4.024 20 0 FIADRP c1ccc2c(c1)NCCC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000515331785 1089970231 /nfs/dbraw/zinc/97/02/31/1089970231.db2.gz AOXFJMBDQRRDGF-HSZRJFAPSA-N 2 0 365.521 4.198 20 0 FIADRP CC[N@H+](CCC1CCN(C(=O)Nc2ccc(C[NH2+]C)cc2)CC1)CC(C)C ZINC000415983182 1090061206 /nfs/dbraw/zinc/06/12/06/1090061206.db2.gz NAIIPMFUEAMZIV-UHFFFAOYSA-N 2 0 374.573 4.018 20 0 FIADRP C[N@H+](C[C@H]1CCC2(CCCCC2)O1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000467198496 1090194573 /nfs/dbraw/zinc/19/45/73/1090194573.db2.gz UCQGPFWYOIAJKV-OAQYLSRUSA-N 2 0 357.542 4.112 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000180611168 1090222843 /nfs/dbraw/zinc/22/28/43/1090222843.db2.gz DTOQKQRNWIXJRQ-HRAATJIYSA-N 2 0 369.484 4.213 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)C[C@H](c1ccccc1)[NH+](C)C ZINC000416175653 1090239178 /nfs/dbraw/zinc/23/91/78/1090239178.db2.gz IIQXTASJXGOZBO-JOCHJYFZSA-N 2 0 365.521 4.222 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1cccc(OCC[NH+](C)C)c1 ZINC000378389868 1090335279 /nfs/dbraw/zinc/33/52/79/1090335279.db2.gz AQLFOACJXGNFCK-AVCGJXAMSA-N 2 0 368.521 4.055 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](CCc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000511595882 1090611293 /nfs/dbraw/zinc/61/12/93/1090611293.db2.gz TYNIMWVAKYWLMO-BGYRXZFFSA-N 2 0 366.549 4.204 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2COCc3ccccc32)CC1 ZINC000417365643 1090847174 /nfs/dbraw/zinc/84/71/74/1090847174.db2.gz OBYODQQDSMDMAX-BBHUYCHWSA-N 2 0 350.506 4.291 20 0 FIADRP CCC[N@H+](CCC1CC[NH+](C)CC1)Cc1cccc(Br)c1 ZINC001207486821 1090993510 /nfs/dbraw/zinc/99/35/10/1090993510.db2.gz NTETXWIJDMWXCJ-UHFFFAOYSA-N 2 0 353.348 4.393 20 0 FIADRP Oc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000397589375 1091012427 /nfs/dbraw/zinc/01/24/27/1091012427.db2.gz LGYIUUZXAXQRKS-HSZRJFAPSA-N 2 0 350.506 4.271 20 0 FIADRP CCn1cncc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000418042484 1091035664 /nfs/dbraw/zinc/03/56/64/1091035664.db2.gz LSWJHIYQQQKOKC-VZKPYBMVSA-N 2 0 372.944 4.260 20 0 FIADRP CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)CCCN1CC[NH+](C(C)C)CC1 ZINC000500129807 1091056083 /nfs/dbraw/zinc/05/60/83/1091056083.db2.gz BRZIEETXJVXOFS-NRFANRHFSA-N 2 0 365.993 4.385 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000390525828 1091182440 /nfs/dbraw/zinc/18/24/40/1091182440.db2.gz IYXDJGQIIOCBCY-XUZZJYLKSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390551003 1091245260 /nfs/dbraw/zinc/24/52/60/1091245260.db2.gz KCGCMNGZXRCDHD-FRVYCDFKSA-N 2 0 355.570 4.082 20 0 FIADRP C[C@@H](c1ccc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1)C(F)(F)F ZINC000660474367 1091592262 /nfs/dbraw/zinc/59/22/62/1091592262.db2.gz IDDUSTUFLFTNHK-QFBILLFUSA-N 2 0 370.459 4.039 20 0 FIADRP C[C@@H](c1nc2ccccc2o1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512236291 1091945247 /nfs/dbraw/zinc/94/52/47/1091945247.db2.gz GJJOHFLJARPCAI-MBSDFSHPSA-N 2 0 361.489 4.487 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(-n2cccn2)cc1 ZINC000512317911 1092028532 /nfs/dbraw/zinc/02/85/32/1092028532.db2.gz HDSVJUKWNIPNKW-CMKODMSKSA-N 2 0 352.526 4.176 20 0 FIADRP Cc1cc(N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428166783 1092220058 /nfs/dbraw/zinc/22/00/58/1092220058.db2.gz STHQMSRRQKCQLQ-KDOFPFPSSA-N 2 0 361.436 4.065 20 0 FIADRP Cc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)cc(C)c1OCc1ccccn1 ZINC000093088744 1092230651 /nfs/dbraw/zinc/23/06/51/1092230651.db2.gz AVKXCQJZIRPVEX-UHFFFAOYSA-N 2 0 367.537 4.051 20 0 FIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc(Cl)c1OC ZINC000520950463 1092375662 /nfs/dbraw/zinc/37/56/62/1092375662.db2.gz WBOOJQUDPPSOJV-MRXNPFEDSA-N 2 0 368.949 4.492 20 0 FIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000665271633 1092421253 /nfs/dbraw/zinc/42/12/53/1092421253.db2.gz PMMPUFPVFVSJGG-CDIGIKMISA-N 2 0 361.533 4.146 20 0 FIADRP Cc1ccncc1CCC[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000521114476 1092511496 /nfs/dbraw/zinc/51/14/96/1092511496.db2.gz DWRIZIZAJJFRKS-UHFFFAOYSA-N 2 0 351.538 4.488 20 0 FIADRP Cc1ncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000428248512 1092574586 /nfs/dbraw/zinc/57/45/86/1092574586.db2.gz LXAAIIDQNFNGDM-HLAWJBBLSA-N 2 0 355.551 4.232 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)CC2)cc1 ZINC000442761883 1092751232 /nfs/dbraw/zinc/75/12/32/1092751232.db2.gz DFYNBSZFKGXMLZ-FQEVSTJZSA-N 2 0 359.517 4.137 20 0 FIADRP Cc1ncncc1[C@@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000521643320 1092821727 /nfs/dbraw/zinc/82/17/27/1092821727.db2.gz BYOWAXLIJFYULI-LJQANCHMSA-N 2 0 366.553 4.171 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c2ccccc2)c1 ZINC000442893251 1092845879 /nfs/dbraw/zinc/84/58/79/1092845879.db2.gz XFKNQCCJJRLDLJ-HSZRJFAPSA-N 2 0 365.565 4.008 20 0 FIADRP Brc1ccc(C[NH+]2CCC(C[NH2+][C@H]3C[C@H]4C[C@H]4C3)CC2)cc1 ZINC001167911164 1092858208 /nfs/dbraw/zinc/85/82/08/1092858208.db2.gz AGPHEXKOXOVFDT-DZFIZOCASA-N 2 0 363.343 4.049 20 0 FIADRP C[C@@H]1CC(N2C[C@@H](CC[NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014923 1092900936 /nfs/dbraw/zinc/90/09/36/1092900936.db2.gz NHOCLRSBQCZDSY-SFHLNBCPSA-N 2 0 363.549 4.381 20 0 FIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000443010700 1092914735 /nfs/dbraw/zinc/91/47/35/1092914735.db2.gz NQVCUYZSCSLALP-UHFFFAOYSA-N 2 0 366.427 4.244 20 0 FIADRP C[N@@H+](Cc1nc2ccc(F)cc2s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000432919356 1092951296 /nfs/dbraw/zinc/95/12/96/1092951296.db2.gz UDHVHRYSDZEHAU-UHFFFAOYSA-N 2 0 370.497 4.179 20 0 FIADRP Cc1ccccc1[C@@H]([C@H](C)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000443193775 1092983847 /nfs/dbraw/zinc/98/38/47/1092983847.db2.gz NDLLPFLYWGUUIX-WMZHIEFXSA-N 2 0 357.586 4.373 20 0 FIADRP COC1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512648504 1093069478 /nfs/dbraw/zinc/06/94/78/1093069478.db2.gz NQPZAFHXJZZFDZ-KICKQETISA-N 2 0 356.554 4.082 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cn(C)nc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168016306 1093081979 /nfs/dbraw/zinc/08/19/79/1093081979.db2.gz UTRDNHCSBFNCQR-OPMZPASUSA-N 2 0 362.521 4.105 20 0 FIADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512660445 1093096633 /nfs/dbraw/zinc/09/66/33/1093096633.db2.gz NGNBYEBUKUSXJH-FDFHNCONSA-N 2 0 358.570 4.066 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)sc1C ZINC000512666369 1093105732 /nfs/dbraw/zinc/10/57/32/1093105732.db2.gz KFBQXQHTJHVQMR-PCCBWWKXSA-N 2 0 369.578 4.193 20 0 FIADRP C[C@@H]1CC([NH2+][C@H]2CC(C)(C)N(O)C2(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168018833 1093173380 /nfs/dbraw/zinc/17/33/80/1093173380.db2.gz FLPXBCVMHYSHSA-HLIPFELVSA-N 2 0 359.558 4.038 20 0 FIADRP COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000474070004 1093180888 /nfs/dbraw/zinc/18/08/88/1093180888.db2.gz XFJBSTCGADZCAX-MRXNPFEDSA-N 2 0 368.477 4.233 20 0 FIADRP C[C@H]1CC([NH2+]CCCCC[NH+]2CCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168020385 1093211991 /nfs/dbraw/zinc/21/19/91/1093211991.db2.gz MUAFSTKDJYBUGY-SFTDATJTSA-N 3 0 357.586 4.284 20 0 FIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC000648416170 1093340268 /nfs/dbraw/zinc/34/02/68/1093340268.db2.gz ZAPAOMSNCMALDR-FCHUYYIVSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168024242 1093382435 /nfs/dbraw/zinc/38/24/35/1093382435.db2.gz CTCIOWWHGDTTIW-QYZOEREBSA-N 2 0 352.522 4.354 20 0 FIADRP CC1=CCC[C@H](C)[C@H]1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000443646766 1093386560 /nfs/dbraw/zinc/38/65/60/1093386560.db2.gz WSEBJRDWUGSVEN-REWPJTCUSA-N 2 0 361.618 4.107 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(-c3cc[nH]n3)o2)C[N@@H+]1Cc1ccccc1 ZINC000433310821 1093565649 /nfs/dbraw/zinc/56/56/49/1093565649.db2.gz JRLAMZDTQVPBMZ-IEBWSBKVSA-N 2 0 364.493 4.060 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3CCC[C@@H](c4ccccc4)N3)n2)cc1 ZINC001211884878 1093630885 /nfs/dbraw/zinc/63/08/85/1093630885.db2.gz ICKYJEUEVBLSBE-PMACEKPBSA-N 2 0 362.477 4.354 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474275293 1093633192 /nfs/dbraw/zinc/63/31/92/1093633192.db2.gz HWXPISWTSHDBLZ-UHFFFAOYSA-N 2 0 372.475 4.071 20 0 FIADRP Cc1ccc(CCC[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)cn1 ZINC000474269805 1093640151 /nfs/dbraw/zinc/64/01/51/1093640151.db2.gz BRFCHICACWPCJV-UHFFFAOYSA-N 2 0 351.538 4.167 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cn3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032150 1093655620 /nfs/dbraw/zinc/65/56/20/1093655620.db2.gz FOUIWGDMTPTRGO-RMFSNUHRSA-N 2 0 367.512 4.284 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2(Cc3ccc(O)cc3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031820 1093655728 /nfs/dbraw/zinc/65/57/28/1093655728.db2.gz CLPBRVIPCLDAES-HATOLVCRSA-N 2 0 364.533 4.499 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2cccc3c2cnn3C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031838 1093656365 /nfs/dbraw/zinc/65/63/65/1093656365.db2.gz CPOCSKFDUXWLLJ-QZTJIDSGSA-N 2 0 362.521 4.105 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000513060654 1093712397 /nfs/dbraw/zinc/71/23/97/1093712397.db2.gz YVQILFLMFBHBHO-JPYJTQIMSA-N 2 0 351.538 4.410 20 0 FIADRP CCC(CC)[N@@H+]1CC[C@H](NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168033367 1093713252 /nfs/dbraw/zinc/71/32/52/1093713252.db2.gz KRTQPGLOORYSOS-SBHAEUEKSA-N 2 0 357.586 4.281 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)C1 ZINC000067222725 1093718539 /nfs/dbraw/zinc/71/85/39/1093718539.db2.gz LUUAIYIFGGEITG-FQEVSTJZSA-N 2 0 367.537 4.099 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000067222991 1093718786 /nfs/dbraw/zinc/71/87/86/1093718786.db2.gz GACPETNIIIACKD-GOSISDBHSA-N 2 0 374.550 4.157 20 0 FIADRP C[C@@H]1C[C@@H](N(CC[NH3+])c2ccc(F)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168034063 1093735083 /nfs/dbraw/zinc/73/50/83/1093735083.db2.gz OEMDPWWNWOMVQT-OPMZPASUSA-N 2 0 355.501 4.032 20 0 FIADRP C[C@@H]1CC([NH2+]C(C)(C)Cc2cccnc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168034695 1093764819 /nfs/dbraw/zinc/76/48/19/1093764819.db2.gz QPYAUDKPGDULSM-RTBURBONSA-N 2 0 351.538 4.434 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1)c1ccco1 ZINC000513073788 1093777192 /nfs/dbraw/zinc/77/71/92/1093777192.db2.gz FTWYJEJJIBTFSP-SESVDKBCSA-N 2 0 361.574 4.295 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474427913 1093779929 /nfs/dbraw/zinc/77/99/29/1093779929.db2.gz SFNXEXGDUZYHGF-INIZCTEOSA-N 2 0 356.341 4.036 20 0 FIADRP CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C1 ZINC000474469307 1093806613 /nfs/dbraw/zinc/80/66/13/1093806613.db2.gz CFKAJFIALSXAPM-YADHBBJMSA-N 2 0 358.570 4.338 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000474480202 1093826399 /nfs/dbraw/zinc/82/63/99/1093826399.db2.gz ZOMDBWKNXGJTCK-GUDVDZBRSA-N 2 0 362.558 4.440 20 0 FIADRP Clc1ccc(CCCC[NH2+]CCCC[NH+]2CCOCC2)cc1Cl ZINC000474483180 1093830235 /nfs/dbraw/zinc/83/02/35/1093830235.db2.gz TUXGFGKJXCHIHW-UHFFFAOYSA-N 2 0 359.341 4.018 20 0 FIADRP CSc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000513098761 1093844969 /nfs/dbraw/zinc/84/49/69/1093844969.db2.gz LPFCAVIUGIWJBI-UHFFFAOYSA-N 2 0 369.578 4.101 20 0 FIADRP Clc1cccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000513099159 1093846502 /nfs/dbraw/zinc/84/65/02/1093846502.db2.gz QUJARKXAZDGCPP-UHFFFAOYSA-N 2 0 357.929 4.032 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cnc(-c3ccccc3)[nH]2)C[N@@H+]1Cc1ccccc1 ZINC000513494781 1094163542 /nfs/dbraw/zinc/16/35/42/1094163542.db2.gz JRLNZVOTHZLVBI-CTNGQTDRSA-N 2 0 374.532 4.467 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513487305 1094165981 /nfs/dbraw/zinc/16/59/81/1094165981.db2.gz BAHDJNXHDOFFOR-WIYYLYMNSA-N 2 0 362.521 4.033 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513500013 1094172941 /nfs/dbraw/zinc/17/29/41/1094172941.db2.gz KKGFZXOORXKSNV-GCJKJVERSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cnn(C(C)(C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000513544977 1094205988 /nfs/dbraw/zinc/20/59/88/1094205988.db2.gz NNUDMEJHNGOFQJ-ICSRJNTNSA-N 2 0 354.542 4.028 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccn(-c3ccccc3)n2)CC1 ZINC000513665930 1094263185 /nfs/dbraw/zinc/26/31/85/1094263185.db2.gz INMHQSFRKJARLE-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)C3CCCCC3)c2)[C@H]2CCC[C@H]21 ZINC000513667012 1094263698 /nfs/dbraw/zinc/26/36/98/1094263698.db2.gz PFTMIWSXYNXPLW-BHIFYINESA-N 2 0 369.553 4.168 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccc(F)cc2)cc1 ZINC000513685125 1094275324 /nfs/dbraw/zinc/27/53/24/1094275324.db2.gz XJYYYGUOLLMZAT-QETWGEEDSA-N 2 0 356.485 4.386 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](CC2CCCC2)c2ccccc2)CC1 ZINC000501006101 1094416077 /nfs/dbraw/zinc/41/60/77/1094416077.db2.gz FNSRVNHXVHHVRK-HSZRJFAPSA-N 2 0 357.586 4.314 20 0 FIADRP FC(F)(F)c1cccc(CCCC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000474622256 1094451333 /nfs/dbraw/zinc/45/13/33/1094451333.db2.gz ZXKZUAYMASKRFF-UHFFFAOYSA-N 2 0 354.460 4.492 20 0 FIADRP C[N@@H+](Cc1ncc(-c2ccccc2)o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070296 1094482939 /nfs/dbraw/zinc/48/29/39/1094482939.db2.gz SLVZWMOXLMHTKX-UHFFFAOYSA-N 2 0 362.477 4.085 20 0 FIADRP CCOC(=O)C[C@@H]1CCC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039984 1094483362 /nfs/dbraw/zinc/48/33/62/1094483362.db2.gz JJSUWNLTJYZJFD-MXNKGDRCSA-N 2 0 372.553 4.093 20 0 FIADRP COCC[C@H](c1ccccc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501092901 1094500971 /nfs/dbraw/zinc/50/09/71/1094500971.db2.gz XZSNAWRAIMNWDV-JOCHJYFZSA-N 2 0 353.510 4.008 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1 ZINC000501117300 1094516527 /nfs/dbraw/zinc/51/65/27/1094516527.db2.gz IKSWJYPPYRPVIK-PCCBWWKXSA-N 2 0 365.565 4.391 20 0 FIADRP CC(C)n1nccc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000474711459 1094534492 /nfs/dbraw/zinc/53/44/92/1094534492.db2.gz KMAJYZOCIZINEG-UHFFFAOYSA-N 2 0 368.569 4.289 20 0 FIADRP CC(C)OCCN1CCC([NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000474797347 1094616717 /nfs/dbraw/zinc/61/67/17/1094616717.db2.gz ZCTXHPASSOINBR-HYVNUMGLSA-N 2 0 370.990 4.373 20 0 FIADRP CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C1 ZINC000474802707 1094636766 /nfs/dbraw/zinc/63/67/66/1094636766.db2.gz YXLIWOFOMBLQEF-UGKGYDQZSA-N 2 0 358.570 4.338 20 0 FIADRP Clc1ccc(CCC[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1 ZINC000420313754 1094878095 /nfs/dbraw/zinc/87/80/95/1094878095.db2.gz PVUSAXUAVSTZKU-OAQYLSRUSA-N 2 0 357.929 4.312 20 0 FIADRP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420316159 1094879077 /nfs/dbraw/zinc/87/90/77/1094879077.db2.gz XZETYZARHDLIOK-PLYYQAHHSA-N 2 0 359.901 4.424 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2OCC(F)(F)F)CC1 ZINC000501768900 1094914568 /nfs/dbraw/zinc/91/45/68/1094914568.db2.gz FFYMEEBGXUWQJO-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP CCC1(Cc2ccccc2)CC[NH+](CCCN2CC[NH+](C(C)C)CC2)CC1 ZINC000501870219 1094981478 /nfs/dbraw/zinc/98/14/78/1094981478.db2.gz MJGHUVVCYPJWNR-UHFFFAOYSA-N 2 0 371.613 4.137 20 0 FIADRP CCOc1ccccc1[C@H](CC)[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000420932436 1095172355 /nfs/dbraw/zinc/17/23/55/1095172355.db2.gz HAVBXVKKYIGQRT-QFIPXVFZSA-N 2 0 368.521 4.158 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCC23CCOCC3)C1 ZINC000502279869 1095299268 /nfs/dbraw/zinc/29/92/68/1095299268.db2.gz FRMJMRAICJBJIV-DENIHFKCSA-N 2 0 356.554 4.357 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)oc1C ZINC000502369955 1095420738 /nfs/dbraw/zinc/42/07/38/1095420738.db2.gz ZDNSXKLBDUGMQW-IBGZPJMESA-N 2 0 355.526 4.149 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000421320781 1095517655 /nfs/dbraw/zinc/51/76/55/1095517655.db2.gz CQTQZLPMWUZTRK-UHFFFAOYSA-N 2 0 352.526 4.097 20 0 FIADRP COc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccc1OCc1cccs1 ZINC000421368594 1095565022 /nfs/dbraw/zinc/56/50/22/1095565022.db2.gz GNZCIDWHKBKNBQ-UHFFFAOYSA-N 2 0 374.550 4.298 20 0 FIADRP Clc1cccc(Cl)c1CCC[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000192630003 1095673429 /nfs/dbraw/zinc/67/34/29/1095673429.db2.gz PQKQULTXXSSIMU-HNNXBMFYSA-N 2 0 371.352 4.017 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cnn(C2CCCC2)c1 ZINC000502684701 1095714203 /nfs/dbraw/zinc/71/42/03/1095714203.db2.gz HDJCPSLYQGGZHJ-GOSISDBHSA-N 2 0 352.526 4.445 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1cnn(C2CCCC2)c1 ZINC000502699758 1095725600 /nfs/dbraw/zinc/72/56/00/1095725600.db2.gz SNAAYPBIFBFPEV-OAHLLOKOSA-N 2 0 353.445 4.174 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051039 1095768710 /nfs/dbraw/zinc/76/87/10/1095768710.db2.gz FNWXLIYUFFVCMZ-SFTDATJTSA-N 3 0 371.613 4.480 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051052 1095770711 /nfs/dbraw/zinc/77/07/11/1095770711.db2.gz FRJBCFMRNTWGPJ-GGPKGHCWSA-N 2 0 372.553 4.092 20 0 FIADRP CC[NH+](CC)C1CCN(C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168051876 1095856371 /nfs/dbraw/zinc/85/63/71/1095856371.db2.gz JRHQNJNFTXNQME-WOJBJXKFSA-N 2 0 357.586 4.234 20 0 FIADRP Cc1ncsc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001279144952 1095886036 /nfs/dbraw/zinc/88/60/36/1095886036.db2.gz RPOCHHJUMJZLQL-UHFFFAOYSA-N 2 0 359.514 4.079 20 0 FIADRP COC(=O)c1csc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000513760502 1095933339 /nfs/dbraw/zinc/93/33/39/1095933339.db2.gz JWQHZTSSRHXZFQ-MRXNPFEDSA-N 2 0 372.534 4.371 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccncc1Cl ZINC000421822766 1095935825 /nfs/dbraw/zinc/93/58/25/1095935825.db2.gz BHZVHKIHPZNHDT-ZACQAIPSSA-N 2 0 373.928 4.195 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C2CC2)c(F)c1 ZINC000421819222 1095952061 /nfs/dbraw/zinc/95/20/61/1095952061.db2.gz FVLHTVLVQSZAMD-JOCHJYFZSA-N 2 0 372.484 4.016 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)c(F)c1 ZINC000421841033 1095965246 /nfs/dbraw/zinc/96/52/46/1095965246.db2.gz HYRGDVMNGVJWFR-JOCHJYFZSA-N 2 0 369.484 4.187 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000414669338 1096396843 /nfs/dbraw/zinc/39/68/43/1096396843.db2.gz ZSWYVLHXHAIUND-XMSQKQJNSA-N 2 0 360.505 4.017 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000422730559 1096464352 /nfs/dbraw/zinc/46/43/52/1096464352.db2.gz KABKFCJFLZZLSU-QGZVFWFLSA-N 2 0 361.489 4.279 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC1CCCC1 ZINC000422719557 1096470246 /nfs/dbraw/zinc/47/02/46/1096470246.db2.gz YSCIZDAEQISROZ-OAHLLOKOSA-N 2 0 369.509 4.030 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1OC ZINC000422724095 1096471062 /nfs/dbraw/zinc/47/10/62/1096471062.db2.gz UJVBIKBGJILSPH-RYQLBKOJSA-N 2 0 366.933 4.148 20 0 FIADRP c1sc2ccccc2c1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422751880 1096483008 /nfs/dbraw/zinc/48/30/08/1096483008.db2.gz DDNCJEOPQLJYFI-RXVVDRJESA-N 2 0 350.487 4.247 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000422753818 1096484028 /nfs/dbraw/zinc/48/40/28/1096484028.db2.gz GNTUHJLBBAIIOE-QZTJIDSGSA-N 2 0 370.459 4.003 20 0 FIADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)c2ccccc21 ZINC000422768365 1096485091 /nfs/dbraw/zinc/48/50/91/1096485091.db2.gz SYAPFYCKQAVCJG-VQTJNVASSA-N 2 0 356.897 4.123 20 0 FIADRP Clc1ccc(SCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422774445 1096487720 /nfs/dbraw/zinc/48/77/20/1096487720.db2.gz XAJDDXUBYBFJCP-ICSRJNTNSA-N 2 0 374.937 4.278 20 0 FIADRP COc1ccc2cc(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422799494 1096493413 /nfs/dbraw/zinc/49/34/13/1096493413.db2.gz XAGDRFOHBXONAE-UPVQGACJSA-N 2 0 374.484 4.194 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000422796283 1096493591 /nfs/dbraw/zinc/49/35/91/1096493591.db2.gz YBGHFIGGZZJXGQ-YJYMSZOUSA-N 2 0 350.478 4.493 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c(OC)c1 ZINC000422797168 1096493950 /nfs/dbraw/zinc/49/39/50/1096493950.db2.gz LFZBGDIFDSIUMC-VBKZILBWSA-N 2 0 362.901 4.164 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000422834591 1096501995 /nfs/dbraw/zinc/50/19/95/1096501995.db2.gz HXAHSAJEBVZWBY-INIZCTEOSA-N 2 0 373.500 4.301 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422837272 1096502547 /nfs/dbraw/zinc/50/25/47/1096502547.db2.gz LTHQNIJTJFIRCT-ICYYRSKXSA-N 2 0 366.480 4.295 20 0 FIADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422880093 1096510859 /nfs/dbraw/zinc/51/08/59/1096510859.db2.gz NEGURYPXOUQIQW-RDTXWAMCSA-N 2 0 371.352 4.019 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422881144 1096511268 /nfs/dbraw/zinc/51/12/68/1096511268.db2.gz POJKZXPVDHWTJK-KDOFPFPSSA-N 2 0 371.352 4.149 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000422879530 1096511316 /nfs/dbraw/zinc/51/13/16/1096511316.db2.gz MIWHVNJFTVYURV-VAMGGRTRSA-N 2 0 364.961 4.145 20 0 FIADRP c1ccc(SC2(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422911333 1096521356 /nfs/dbraw/zinc/52/13/56/1096521356.db2.gz STNUIQFGXMMGJW-TZIWHRDSSA-N 2 0 366.530 4.157 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H](C)CCCC[NH3+])CCC3)cc1 ZINC000422912913 1096522121 /nfs/dbraw/zinc/52/21/21/1096522121.db2.gz XIQUZKCRVIAFFP-YOEHRIQHSA-N 2 0 359.539 4.303 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)nc1-c1ccccc1 ZINC000422925647 1096526177 /nfs/dbraw/zinc/52/61/77/1096526177.db2.gz BWXIMSLTHBKBPX-QRVBRYPASA-N 2 0 355.551 4.171 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000422925094 1096526345 /nfs/dbraw/zinc/52/63/45/1096526345.db2.gz VBVHYYSJBCSRJU-DLBZAZTESA-N 2 0 352.526 4.396 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000422927346 1096527218 /nfs/dbraw/zinc/52/72/18/1096527218.db2.gz GFWUUDSXZLFIMN-RYUDHWBXSA-N 2 0 353.388 4.159 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422943864 1096527819 /nfs/dbraw/zinc/52/78/19/1096527819.db2.gz LCJLVPRNEUPHCV-AKHDSKFASA-N 2 0 362.583 4.324 20 0 FIADRP c1nc2ccccc2n1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422935653 1096529052 /nfs/dbraw/zinc/52/90/52/1096529052.db2.gz HGIYWEFDOWAZHB-FDFHNCONSA-N 2 0 374.532 4.095 20 0 FIADRP c1ccc2c(c1)cccc2OCC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422933988 1096529286 /nfs/dbraw/zinc/52/92/86/1096529286.db2.gz BWKKJCWPGBZTIE-XUZZJYLKSA-N 2 0 374.484 4.064 20 0 FIADRP c1nc2ccccc2n1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422935652 1096529366 /nfs/dbraw/zinc/52/93/66/1096529366.db2.gz HGIYWEFDOWAZHB-BHIFYINESA-N 2 0 374.532 4.095 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422934567 1096529654 /nfs/dbraw/zinc/52/96/54/1096529654.db2.gz CPBASQXEYVOMFR-HZPDHXFCSA-N 2 0 371.525 4.448 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)cc1OC ZINC000422917717 1096532201 /nfs/dbraw/zinc/53/22/01/1096532201.db2.gz GQIFXPQOXWQMDR-VBKZILBWSA-N 2 0 362.901 4.164 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2ccc(Br)cc2)CCC1 ZINC000422947565 1096536526 /nfs/dbraw/zinc/53/65/26/1096536526.db2.gz YLAUOXYYWNGXHY-CQSZACIVSA-N 2 0 374.326 4.341 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954628 1096539357 /nfs/dbraw/zinc/53/93/57/1096539357.db2.gz JKKFPFJPNGILLM-PIGZYNQJSA-N 2 0 350.293 4.494 20 0 FIADRP CC(C)c1ccccc1OCC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422960323 1096540410 /nfs/dbraw/zinc/54/04/10/1096540410.db2.gz VUAIRGKYALFVQN-REWPJTCUSA-N 2 0 366.505 4.034 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NCC1([NH3+])CCCCC1)C1CCCCC1 ZINC000414711729 1096549466 /nfs/dbraw/zinc/54/94/66/1096549466.db2.gz MQCUHAGFKLYQPQ-UHFFFAOYSA-N 2 0 372.557 4.234 20 0 FIADRP CCCC[C@@H](C[NH3+])NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414712180 1096553128 /nfs/dbraw/zinc/55/31/28/1096553128.db2.gz NGWQYDGSHXVBRO-SFHVURJKSA-N 2 0 360.546 4.090 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CC(F)(F)F)c1ccc(Br)cc1 ZINC000423041887 1096558680 /nfs/dbraw/zinc/55/86/80/1096558680.db2.gz YALSNMVZOVVSLN-GXFFZTMASA-N 2 0 353.226 4.160 20 0 FIADRP C[NH+](C)[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000423057467 1096559975 /nfs/dbraw/zinc/55/99/75/1096559975.db2.gz ZVGBGKKAMFBRFC-IPMKNSEASA-N 2 0 363.427 4.043 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000423060132 1096560656 /nfs/dbraw/zinc/56/06/56/1096560656.db2.gz NSJNHAGBFXFHPB-KOLCDFICSA-N 2 0 354.317 4.085 20 0 FIADRP Brc1cccc(C[C@@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000423054236 1096566836 /nfs/dbraw/zinc/56/68/36/1096566836.db2.gz UELRDBUYEBZHLQ-MHYDHLEJSA-N 2 0 363.343 4.033 20 0 FIADRP Fc1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423086987 1096570120 /nfs/dbraw/zinc/57/01/20/1096570120.db2.gz OMDJNTGSBWDJCY-GUBFDYSESA-N 2 0 366.480 4.307 20 0 FIADRP Fc1cccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423094004 1096573243 /nfs/dbraw/zinc/57/32/43/1096573243.db2.gz IWKVEJDEHJQUDE-GUBFDYSESA-N 2 0 366.480 4.307 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423115405 1096576162 /nfs/dbraw/zinc/57/61/62/1096576162.db2.gz NFYKKZKXGFFJOD-FYINFDKHSA-N 2 0 354.519 4.315 20 0 FIADRP CCc1ccc([C@H](C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)N(CC)CC)cc1 ZINC000423121683 1096578668 /nfs/dbraw/zinc/57/86/68/1096578668.db2.gz BAPXNGWXRBXUCD-HXOBKFHXSA-N 2 0 368.569 4.145 20 0 FIADRP CC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423125798 1096580210 /nfs/dbraw/zinc/58/02/10/1096580210.db2.gz AHMZEZJELVKRQY-NQIIRXRSSA-N 2 0 358.432 4.144 20 0 FIADRP Clc1ccc([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)OCc2ccccc2)cc1 ZINC000423131085 1096581250 /nfs/dbraw/zinc/58/12/50/1096581250.db2.gz NPMOJHVUHTUFNL-IUPYZPJSSA-N 2 0 370.924 4.471 20 0 FIADRP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423104017 1096582421 /nfs/dbraw/zinc/58/24/21/1096582421.db2.gz PMUDPNVXMUEXIA-GVDBMIGSSA-N 2 0 364.942 4.110 20 0 FIADRP Clc1cccc([C@H]2C[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423105273 1096582650 /nfs/dbraw/zinc/58/26/50/1096582650.db2.gz YWELLODYQVRUMF-JXYHXMIBSA-N 2 0 368.908 4.432 20 0 FIADRP [NH3+]CC1CCC([NH2+]CC2(c3ccc(Br)s3)CCC2)CC1 ZINC000423108347 1096583150 /nfs/dbraw/zinc/58/31/50/1096583150.db2.gz RALOVFOAANIWFR-UHFFFAOYSA-N 2 0 357.361 4.039 20 0 FIADRP Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000423108380 1096583958 /nfs/dbraw/zinc/58/39/58/1096583958.db2.gz RDGJOTSLDQRHDW-FGTMMUONSA-N 2 0 361.942 4.474 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1OC(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503909254 1096593138 /nfs/dbraw/zinc/59/31/38/1096593138.db2.gz LEIKDJJSYKQBRF-NXWXRZEISA-N 2 0 352.469 4.037 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000423139896 1096595058 /nfs/dbraw/zinc/59/50/58/1096595058.db2.gz WUECVEIMAVVRAA-FZKQIMNGSA-N 2 0 351.416 4.236 20 0 FIADRP Brc1cccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2)c1 ZINC000423238740 1096618013 /nfs/dbraw/zinc/61/80/13/1096618013.db2.gz AUNRSWDYFGCLRC-DNVCBOLYSA-N 2 0 359.311 4.128 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000423214609 1096618411 /nfs/dbraw/zinc/61/84/11/1096618411.db2.gz LLTQVHYNILHGGC-VCANKDNSSA-N 2 0 367.324 4.408 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)[C@H]1CCC[NH2+]C1 ZINC000423219616 1096620481 /nfs/dbraw/zinc/62/04/81/1096620481.db2.gz ULIROEOKMAHMLQ-AGIUHOORSA-N 2 0 351.288 4.234 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423222140 1096622613 /nfs/dbraw/zinc/62/26/13/1096622613.db2.gz ZVNWLAHDLNGLHG-CGTJXYLNSA-N 2 0 355.551 4.474 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccccc2)c2cccc(Br)c2)CC1 ZINC000423240898 1096626397 /nfs/dbraw/zinc/62/63/97/1096626397.db2.gz XPTROHKQLPWRRK-CTWPCTMYSA-N 2 0 359.311 4.398 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccccc2)c2cccc(Br)c2)CC1 ZINC000423240896 1096626765 /nfs/dbraw/zinc/62/67/65/1096626765.db2.gz XPTROHKQLPWRRK-ACBHZAAOSA-N 2 0 359.311 4.398 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423244560 1096627539 /nfs/dbraw/zinc/62/75/39/1096627539.db2.gz HSCCHTXCTGUPGC-WDEREUQCSA-N 2 0 354.338 4.374 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423255549 1096631377 /nfs/dbraw/zinc/63/13/77/1096631377.db2.gz CHCJNQZOLGRYKC-RHSMWYFYSA-N 2 0 359.514 4.306 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)CCC2 ZINC000423257412 1096631472 /nfs/dbraw/zinc/63/14/72/1096631472.db2.gz JHNQBOGCXZNSSO-PBHICJAKSA-N 2 0 359.514 4.306 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccc(F)c(F)c2)c1 ZINC000423254780 1096631947 /nfs/dbraw/zinc/63/19/47/1096631947.db2.gz ZJWGRDYDWKSCRZ-VLIAUNLRSA-N 2 0 362.489 4.365 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Br)ccc2F)cc1 ZINC000423291055 1096635921 /nfs/dbraw/zinc/63/59/21/1096635921.db2.gz GLJJVRMZLVLERB-VXGBXAGGSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)ccc2F)cc1 ZINC000423291054 1096636140 /nfs/dbraw/zinc/63/61/40/1096636140.db2.gz GLJJVRMZLVLERB-RYUDHWBXSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Br)ccc1F ZINC000423291053 1096636195 /nfs/dbraw/zinc/63/61/95/1096636195.db2.gz GLJJVRMZLVLERB-NWDGAFQWSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccccc2Br)s1 ZINC000423306777 1096640221 /nfs/dbraw/zinc/64/02/21/1096640221.db2.gz UTFGYGORRBWUOW-NSHDSACASA-N 2 0 351.313 4.048 20 0 FIADRP C[C@@H]1C[C@H](C[NH+]2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]1 ZINC000414731236 1096641158 /nfs/dbraw/zinc/64/11/58/1096641158.db2.gz AHLALPPYEAKRCO-HUUCEWRRSA-N 2 0 371.352 4.363 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1Br ZINC000423295691 1096644411 /nfs/dbraw/zinc/64/44/11/1096644411.db2.gz XFJYTGSOJVKXJZ-NWDGAFQWSA-N 2 0 351.263 4.459 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000423334623 1096649921 /nfs/dbraw/zinc/64/99/21/1096649921.db2.gz FTPTTYNTNLUDNX-IBGZPJMESA-N 2 0 364.386 4.443 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1F ZINC000423386028 1096662361 /nfs/dbraw/zinc/66/23/61/1096662361.db2.gz LSRDQJRMTXYYDA-PZJWPPBQSA-N 2 0 354.469 4.254 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC[NH2+]1 ZINC000423391517 1096663388 /nfs/dbraw/zinc/66/33/88/1096663388.db2.gz WXWWUABHVKGPEX-CJBNDPTMSA-N 2 0 362.315 4.038 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC[NH2+]1 ZINC000423391519 1096663983 /nfs/dbraw/zinc/66/39/83/1096663983.db2.gz WXWWUABHVKGPEX-ZUCKAHLUSA-N 2 0 362.315 4.038 20 0 FIADRP Brc1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423398979 1096667539 /nfs/dbraw/zinc/66/75/39/1096667539.db2.gz ULGSYOVXJXWIDN-GOSISDBHSA-N 2 0 373.294 4.056 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2ccccc2)c1 ZINC000423406111 1096673862 /nfs/dbraw/zinc/67/38/62/1096673862.db2.gz YNBOMTRJAXPKAP-XMMPIXPASA-N 2 0 358.485 4.372 20 0 FIADRP COCC1(C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC[NH2+]CC1 ZINC000423413344 1096674905 /nfs/dbraw/zinc/67/49/05/1096674905.db2.gz YXRVWZAOVWQGBK-KRWDZBQOSA-N 2 0 358.448 4.008 20 0 FIADRP c1ccc([C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccc3ccccc3n2)cc1 ZINC000423430728 1096683001 /nfs/dbraw/zinc/68/30/01/1096683001.db2.gz IGUABCYQSVQLDT-TUACAJSNSA-N 2 0 357.501 4.302 20 0 FIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000423435567 1096685901 /nfs/dbraw/zinc/68/59/01/1096685901.db2.gz LEDGCLSHBLTNQB-URZJWIJPSA-N 2 0 350.506 4.401 20 0 FIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCSc2ccc(Br)cc21 ZINC000423458925 1096689088 /nfs/dbraw/zinc/68/90/88/1096689088.db2.gz KTLYQUYYCZYMOK-XTXFNFMZSA-N 2 0 367.356 4.092 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423457568 1096689846 /nfs/dbraw/zinc/68/98/46/1096689846.db2.gz IKVFJARXUOBZJL-TUAOUCFPSA-N 2 0 364.383 4.058 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)CCC2 ZINC000423472174 1096693897 /nfs/dbraw/zinc/69/38/97/1096693897.db2.gz MXOFFEUNFBIFOS-JQHSSLGASA-N 2 0 373.541 4.205 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cnc2ccsc2c1 ZINC000423474450 1096695609 /nfs/dbraw/zinc/69/56/09/1096695609.db2.gz OXOONVQYCWCYEI-UCLAIMLFSA-N 2 0 369.509 4.479 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(-c2ccccc2)s1 ZINC000423506957 1096700799 /nfs/dbraw/zinc/70/07/99/1096700799.db2.gz JAXNYYRRKAVNIH-KKXNLOMOSA-N 2 0 369.578 4.282 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2ccccc2Cl)cc1OC ZINC000423506807 1096701920 /nfs/dbraw/zinc/70/19/20/1096701920.db2.gz MILDHHBXNBGRDZ-PXARDIRTSA-N 2 0 374.912 4.164 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2ccccc2Cl)cc1OC ZINC000423506806 1096702262 /nfs/dbraw/zinc/70/22/62/1096702262.db2.gz MILDHHBXNBGRDZ-NVAPDCRFSA-N 2 0 374.912 4.164 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423483140 1096703099 /nfs/dbraw/zinc/70/30/99/1096703099.db2.gz PYMUUJKFJKSYBC-QUCCMNQESA-N 2 0 360.448 4.499 20 0 FIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000423508328 1096703136 /nfs/dbraw/zinc/70/31/36/1096703136.db2.gz QOLOIPKABFHVOB-IERDGZPVSA-N 2 0 366.509 4.101 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423483489 1096703281 /nfs/dbraw/zinc/70/32/81/1096703281.db2.gz QBNQWTBEYMSBDU-WMLDXEAASA-N 2 0 355.295 4.161 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000423511990 1096710027 /nfs/dbraw/zinc/71/00/27/1096710027.db2.gz QJQYLSUFICGZHC-PSGMQZRDSA-N 2 0 362.489 4.493 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000423511986 1096710216 /nfs/dbraw/zinc/71/02/16/1096710216.db2.gz QJQYLSUFICGZHC-AUJRIZCKSA-N 2 0 362.489 4.493 20 0 FIADRP C[C@@H](NC[C@@H]1C[NH2+]CCCO1)c1ccc(-c2ccccc2Cl)s1 ZINC000423512607 1096710365 /nfs/dbraw/zinc/71/03/65/1096710365.db2.gz KUZSEGKCARKLLC-KGLIPLIRSA-N 2 0 350.915 4.098 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423524377 1096712791 /nfs/dbraw/zinc/71/27/91/1096712791.db2.gz WYXILDGHXOHNGY-VSKRKVRLSA-N 2 0 366.505 4.238 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423524368 1096713154 /nfs/dbraw/zinc/71/31/54/1096713154.db2.gz WYXILDGHXOHNGY-BHIFYINESA-N 2 0 366.505 4.238 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2ccccc2)cc1 ZINC000423537611 1096715312 /nfs/dbraw/zinc/71/53/12/1096715312.db2.gz DICCHEUBKUMZOB-CTAFRAEOSA-N 2 0 372.459 4.355 20 0 FIADRP CSC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000423538950 1096715366 /nfs/dbraw/zinc/71/53/66/1096715366.db2.gz HIPIVZHZWYOPBW-ABFRBSLYSA-N 2 0 358.473 4.087 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)s2)cc1 ZINC000423540290 1096716136 /nfs/dbraw/zinc/71/61/36/1096716136.db2.gz JPDJCDBSICYUHU-HNONPPJISA-N 2 0 371.550 4.166 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423540997 1096716201 /nfs/dbraw/zinc/71/62/01/1096716201.db2.gz KIVCLYVIZMHUSM-JXFSHQFZSA-N 2 0 355.309 4.185 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423540995 1096716868 /nfs/dbraw/zinc/71/68/68/1096716868.db2.gz KIVCLYVIZMHUSM-IATRGZMQSA-N 2 0 355.309 4.185 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C2CC2)c1 ZINC000423544600 1096717641 /nfs/dbraw/zinc/71/76/41/1096717641.db2.gz OMWJSYJSADJAHU-YFHUEUNASA-N 2 0 354.416 4.014 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2ccccc2Cl)cc1 ZINC000423549431 1096719157 /nfs/dbraw/zinc/71/91/57/1096719157.db2.gz RXKFNSYBXLVBNA-AYMMHLMVSA-N 2 0 370.924 4.416 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2ccccc2Cl)cc1 ZINC000423549434 1096719263 /nfs/dbraw/zinc/71/92/63/1096719263.db2.gz RXKFNSYBXLVBNA-IDVKNYFZSA-N 2 0 370.924 4.416 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(F)cc(Br)c1 ZINC000423553214 1096720171 /nfs/dbraw/zinc/72/01/71/1096720171.db2.gz VZBOEKNHEGVAKZ-KVPRVUCYSA-N 2 0 355.295 4.017 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423551177 1096720239 /nfs/dbraw/zinc/72/02/39/1096720239.db2.gz TZWRJORJNMJKCS-WQANXHIZSA-N 2 0 355.551 4.466 20 0 FIADRP CC[NH+](CC)[C@@H](c1nc(-c2ccc(C[NH+](C)C)cc2)no1)c1ccccc1 ZINC000504228939 1096721396 /nfs/dbraw/zinc/72/13/96/1096721396.db2.gz BVWYEARVWNGJTJ-HXUWFJFHSA-N 2 0 364.493 4.229 20 0 FIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)c1ccc(C[NH+](CC)C2CC2)cc1 ZINC000504561307 1096809694 /nfs/dbraw/zinc/80/96/94/1096809694.db2.gz QEHXJOLGJMJAKL-JOCHJYFZSA-N 2 0 371.569 4.055 20 0 FIADRP FC(F)(F)c1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167960165 1098695788 /nfs/dbraw/zinc/69/57/88/1098695788.db2.gz WPBGIRBTKCZMKA-YQQQUEKLSA-N 2 0 352.444 4.243 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccsc2)c1 ZINC000436274052 1098901743 /nfs/dbraw/zinc/90/17/43/1098901743.db2.gz WUMMIKSVERZXBQ-UHFFFAOYSA-N 2 0 354.523 4.270 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc3ccccc32)CC1 ZINC000533271797 1098922317 /nfs/dbraw/zinc/92/23/17/1098922317.db2.gz ZPTNQFWUZVFGCH-GOSISDBHSA-N 2 0 367.537 4.219 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000436469469 1099045490 /nfs/dbraw/zinc/04/54/90/1099045490.db2.gz BPUJJLZFASDBAC-SFHVURJKSA-N 2 0 358.489 4.463 20 0 FIADRP Cc1cn2c(n1)[C@H](C[NH2+]Cc1ccc(-c3ccncc3)cc1F)CCC2 ZINC000533565359 1099176450 /nfs/dbraw/zinc/17/64/50/1099176450.db2.gz QHKJYHGEQJRCOY-IBGZPJMESA-N 2 0 350.441 4.060 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162265541 1099670620 /nfs/dbraw/zinc/67/06/20/1099670620.db2.gz OUTSXDCCGQOMGR-HZPDHXFCSA-N 2 0 360.473 4.187 20 0 FIADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000162279158 1099673806 /nfs/dbraw/zinc/67/38/06/1099673806.db2.gz AVYZYVGBGHQCQE-IBGZPJMESA-N 2 0 353.510 4.187 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000162498620 1099810514 /nfs/dbraw/zinc/81/05/14/1099810514.db2.gz CXVUWZXMBKUAPO-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@H](CN(C)Cc1ccccc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693253 1099826838 /nfs/dbraw/zinc/82/68/38/1099826838.db2.gz CQOQVFOKGYJMOR-LGVFNWMJSA-N 2 0 365.565 4.007 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702682 1099857961 /nfs/dbraw/zinc/85/79/61/1099857961.db2.gz WHKNJEUQZNNMDK-GHTZIAJQSA-N 2 0 367.537 4.259 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713932 1099886009 /nfs/dbraw/zinc/88/60/09/1099886009.db2.gz AQHMRHPIGYHDDE-PXNSSMCTSA-N 2 0 374.475 4.331 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508709955 1099899773 /nfs/dbraw/zinc/89/97/73/1099899773.db2.gz KMABGVMTWSFDSH-UGKGYDQZSA-N 2 0 351.538 4.379 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000162574660 1099903800 /nfs/dbraw/zinc/90/38/00/1099903800.db2.gz DGNGLYVIGALFOF-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(OC)cc1 ZINC000516882463 1099906668 /nfs/dbraw/zinc/90/66/68/1099906668.db2.gz BJTCJZVUFXOGAO-QHCPKHFHSA-N 2 0 368.521 4.409 20 0 FIADRP COc1cc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508717885 1099908460 /nfs/dbraw/zinc/90/84/60/1099908460.db2.gz MQRAWUKTVMYHBN-KNQAVFIVSA-N 2 0 352.522 4.046 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)Cc1ccccc1 ZINC000508720924 1099939509 /nfs/dbraw/zinc/93/95/09/1099939509.db2.gz NWSOJSNYWGPJPN-HFMPRLQTSA-N 2 0 365.565 4.007 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722899 1099943640 /nfs/dbraw/zinc/94/36/40/1099943640.db2.gz YQTRHQVGUUTNIR-FPOVZHCZSA-N 2 0 364.533 4.227 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722914 1099943732 /nfs/dbraw/zinc/94/37/32/1099943732.db2.gz YXOWVJJDWMAJFH-URXFXBBRSA-N 3 0 371.613 4.245 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000437489247 1099952324 /nfs/dbraw/zinc/95/23/24/1099952324.db2.gz ZAJMXQZISZICCC-NRFANRHFSA-N 2 0 373.585 4.012 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](C)C(C)(C)c3ccccc3)CC2)oc1C ZINC000162723929 1099975753 /nfs/dbraw/zinc/97/57/53/1099975753.db2.gz FPGXIRUXQMBNAP-IBGZPJMESA-N 2 0 369.553 4.459 20 0 FIADRP C[C@@H](Nc1ccc(N2CCCC2)cn1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516998735 1099978398 /nfs/dbraw/zinc/97/83/98/1099978398.db2.gz XLSLOKSOUMTZRS-QUCCMNQESA-N 2 0 350.510 4.004 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(N3CCCC3)nc2)CC1 ZINC000536664486 1100136226 /nfs/dbraw/zinc/13/62/26/1100136226.db2.gz FJIIBEWNFLEUIP-HXUWFJFHSA-N 2 0 370.585 4.158 20 0 FIADRP C[C@H]1C[C@H]1c1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000536665610 1100138625 /nfs/dbraw/zinc/13/86/25/1100138625.db2.gz UBTGQVCAOVYEQB-PGRDOPGGSA-N 2 0 373.585 4.031 20 0 FIADRP C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000536665611 1100139581 /nfs/dbraw/zinc/13/95/81/1100139581.db2.gz UBTGQVCAOVYEQB-XMSQKQJNSA-N 2 0 373.585 4.031 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(-c3ccccc3)o2)CC1 ZINC000536709223 1100228226 /nfs/dbraw/zinc/22/82/26/1100228226.db2.gz LHERRZAHOXAVQW-UHFFFAOYSA-N 2 0 356.510 4.269 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000379638042 1100235511 /nfs/dbraw/zinc/23/55/11/1100235511.db2.gz UEIVSIXSTBVIER-VQIMIIECSA-N 2 0 358.913 4.491 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000379628413 1100244536 /nfs/dbraw/zinc/24/45/36/1100244536.db2.gz IXHGKJJKKQZJSB-DXIQSLLYSA-N 2 0 352.522 4.356 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666856526 1100286984 /nfs/dbraw/zinc/28/69/84/1100286984.db2.gz NLXOSQOYQVKLNR-OAHLLOKOSA-N 2 0 357.361 4.181 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1cn(C2CCCC2)nc1-c1ccccn1)C1CC1 ZINC000459582956 1100308486 /nfs/dbraw/zinc/30/84/86/1100308486.db2.gz GHSGGFFFPXFZJL-UHFFFAOYSA-N 2 0 367.541 4.024 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536834948 1100346307 /nfs/dbraw/zinc/34/63/07/1100346307.db2.gz YUAWAHMAUFSGAA-QUCCMNQESA-N 2 0 354.542 4.199 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000536853087 1100366038 /nfs/dbraw/zinc/36/60/38/1100366038.db2.gz PRBDNBAURUGOMJ-FXAWDEMLSA-N 2 0 364.961 4.098 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536857656 1100372707 /nfs/dbraw/zinc/37/27/07/1100372707.db2.gz LSVBYFLMPRIDOD-XHSDSOJGSA-N 2 0 358.448 4.245 20 0 FIADRP Brc1ccc(C2CC([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC000459654791 1100397802 /nfs/dbraw/zinc/39/78/02/1100397802.db2.gz CQUNSYIUYOYWQF-UHFFFAOYSA-N 2 0 356.267 4.133 20 0 FIADRP COc1cccc(C2(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CC2)c1 ZINC000517629925 1100571358 /nfs/dbraw/zinc/57/13/58/1100571358.db2.gz BLGIRFPIEPKVSA-WMZHIEFXSA-N 2 0 364.533 4.227 20 0 FIADRP COc1cccc(C2(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CC2)c1 ZINC000517629927 1100571605 /nfs/dbraw/zinc/57/16/05/1100571605.db2.gz BLGIRFPIEPKVSA-XXBNENTESA-N 2 0 364.533 4.227 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+][C@H](C)c1ccc(-n3ccnc3C)cc1)C2 ZINC000426062578 1100756878 /nfs/dbraw/zinc/75/68/78/1100756878.db2.gz XZCGMDFJLSWASW-UZLBHIALSA-N 2 0 361.489 4.397 20 0 FIADRP [NH3+]C[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414946058 1100891994 /nfs/dbraw/zinc/89/19/94/1100891994.db2.gz SIZOKWOTOAABPA-XMMPIXPASA-N 2 0 359.517 4.094 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000414951631 1100911711 /nfs/dbraw/zinc/91/17/11/1100911711.db2.gz HUVQUJOUDSRMQE-KXBFYZLASA-N 2 0 374.912 4.015 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC[NH2+]1 ZINC000414955338 1100925779 /nfs/dbraw/zinc/92/57/79/1100925779.db2.gz UCBTVDKIRBWRQE-OLZOCXBDSA-N 2 0 365.340 4.408 20 0 FIADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438829244 1100949171 /nfs/dbraw/zinc/94/91/71/1100949171.db2.gz ZJZTVZWMSMDEQF-PLYUQDFWSA-N 2 0 358.570 4.470 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CCO)c2ccccc2)CC1 ZINC000438838655 1100956115 /nfs/dbraw/zinc/95/61/15/1100956115.db2.gz FXBZEHYPVKCXBV-XPPIMPSXSA-N 2 0 352.522 4.143 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOCCc2ccccc2)C1 ZINC000506474787 1101111022 /nfs/dbraw/zinc/11/10/22/1101111022.db2.gz PPFKYGICIASALG-FYYLOGMGSA-N 2 0 358.570 4.222 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439143899 1101199529 /nfs/dbraw/zinc/19/95/29/1101199529.db2.gz TUZHBTKWYDFZNP-XJKCOSOUSA-N 2 0 357.361 4.424 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000426302861 1101236030 /nfs/dbraw/zinc/23/60/30/1101236030.db2.gz VGKSQWOEOSBDNV-YZGWKJHDSA-N 2 0 359.533 4.037 20 0 FIADRP Clc1ccc(SCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167964080 1101253424 /nfs/dbraw/zinc/25/34/24/1101253424.db2.gz NABLZGUVMXGKQL-AYHJJNSGSA-N 2 0 350.959 4.427 20 0 FIADRP Cc1cc(C[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc2cccnc12 ZINC000414994351 1101329499 /nfs/dbraw/zinc/32/94/99/1101329499.db2.gz DDMJIRFUEPTOLB-RBBKRZOGSA-N 2 0 363.480 4.165 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000414994406 1101330852 /nfs/dbraw/zinc/33/08/52/1101330852.db2.gz DNEVFQGZFRXOLF-AEFFLSMTSA-N 2 0 366.534 4.208 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2(CO)CCC2)c2ccc(F)cc2)CC1 ZINC000671120663 1101338519 /nfs/dbraw/zinc/33/85/19/1101338519.db2.gz HLBRWYYPKPQKDZ-OAQYLSRUSA-N 2 0 362.533 4.131 20 0 FIADRP CC(C)[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000537011860 1101392163 /nfs/dbraw/zinc/39/21/63/1101392163.db2.gz SHOASEFDLTWXPP-LJQANCHMSA-N 2 0 372.384 4.306 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)cc1OC ZINC000537059342 1101414353 /nfs/dbraw/zinc/41/43/53/1101414353.db2.gz CRNUIPVQJPFNGY-NRFANRHFSA-N 2 0 368.521 4.063 20 0 FIADRP CC(C)[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccnc1 ZINC000537095638 1101462776 /nfs/dbraw/zinc/46/27/76/1101462776.db2.gz IXWYEADVMWRBJZ-QHCPKHFHSA-N 2 0 367.537 4.086 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)nc1 ZINC000760161473 1101478542 /nfs/dbraw/zinc/47/85/42/1101478542.db2.gz WWMIXLXEJGCCHC-MRXNPFEDSA-N 2 0 359.901 4.060 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000414999515 1101483792 /nfs/dbraw/zinc/48/37/92/1101483792.db2.gz JEIVHIOUXMTUSS-WFASDCNBSA-N 2 0 369.456 4.436 20 0 FIADRP COc1cccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1OC(C)C ZINC000518763514 1101519143 /nfs/dbraw/zinc/51/91/43/1101519143.db2.gz RTFMRJUAGMCLAY-KDURUIRLSA-N 2 0 362.558 4.330 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[NH+]3CCC(C)CC3)cc12 ZINC000894384130 1101538768 /nfs/dbraw/zinc/53/87/68/1101538768.db2.gz DOBNHVLBSCLRLN-UHFFFAOYSA-N 2 0 364.493 4.053 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000415001250 1101552217 /nfs/dbraw/zinc/55/22/17/1101552217.db2.gz KSALZNMZULKSPC-NVXWUHKLSA-N 2 0 371.912 4.199 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000537293671 1101614893 /nfs/dbraw/zinc/61/48/93/1101614893.db2.gz ABRWAARVWNPBON-NQIIRXRSSA-N 2 0 363.565 4.166 20 0 FIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537308527 1101636904 /nfs/dbraw/zinc/63/69/04/1101636904.db2.gz RWKFQMCJLSHDHF-KRWDZBQOSA-N 2 0 354.469 4.317 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000537355713 1101691250 /nfs/dbraw/zinc/69/12/50/1101691250.db2.gz AXWRGEDXWCASDF-IRFCIJBXSA-N 2 0 352.522 4.130 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168167700 1101819419 /nfs/dbraw/zinc/81/94/19/1101819419.db2.gz NWHCFFDKQSOTAW-ATZDWAIDSA-N 2 0 350.934 4.022 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2cccc(F)c2)CC1 ZINC001168168177 1101819818 /nfs/dbraw/zinc/81/98/18/1101819818.db2.gz PMWWVLORDRMGOK-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP Clc1ccc([C@@H](Cc2cccnc2)[NH2+]CCCCn2ccnc2)cc1 ZINC000546165030 1101993382 /nfs/dbraw/zinc/99/33/82/1101993382.db2.gz QGLINDHUFSDCHJ-HXUWFJFHSA-N 2 0 354.885 4.285 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000327814885 1102020096 /nfs/dbraw/zinc/02/00/96/1102020096.db2.gz LHXBFAGSIOBFQE-UHFFFAOYSA-N 2 0 355.507 4.378 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCc1noc2ccccc21 ZINC000653615735 1102180678 /nfs/dbraw/zinc/18/06/78/1102180678.db2.gz WISVURGQOPTJCQ-ROUUACIJSA-N 2 0 363.505 4.117 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000440343144 1102218433 /nfs/dbraw/zinc/21/84/33/1102218433.db2.gz PARWIBGGMYYALR-UHFFFAOYSA-N 2 0 366.534 4.335 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000415010853 1102222225 /nfs/dbraw/zinc/22/22/25/1102222225.db2.gz GVMYPXWJQFLXPR-LBPRGKRZSA-N 2 0 368.344 4.180 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000467399100 1102229826 /nfs/dbraw/zinc/22/98/26/1102229826.db2.gz CYLUZKLHCNGIGD-QFBILLFUSA-N 2 0 372.475 4.240 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)o1 ZINC000415014061 1102261422 /nfs/dbraw/zinc/26/14/22/1102261422.db2.gz ZGFIYVSQRNJVOW-HKUYNNGSSA-N 2 0 364.493 4.048 20 0 FIADRP COc1ccc2oc(C[NH2+]C[C@@H]3C[NH2+]CC[C@@H]3c3ccc(F)cc3)cc2c1 ZINC000415014655 1102261450 /nfs/dbraw/zinc/26/14/50/1102261450.db2.gz ZZURNTYACOQHKH-LAUBAEHRSA-N 2 0 368.452 4.063 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)ccc1SC ZINC000120949283 1102287851 /nfs/dbraw/zinc/28/78/51/1102287851.db2.gz WSNJRIDMDPAKLS-AWEZNQCLSA-N 2 0 362.514 4.469 20 0 FIADRP C[NH+](C)C[C@H](N[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000550796791 1102327366 /nfs/dbraw/zinc/32/73/66/1102327366.db2.gz AWLORWWHQVORBF-FKBYEOEOSA-N 2 0 371.956 4.368 20 0 FIADRP Brc1cc2c(s1)CC[C@@H]2NC1CC([NH+]2CCCCC2)C1 ZINC000550797031 1102327527 /nfs/dbraw/zinc/32/75/27/1102327527.db2.gz JSQGDKUSNXJAOI-YIZWMMSDSA-N 2 0 355.345 4.104 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1 ZINC000532446325 1102337601 /nfs/dbraw/zinc/33/76/01/1102337601.db2.gz FTYFJNNBCHUJQI-CPUCHLNUSA-N 2 0 353.348 4.045 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000532461756 1102370386 /nfs/dbraw/zinc/37/03/86/1102370386.db2.gz ZUXKANFVLSBJRJ-KRWDZBQOSA-N 2 0 357.542 4.134 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000532461760 1102370951 /nfs/dbraw/zinc/37/09/51/1102370951.db2.gz ZUXKANFVLSBJRJ-QGZVFWFLSA-N 2 0 357.542 4.134 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cccc(CO)c1 ZINC000121535163 1102410135 /nfs/dbraw/zinc/41/01/35/1102410135.db2.gz QCOOCFLAIPVRCV-IBGZPJMESA-N 2 0 352.522 4.406 20 0 FIADRP C[C@@H](NC[C@H](O)C[NH+]1CCCC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000532479639 1102423764 /nfs/dbraw/zinc/42/37/64/1102423764.db2.gz LJHLELNHPRDGFZ-PBHICJAKSA-N 2 0 364.942 4.176 20 0 FIADRP COc1cc(C)ccc1[C@@H](C)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485514 1102426721 /nfs/dbraw/zinc/42/67/21/1102426721.db2.gz SQTLPMXQBGSCJD-CTNGQTDRSA-N 2 0 352.522 4.219 20 0 FIADRP c1cnc2c(c1)CC[C@H]([NH2+]Cc1cccc(C[NH+]3CCCCCC3)c1)CC2 ZINC001648986978 1102587539 /nfs/dbraw/zinc/58/75/39/1102587539.db2.gz YXERFFQEOHFSII-QHCPKHFHSA-N 2 0 363.549 4.495 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[C@H]1C ZINC000550882056 1102653268 /nfs/dbraw/zinc/65/32/68/1102653268.db2.gz HPYKZMUOLWBWHY-VAPSRWTKSA-N 2 0 370.581 4.330 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1cccs1 ZINC000550887729 1102658267 /nfs/dbraw/zinc/65/82/67/1102658267.db2.gz ZFQBEMGUCRXEAO-QUCCMNQESA-N 2 0 370.562 4.328 20 0 FIADRP CN(C)[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1cccs1 ZINC000550886563 1102658547 /nfs/dbraw/zinc/65/85/47/1102658547.db2.gz HVBAGCFEZMYCQP-XVAXZDLZSA-N 2 0 371.594 4.384 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257506 1102675792 /nfs/dbraw/zinc/67/57/92/1102675792.db2.gz LSLMDHQMYHFSFQ-YPAWHYETSA-N 2 0 368.496 4.074 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)CC1 ZINC000550920877 1102693032 /nfs/dbraw/zinc/69/30/32/1102693032.db2.gz KNXFAHPULJPWOS-GPVXHPMSSA-N 2 0 368.565 4.367 20 0 FIADRP CCCC[N@H+](C)CC1CCN(Cc2csc(-c3ccccn3)n2)CC1 ZINC000111684408 1102702447 /nfs/dbraw/zinc/70/24/47/1102702447.db2.gz QLIWFSXBCJCZFK-UHFFFAOYSA-N 2 0 358.555 4.149 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cn(C)nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000537652436 1102728144 /nfs/dbraw/zinc/72/81/44/1102728144.db2.gz UXRWEUPQOAIUMZ-UYAOXDASSA-N 2 0 368.569 4.108 20 0 FIADRP Clc1ccc(Cl)c(-c2csc(C[NH2+][C@H]3CC34CC[NH2+]CC4)n2)c1 ZINC000666953505 1102747479 /nfs/dbraw/zinc/74/74/79/1102747479.db2.gz ADWMFCMMZIGKCN-HNNXBMFYSA-N 2 0 368.333 4.349 20 0 FIADRP FC(F)(F)C(CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C(F)(F)F ZINC001167981880 1102773809 /nfs/dbraw/zinc/77/38/09/1102773809.db2.gz NUYOQKYSSXMEKQ-YHWZYXNKSA-N 2 0 358.370 4.112 20 0 FIADRP c1ccc2c(c1)nc(C1CC[NH2+]CC1)n2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167983361 1102884090 /nfs/dbraw/zinc/88/40/90/1102884090.db2.gz GPWKINPQMLLBOZ-YOFSQIOKSA-N 2 0 364.537 4.081 20 0 FIADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550269992 1102894237 /nfs/dbraw/zinc/89/42/37/1102894237.db2.gz DSIXPJMPYNOAPN-YMPZKCBVSA-N 2 0 370.581 4.331 20 0 FIADRP CCC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CC1 ZINC000550270762 1102901573 /nfs/dbraw/zinc/90/15/73/1102901573.db2.gz BRHBUOCCZNANJB-APKLWFBNSA-N 2 0 370.581 4.474 20 0 FIADRP CN1CC[C@@H]([NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@H]1c1ccccc1 ZINC000551086695 1102906082 /nfs/dbraw/zinc/90/60/82/1102906082.db2.gz ARNFEWTYCMDCBO-VFUGHAIPSA-N 2 0 372.553 4.312 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1)c1ccc(Cl)nc1 ZINC000179132408 1102949655 /nfs/dbraw/zinc/94/96/55/1102949655.db2.gz KSYRVPYVYSLONI-HNNXBMFYSA-N 2 0 358.917 4.121 20 0 FIADRP CCCC(CCC)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265662 1103024910 /nfs/dbraw/zinc/02/49/10/1103024910.db2.gz YCIGFRMVHZYGKI-OAQYLSRUSA-N 2 0 358.570 4.474 20 0 FIADRP COc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c(OC)c1 ZINC000551266187 1103025216 /nfs/dbraw/zinc/02/52/16/1103025216.db2.gz XOZCBQPXNXFGAI-UHFFFAOYSA-N 2 0 368.521 4.237 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000551268132 1103026349 /nfs/dbraw/zinc/02/63/49/1103026349.db2.gz OLXFUUFPULFRDR-NRFANRHFSA-N 2 0 368.521 4.280 20 0 FIADRP c1nc(SC2CCCC2)ncc1CC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000551296402 1103051512 /nfs/dbraw/zinc/05/15/12/1103051512.db2.gz JPVYPGXJKHKXEQ-UHFFFAOYSA-N 2 0 374.598 4.050 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(C(F)(F)F)cn1 ZINC000551394637 1103177479 /nfs/dbraw/zinc/17/74/79/1103177479.db2.gz KHSLHNBYJBHNME-KXBFYZLASA-N 2 0 363.427 4.101 20 0 FIADRP C[C@H](Cn1ccnc1)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000532828637 1103245967 /nfs/dbraw/zinc/24/59/67/1103245967.db2.gz MVTKQCVMGBPBDD-LLVKDONJSA-N 2 0 367.305 4.492 20 0 FIADRP Fc1ccc(C(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccc(F)cc2)cc1 ZINC000666993679 1103305704 /nfs/dbraw/zinc/30/57/04/1103305704.db2.gz BBNQCAPWOQSOKG-HXUWFJFHSA-N 2 0 356.460 4.361 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccccc2)cc1OC ZINC000666995238 1103351600 /nfs/dbraw/zinc/35/16/00/1103351600.db2.gz HLJWPJRYJNAFIZ-IBGZPJMESA-N 2 0 366.505 4.135 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507444807 1103391967 /nfs/dbraw/zinc/39/19/67/1103391967.db2.gz PHMQUHXJROJJMC-MRXNPFEDSA-N 2 0 357.567 4.425 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)[C@H]1COc2ccccc21 ZINC000507485316 1103433837 /nfs/dbraw/zinc/43/38/37/1103433837.db2.gz LKOTXXATFBUPDU-YZMLUHFISA-N 2 0 362.517 4.051 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)[C@@H](C)C2 ZINC000551813417 1103695867 /nfs/dbraw/zinc/69/58/67/1103695867.db2.gz LQTACXRLENFTTQ-UUOWRZLLSA-N 2 0 364.533 4.491 20 0 FIADRP Clc1cc(Cl)c(OCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000246828350 1103714035 /nfs/dbraw/zinc/71/40/35/1103714035.db2.gz QEFOKVMJPRCDIC-OLZOCXBDSA-N 2 0 363.716 4.242 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@@H](c3ccnn3C)C2)c1 ZINC000519863492 1103912231 /nfs/dbraw/zinc/91/22/31/1103912231.db2.gz TXSFJQKDAJRARH-RTWAWAEBSA-N 2 0 354.542 4.076 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@H](C)[C@@H](C)C2)cc1)c1cscn1 ZINC000538193965 1104029288 /nfs/dbraw/zinc/02/92/88/1104029288.db2.gz GCSDCCBGVPGJQR-BZSNNMDCSA-N 2 0 373.566 4.003 20 0 FIADRP FC(F)(F)c1ccc(OCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441419874 1104381938 /nfs/dbraw/zinc/38/19/38/1104381938.db2.gz YFDRUTRGUOWKNY-DNVCBOLYSA-N 2 0 368.443 4.033 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(F)c1 ZINC000188445484 1104446034 /nfs/dbraw/zinc/44/60/34/1104446034.db2.gz VRWZETWYIYLZKB-FGZHOGPDSA-N 2 0 356.485 4.023 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)o2)cc1 ZINC000647976683 1104484922 /nfs/dbraw/zinc/48/49/22/1104484922.db2.gz RZXJLUBFSBBHOK-SJORKVTESA-N 2 0 359.901 4.207 20 0 FIADRP Cc1cccc(OC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167995297 1104507888 /nfs/dbraw/zinc/50/78/88/1104507888.db2.gz ZMAJTOUCCVGDAY-WCRBZPEASA-N 2 0 354.538 4.244 20 0 FIADRP COCCC1(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)CCCCC1 ZINC000189135435 1104782068 /nfs/dbraw/zinc/78/20/68/1104782068.db2.gz DQLCYKSKFVFBMY-QFIPXVFZSA-N 2 0 358.570 4.128 20 0 FIADRP Cc1ccc2cc(C[NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)ccc2n1 ZINC000189314717 1104794456 /nfs/dbraw/zinc/79/44/56/1104794456.db2.gz ALGULKLKRJGNKW-JOCHJYFZSA-N 2 0 359.517 4.197 20 0 FIADRP COC(=O)c1ccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168001660 1104936001 /nfs/dbraw/zinc/93/60/01/1104936001.db2.gz FXPGPBMVLMMDKH-IUPYZPJSSA-N 2 0 368.521 4.016 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000388829659 1105045094 /nfs/dbraw/zinc/04/50/94/1105045094.db2.gz WZJIUXFKGGPFMS-ZWOKBUDYSA-N 2 0 356.485 4.396 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152406518 1105088067 /nfs/dbraw/zinc/08/80/67/1105088067.db2.gz AIKTVXSDKUICLE-ROUUACIJSA-N 2 0 350.506 4.497 20 0 FIADRP C[C@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)c1cccc(Cl)c1 ZINC000189825158 1105095430 /nfs/dbraw/zinc/09/54/30/1105095430.db2.gz UKEIKBGCYWYYSP-GOSISDBHSA-N 2 0 371.956 4.477 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2-c2ccnn2C)C1 ZINC000507834402 1105240857 /nfs/dbraw/zinc/24/08/57/1105240857.db2.gz UPTNRNGDGHWFCB-VQTJNVASSA-N 2 0 366.553 4.174 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)CC1 ZINC000507951141 1105281576 /nfs/dbraw/zinc/28/15/76/1105281576.db2.gz NWQWORVPPMFUOB-UHFFFAOYSA-N 2 0 366.590 4.235 20 0 FIADRP c1sc(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1-c1ccccc1 ZINC000530249045 1106920022 /nfs/dbraw/zinc/92/00/22/1106920022.db2.gz SXZHGHMMWAJTST-HXUWFJFHSA-N 2 0 356.535 4.006 20 0 FIADRP C[C@@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530243467 1106923309 /nfs/dbraw/zinc/92/33/09/1106923309.db2.gz YKLJJASOYPUCEN-XJKSGUPXSA-N 2 0 357.325 4.145 20 0 FIADRP CN(c1ccccc1C[NH2+]CCCc1ccccc1F)C1CC[NH+](C)CC1 ZINC000475580465 1107798550 /nfs/dbraw/zinc/79/85/50/1107798550.db2.gz YNUDYNARXFRVTI-UHFFFAOYSA-N 2 0 369.528 4.079 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000531704827 1108084548 /nfs/dbraw/zinc/08/45/48/1108084548.db2.gz RBLLGKAFCXYZCD-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP CC(C[NH+]1CC[C@H](CC(F)(F)F)C1)C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444714763 1108088084 /nfs/dbraw/zinc/08/80/84/1108088084.db2.gz KSZILCIPCHAYBN-ZIAGYGMSSA-N 2 0 360.386 4.171 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531709937 1108088576 /nfs/dbraw/zinc/08/85/76/1108088576.db2.gz BTBGVUHCNPJBJX-ZEQRLZLVSA-N 2 0 365.565 4.278 20 0 FIADRP C[C@H](CC[NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2)[N@H+](C)Cc1ccccc1 ZINC000531725756 1108098069 /nfs/dbraw/zinc/09/80/69/1108098069.db2.gz BVGTZUNCEDYKDZ-QZTJIDSGSA-N 2 0 365.521 4.133 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ncc(-c2ccccc2)n1C ZINC000453054944 1108131412 /nfs/dbraw/zinc/13/14/12/1108131412.db2.gz CYFVFIVZJYFFJE-OALUTQOASA-N 2 0 354.542 4.250 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CCO1 ZINC000453138503 1108213422 /nfs/dbraw/zinc/21/34/22/1108213422.db2.gz AFVIVGRUHJIDJM-CCSDVLNMSA-N 2 0 356.554 4.223 20 0 FIADRP c1[nH]c2ncccc2c1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453169885 1108244355 /nfs/dbraw/zinc/24/43/55/1108244355.db2.gz KRMCEKXEQBNLFW-VJBWXMMDSA-N 2 0 374.532 4.138 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2sccc21 ZINC000453198630 1108266929 /nfs/dbraw/zinc/26/69/29/1108266929.db2.gz QHUUNOIGCCPYCJ-ZTNFWEORSA-N 2 0 356.535 4.043 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(-c2ccccc2)nn1C ZINC000453208583 1108278362 /nfs/dbraw/zinc/27/83/62/1108278362.db2.gz CHGGIICGGLSGCJ-FPOVZHCZSA-N 2 0 374.532 4.260 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000453213577 1108282511 /nfs/dbraw/zinc/28/25/11/1108282511.db2.gz APFMPANFOGJRHN-XZOQPEGZSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453214559 1108283977 /nfs/dbraw/zinc/28/39/77/1108283977.db2.gz DNAFQOZSMDACHO-AEFFLSMTSA-N 2 0 356.535 4.167 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000453217722 1108291027 /nfs/dbraw/zinc/29/10/27/1108291027.db2.gz IEBSTVLHNZQAPT-NRFANRHFSA-N 2 0 373.928 4.306 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CCOC4(CCC4)C3)[C@@H]3CCC[C@@H]32)cc1 ZINC000453331658 1108388703 /nfs/dbraw/zinc/38/87/03/1108388703.db2.gz ZQCFLUHLEUHZHB-LDVJMBRRSA-N 2 0 368.565 4.369 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc2c(c1)OCCO2 ZINC000531945643 1108389323 /nfs/dbraw/zinc/38/93/23/1108389323.db2.gz MTTZWOGDRRUJPU-GOSISDBHSA-N 2 0 366.505 4.295 20 0 FIADRP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000453311748 1108398194 /nfs/dbraw/zinc/39/81/94/1108398194.db2.gz BIZASZCWHMPEGP-FADBTOOJSA-N 2 0 356.554 4.223 20 0 FIADRP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000453311749 1108399261 /nfs/dbraw/zinc/39/92/61/1108399261.db2.gz BIZASZCWHMPEGP-HPAIXVDQSA-N 2 0 356.554 4.223 20 0 FIADRP c1ccc(CN2CCC([NH2+][C@H]3CSCCc4ccccc43)CC2)cc1 ZINC000531932762 1108402341 /nfs/dbraw/zinc/40/23/41/1108402341.db2.gz XPAIZAQEEBMOTC-QFIPXVFZSA-N 2 0 352.547 4.271 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccccc1C[NH+](C)C1CCCCC1 ZINC000531939139 1108415608 /nfs/dbraw/zinc/41/56/08/1108415608.db2.gz XOKDIVRYBJYSGO-DNVFCKCGSA-N 3 0 357.586 4.269 20 0 FIADRP Cc1c([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cnn1-c1cccc(Cl)c1 ZINC000453338419 1108432216 /nfs/dbraw/zinc/43/22/16/1108432216.db2.gz FXQXOPWIKYAIAB-TZUVLKIQSA-N 2 0 358.917 4.110 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531957885 1108446698 /nfs/dbraw/zinc/44/66/98/1108446698.db2.gz JMSKWYJDCNFTFG-AVRDEDQJSA-N 2 0 369.578 4.048 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453353302 1108454528 /nfs/dbraw/zinc/45/45/28/1108454528.db2.gz NQMPXXNSRVRYOF-ZYJGPIPZSA-N 2 0 350.506 4.194 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)c1 ZINC000453354155 1108456743 /nfs/dbraw/zinc/45/67/43/1108456743.db2.gz OFEUJPHDFPTCEQ-VYTWWXLVSA-N 2 0 350.506 4.194 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)c1 ZINC000453354159 1108457538 /nfs/dbraw/zinc/45/75/38/1108457538.db2.gz OFEUJPHDFPTCEQ-ZYJGPIPZSA-N 2 0 350.506 4.194 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1)C1CC1 ZINC000453386245 1108471886 /nfs/dbraw/zinc/47/18/86/1108471886.db2.gz ALBNZRZEFQTJRB-NRFANRHFSA-N 2 0 357.929 4.483 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1cc2ccccc2nc1N1CCCCC1)C1CC1 ZINC000453593620 1108629957 /nfs/dbraw/zinc/62/99/57/1108629957.db2.gz HAKVUZMTOOYQQH-UHFFFAOYSA-N 2 0 366.553 4.189 20 0 FIADRP c1snnc1C[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453594028 1108649817 /nfs/dbraw/zinc/64/98/17/1108649817.db2.gz DMCSOYRROJLKTG-NRFANRHFSA-N 2 0 370.566 4.195 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000532192543 1108701257 /nfs/dbraw/zinc/70/12/57/1108701257.db2.gz UXSKRKNOLPITTE-LJQANCHMSA-N 2 0 354.542 4.343 20 0 FIADRP C[C@H]1C[C@@H]1c1ccc(CNC2CC[NH+](CCc3ccc(F)cc3)CC2)o1 ZINC000532210915 1108713131 /nfs/dbraw/zinc/71/31/31/1108713131.db2.gz DHMPQOFENDTCAJ-KKSFZXQISA-N 2 0 356.485 4.339 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc21 ZINC000532214178 1108715309 /nfs/dbraw/zinc/71/53/09/1108715309.db2.gz ZIEZTFWGBDNVFD-CTUHWIOQSA-N 2 0 363.549 4.203 20 0 FIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000532227110 1108723599 /nfs/dbraw/zinc/72/35/99/1108723599.db2.gz OQDHLEPPQQPLOV-LJQANCHMSA-N 2 0 368.521 4.329 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532234424 1108729813 /nfs/dbraw/zinc/72/98/13/1108729813.db2.gz FXTRGQYMSJRDIZ-UXPWSPDFSA-N 2 0 357.542 4.123 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCc2ccccc21)C1CC[NH+](C)CC1 ZINC000532358581 1108769643 /nfs/dbraw/zinc/76/96/43/1108769643.db2.gz OICXDRWJHZQYKS-HXUWFJFHSA-N 2 0 363.549 4.037 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2cccc(OCC(F)(F)F)c2)CC1 ZINC000475635430 1109014089 /nfs/dbraw/zinc/01/40/89/1109014089.db2.gz PQUDVHVRMKFXLH-UHFFFAOYSA-N 2 0 358.448 4.023 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822908 1109350188 /nfs/dbraw/zinc/35/01/88/1109350188.db2.gz ZEBWIQCHAMIYHQ-REWPJTCUSA-N 2 0 357.586 4.090 20 0 FIADRP c1ccc(COc2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cc2)cc1 ZINC000446885549 1109382786 /nfs/dbraw/zinc/38/27/86/1109382786.db2.gz XLKYCDWIGULSSB-UHFFFAOYSA-N 2 0 350.506 4.230 20 0 FIADRP CN(c1ccccc1C[N@H+](C)Cc1cc(F)cc(F)c1)C1CC[NH+](C)CC1 ZINC000446975414 1109408375 /nfs/dbraw/zinc/40/83/75/1109408375.db2.gz RAEUSJVJPHZDAX-UHFFFAOYSA-N 2 0 373.491 4.127 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCc4occc43)CC2)cc1 ZINC000447533513 1109570242 /nfs/dbraw/zinc/57/02/42/1109570242.db2.gz XVXVJASNBQPMEG-OAQYLSRUSA-N 2 0 354.494 4.167 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)c(Br)c1 ZINC000447556283 1109580289 /nfs/dbraw/zinc/58/02/89/1109580289.db2.gz FLIWDEGFSOHGSV-GFCCVEGCSA-N 2 0 355.295 4.113 20 0 FIADRP COC(=O)c1coc([C@@H](C)NCc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000447563633 1109582755 /nfs/dbraw/zinc/58/27/55/1109582755.db2.gz RGFZIARSSUODCI-QGZVFWFLSA-N 2 0 370.493 4.149 20 0 FIADRP Fc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1F ZINC000447590412 1109589479 /nfs/dbraw/zinc/58/94/79/1109589479.db2.gz CLPYMHGCBIZNTP-LDLYASANSA-N 2 0 374.450 4.432 20 0 FIADRP COC1CCC(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447600251 1109599208 /nfs/dbraw/zinc/59/92/08/1109599208.db2.gz LLKQOLQPKWGKIX-KHBUQGBSSA-N 2 0 356.554 4.367 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(-c2nc(-c3ccn4c[nH+]cc4c3)no2)cc1 ZINC000447955017 1109686407 /nfs/dbraw/zinc/68/64/07/1109686407.db2.gz PDXCFRDRUZHPOL-UHFFFAOYSA-N 2 0 361.449 4.283 20 0 FIADRP C[C@H](N[C@H]1CCOc2c(F)cccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527197744 1109717949 /nfs/dbraw/zinc/71/79/49/1109717949.db2.gz ZSDIKLDKLJXOMM-MDKPJZGXSA-N 2 0 354.469 4.150 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(-c3ccccc3)nc3ccccn32)C[C@H]1C ZINC000448097867 1109723696 /nfs/dbraw/zinc/72/36/96/1109723696.db2.gz RCPLERQPWSQHOT-UYAOXDASSA-N 2 0 362.521 4.306 20 0 FIADRP C[C@H]([NH2+]CCCOc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544422442 1109791552 /nfs/dbraw/zinc/79/15/52/1109791552.db2.gz XXIIEMIBPMVVNK-DLBZAZTESA-N 2 0 350.934 4.352 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC000527694291 1109805879 /nfs/dbraw/zinc/80/58/79/1109805879.db2.gz YIGGFBFGENVYTO-SFHVURJKSA-N 2 0 371.956 4.123 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ncc(C(F)(F)F)cc2Cl)CC1 ZINC000527844064 1109837688 /nfs/dbraw/zinc/83/76/88/1109837688.db2.gz DKMMIOQKWGKTFA-LBPRGKRZSA-N 2 0 363.855 4.149 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ncc(C(F)(F)F)cc2Cl)CC1 ZINC000527844061 1109837818 /nfs/dbraw/zinc/83/78/18/1109837818.db2.gz DKMMIOQKWGKTFA-GFCCVEGCSA-N 2 0 363.855 4.149 20 0 FIADRP CC[C@@H](CCc1ccccc1)[NH2+]C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000527871509 1109845612 /nfs/dbraw/zinc/84/56/12/1109845612.db2.gz PWPJYCSMVBMXLE-FQEVSTJZSA-N 2 0 352.526 4.063 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)cc1C[NH+]1CCCCC1 ZINC000527933519 1109870065 /nfs/dbraw/zinc/87/00/65/1109870065.db2.gz VMAZYFUVVTWXTR-MOPGFXCFSA-N 2 0 360.542 4.148 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC/C=C\c1ccc(Br)cc1 ZINC000527932578 1109870417 /nfs/dbraw/zinc/87/04/17/1109870417.db2.gz NKZPDANFWUYYQR-FFLCMVSISA-N 2 0 351.332 4.171 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCN2C2CCCC2)CC1 ZINC000527999160 1109881439 /nfs/dbraw/zinc/88/14/39/1109881439.db2.gz FOAIMIZCOASFDK-BBHUYCHWSA-N 2 0 355.570 4.036 20 0 FIADRP CC(C)[NH+]1CCC(N[C@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000528011592 1109885313 /nfs/dbraw/zinc/88/53/13/1109885313.db2.gz VTFYAFXQLULOAS-GOSISDBHSA-N 2 0 358.357 4.059 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCN2CCCCCC2=O)CC1 ZINC000449061401 1109964941 /nfs/dbraw/zinc/96/49/41/1109964941.db2.gz ILYSKHXKSLCFKS-UHFFFAOYSA-N 2 0 365.606 4.048 20 0 FIADRP COc1cc(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc2ccccc21 ZINC000449088153 1109971441 /nfs/dbraw/zinc/97/14/41/1109971441.db2.gz HOZGHAVJASYYFB-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP c1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n(C2CCCC2)n1 ZINC000449098692 1109976089 /nfs/dbraw/zinc/97/60/89/1109976089.db2.gz QNSHLTJUVKVXGC-UHFFFAOYSA-N 2 0 352.526 4.000 20 0 FIADRP c1ccc(CC2CC[NH+](CCCC[NH2+][C@H]3CCOC4(CCC4)C3)CC2)cc1 ZINC000449122522 1109980280 /nfs/dbraw/zinc/98/02/80/1109980280.db2.gz LMKIYOYCRDAWKN-QHCPKHFHSA-N 2 0 370.581 4.413 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(O)cc2)CC1 ZINC000449127211 1109981341 /nfs/dbraw/zinc/98/13/41/1109981341.db2.gz OKDRYGSAMVMFSB-VQTJNVASSA-N 2 0 366.549 4.399 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2CCOC3(CCC3)C2)CC1 ZINC000449130414 1109981790 /nfs/dbraw/zinc/98/17/90/1109981790.db2.gz YWZZVBVAHBBZOM-LJQANCHMSA-N 2 0 362.945 4.243 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(O)cc2)CC1 ZINC000449131622 1109982253 /nfs/dbraw/zinc/98/22/53/1109982253.db2.gz OIXQRUYDMCKXJZ-RBUKOAKNSA-N 2 0 352.522 4.008 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCOc3ccccc32)CC1 ZINC000449145500 1109985052 /nfs/dbraw/zinc/98/50/52/1109985052.db2.gz LMHQJZVSWLJYGM-FPOVZHCZSA-N 2 0 364.533 4.238 20 0 FIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NCc2ccnn2C2CCCC2)CC1 ZINC000449149312 1109985909 /nfs/dbraw/zinc/98/59/09/1109985909.db2.gz NGYJDAVVVCTHDL-SFHVURJKSA-N 2 0 352.526 4.313 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@H]2CCCC[C@@H]2O)CC1 ZINC000449190537 1109991503 /nfs/dbraw/zinc/99/15/03/1109991503.db2.gz JELLHIIMBQBIFM-LSWJPFSZSA-N 2 0 358.570 4.003 20 0 FIADRP COCCC1(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCCC1 ZINC000449182325 1109993540 /nfs/dbraw/zinc/99/35/40/1109993540.db2.gz JRPLWISDUPHXMK-FQEVSTJZSA-N 2 0 358.570 4.269 20 0 FIADRP C[NH+](C)Cc1ccc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)cc1F ZINC000449210119 1109996519 /nfs/dbraw/zinc/99/65/19/1109996519.db2.gz VVDJXDQVRDDWLD-INIZCTEOSA-N 2 0 352.375 4.082 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3c(F)cccc3F)s2)c1 ZINC000449221898 1110000491 /nfs/dbraw/zinc/00/04/91/1110000491.db2.gz UWSBEWHWMYJTKA-UHFFFAOYSA-N 2 0 373.472 4.440 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)nn1C ZINC000282027395 1110281029 /nfs/dbraw/zinc/28/10/29/1110281029.db2.gz FGLKEGZYDQPJCB-SFHVURJKSA-N 2 0 362.521 4.308 20 0 FIADRP CCCOc1ccc(Br)cc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000389900590 1110284769 /nfs/dbraw/zinc/28/47/69/1110284769.db2.gz QWUIKPLNDMQQGL-UHFFFAOYSA-N 2 0 369.347 4.059 20 0 FIADRP CC(C)c1nnc(CN2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)s1 ZINC000450494001 1110306413 /nfs/dbraw/zinc/30/64/13/1110306413.db2.gz IBGKSBKASOYFKN-MRXNPFEDSA-N 2 0 350.576 4.138 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)cc1)C(F)(F)F ZINC000450599901 1110318687 /nfs/dbraw/zinc/31/86/87/1110318687.db2.gz LXSCPGWJCAMUJQ-ZWQIFLOQSA-N 2 0 370.459 4.036 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1cc(-c2ccccc2)cs1 ZINC000538795881 1111293944 /nfs/dbraw/zinc/29/39/44/1111293944.db2.gz BOOIXUMFJGNSGM-NRSPTQNISA-N 2 0 356.535 4.099 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc(-c2ccccc2)cs1 ZINC000538795880 1111294215 /nfs/dbraw/zinc/29/42/15/1111294215.db2.gz BOOIXUMFJGNSGM-HMXCVIKNSA-N 2 0 356.535 4.099 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000539064234 1111405845 /nfs/dbraw/zinc/40/58/45/1111405845.db2.gz DRAVPKNTBDOGNV-PWRODBHTSA-N 2 0 362.945 4.075 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1csc(C(C)(C)C)n1 ZINC000539045027 1111409902 /nfs/dbraw/zinc/40/99/02/1111409902.db2.gz ZAVNLMPCWNDJNH-FXAWDEMLSA-N 2 0 371.594 4.483 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)Nc2cccc(F)c2)c1 ZINC000539071970 1111418648 /nfs/dbraw/zinc/41/86/48/1111418648.db2.gz ZITRIMKRTCJZLH-QGZVFWFLSA-N 2 0 371.500 4.173 20 0 FIADRP CC(C)[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159457 1111454256 /nfs/dbraw/zinc/45/42/56/1111454256.db2.gz RVAGBTAFSSDQQO-JXXFODFXSA-N 2 0 359.514 4.188 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H](CC)Cc2ccccc2Br)CC1 ZINC000539293768 1111505272 /nfs/dbraw/zinc/50/52/72/1111505272.db2.gz XNRWYUYQRJHQPJ-INIZCTEOSA-N 2 0 353.348 4.234 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H]1[C@@H]3Cc4ccccc4[C@H]13)c1ccccc1O2 ZINC000539392823 1111540388 /nfs/dbraw/zinc/54/03/88/1111540388.db2.gz GEYJKCURVHQCEW-KHUIQGCPSA-N 2 0 374.528 4.150 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000643522337 1111543413 /nfs/dbraw/zinc/54/34/13/1111543413.db2.gz LUVPLDYMKTYSNW-CMPLNLGQSA-N 2 0 365.237 4.261 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000552062518 1111562797 /nfs/dbraw/zinc/56/27/97/1111562797.db2.gz ZZXNOASOXDEVDS-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H](O)[C@](C)(C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)Cc1ccccc1 ZINC000477854493 1111578768 /nfs/dbraw/zinc/57/87/68/1111578768.db2.gz BKXPEKXQYMKZRY-CHOVIJNXSA-N 2 0 372.597 4.249 20 0 FIADRP C[C@H](O)[C@](C)(C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)Cc1ccccc1 ZINC000477858853 1111579947 /nfs/dbraw/zinc/57/99/47/1111579947.db2.gz MWUDVJKBELXPND-SHBJFUFKSA-N 2 0 372.597 4.249 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CCO[C@@H]3c3ccccc3)CC2)C1 ZINC000477927756 1111604747 /nfs/dbraw/zinc/60/47/47/1111604747.db2.gz BIMMNVMREMGHJA-CVNLYIMZSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000477945964 1111617354 /nfs/dbraw/zinc/61/73/54/1111617354.db2.gz JTXGRAWPEAMSFD-JMUQELJHSA-N 2 0 368.521 4.055 20 0 FIADRP Cc1nc(C)c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)s1 ZINC000552272925 1111654614 /nfs/dbraw/zinc/65/46/14/1111654614.db2.gz IVBLPQMMPUIAHL-UHFFFAOYSA-N 2 0 355.551 4.248 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000552338234 1111678848 /nfs/dbraw/zinc/67/88/48/1111678848.db2.gz BSSSJJRBSPYJSX-RCCFBDPRSA-N 2 0 352.444 4.219 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479074764 1111944725 /nfs/dbraw/zinc/94/47/25/1111944725.db2.gz ARQABWJQIAIKJG-GOSISDBHSA-N 2 0 369.322 4.361 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccc(Br)cc2)C1 ZINC000479290016 1111986558 /nfs/dbraw/zinc/98/65/58/1111986558.db2.gz XFGXJRFNDLCHCK-NVXWUHKLSA-N 2 0 353.348 4.090 20 0 FIADRP CC[N@H+](CCNc1cc[nH+]c2cc(F)c(OC)cc12)CCC(F)(F)F ZINC000479329878 1111993901 /nfs/dbraw/zinc/99/39/01/1111993901.db2.gz ZNXHSQUQASKYGS-UHFFFAOYSA-N 2 0 359.367 4.069 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3nn(C)cc32)C1 ZINC000479344001 1112001312 /nfs/dbraw/zinc/00/13/12/1112001312.db2.gz KYHIBPPZMGFDMP-SVMVAKDDSA-N 2 0 366.553 4.065 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCc3nn(C)cc32)C1 ZINC000479343999 1112001414 /nfs/dbraw/zinc/00/14/14/1112001414.db2.gz KYHIBPPZMGFDMP-JBYIUTFZSA-N 2 0 366.553 4.065 20 0 FIADRP CC1(C)C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cc(Br)ccc21 ZINC000479367203 1112002027 /nfs/dbraw/zinc/00/20/27/1112002027.db2.gz WEEBUOHCQHLBOQ-ACJLOTCBSA-N 2 0 363.343 4.245 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H](C[C@H]3CCOC3)c3ccccc3)C2)cc1 ZINC000479462538 1112032975 /nfs/dbraw/zinc/03/29/75/1112032975.db2.gz GHJDIKSZNREOAQ-CQOQZXRMSA-N 2 0 364.533 4.266 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000479463035 1112033258 /nfs/dbraw/zinc/03/32/58/1112033258.db2.gz HUWVMKYEFSKFQQ-TZIWHRDSSA-N 2 0 366.505 4.021 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000479463552 1112033621 /nfs/dbraw/zinc/03/36/21/1112033621.db2.gz IPRVUYDLNSKAJR-HKUYNNGSSA-N 2 0 355.501 4.064 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000479465600 1112034817 /nfs/dbraw/zinc/03/48/17/1112034817.db2.gz KYAJUDQNPHRNPM-KSFYIVLOSA-N 2 0 356.485 4.494 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@H](C)C1 ZINC000479535723 1112060130 /nfs/dbraw/zinc/06/01/30/1112060130.db2.gz IUBNQSUBOMGGHZ-KRZXBLKESA-N 2 0 364.961 4.313 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000479551981 1112068506 /nfs/dbraw/zinc/06/85/06/1112068506.db2.gz ARZQDXWJLMHJHT-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000479739089 1112126290 /nfs/dbraw/zinc/12/62/90/1112126290.db2.gz FXSDFXVEPCGBNN-IRXDYDNUSA-N 2 0 360.521 4.481 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000479739076 1112126474 /nfs/dbraw/zinc/12/64/74/1112126474.db2.gz FXSDFXVEPCGBNN-DLBZAZTESA-N 2 0 360.521 4.481 20 0 FIADRP COc1cc([C@@H](C)NCc2ccccc2C[NH+]2CCCCC2)c(F)cn1 ZINC000554047829 1112174153 /nfs/dbraw/zinc/17/41/53/1112174153.db2.gz IZFNOGIXEHPUTA-MRXNPFEDSA-N 2 0 357.473 4.066 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000479899911 1112181268 /nfs/dbraw/zinc/18/12/68/1112181268.db2.gz HFJXRRPMMDWMGV-OAQYLSRUSA-N 2 0 358.913 4.413 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)cn1 ZINC000480162460 1112309459 /nfs/dbraw/zinc/30/94/59/1112309459.db2.gz BRJDGEWZYXAQGN-BRWVUGGUSA-N 2 0 373.928 4.195 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCO[C@H](C(F)(F)F)C2)C1 ZINC000554349382 1112311343 /nfs/dbraw/zinc/31/13/43/1112311343.db2.gz KTWBMRTYDJJZOM-MNEFBYGVSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000480166099 1112312751 /nfs/dbraw/zinc/31/27/51/1112312751.db2.gz BDQHXFVNQVNCCJ-KRWDZBQOSA-N 2 0 373.928 4.103 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CC[C@@H]2C(C)(C)C)c1)C1CCOCC1 ZINC000554362673 1112318175 /nfs/dbraw/zinc/31/81/75/1112318175.db2.gz XNAUFRVSKAQYJI-VXKWHMMOSA-N 2 0 374.569 4.091 20 0 FIADRP COC[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccc1 ZINC000554362551 1112318255 /nfs/dbraw/zinc/31/82/55/1112318255.db2.gz UUMQPMBPGVZBHQ-QHCPKHFHSA-N 2 0 352.522 4.396 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccsc3Cl)CC2)cc1 ZINC000480361068 1112401067 /nfs/dbraw/zinc/40/10/67/1112401067.db2.gz WQSCKHWZLSQQPE-UHFFFAOYSA-N 2 0 364.942 4.412 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000667681606 1112446391 /nfs/dbraw/zinc/44/63/91/1112446391.db2.gz MRKCQAZIJFTFAY-LJQANCHMSA-N 2 0 355.551 4.282 20 0 FIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]Cc1ccc(-n2ccnc2C)c(F)c1 ZINC000554734816 1112464148 /nfs/dbraw/zinc/46/41/48/1112464148.db2.gz QPYYNQVWQZHLIC-SFHVURJKSA-N 2 0 369.415 4.245 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1cccc(-c2ccccc2)c1)N1CC[NH+](C)CC1 ZINC000480534669 1112464734 /nfs/dbraw/zinc/46/47/34/1112464734.db2.gz DSEGDZOGYACDCQ-HYBUGGRVSA-N 2 0 365.565 4.276 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000554746823 1112474511 /nfs/dbraw/zinc/47/45/11/1112474511.db2.gz HXPNCUCZOMOGGU-UHFFFAOYSA-N 2 0 372.394 4.373 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000480610037 1112500450 /nfs/dbraw/zinc/50/04/50/1112500450.db2.gz NFSXGSVCKLNXTF-ZCNNSNEGSA-N 2 0 354.542 4.281 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)ccc1OC(F)F ZINC000480619445 1112511985 /nfs/dbraw/zinc/51/19/85/1112511985.db2.gz ULIRVCBOSZPGIU-MRXNPFEDSA-N 2 0 370.484 4.459 20 0 FIADRP c1cc(C[NH2+]Cc2ccc(OCC3CC3)cc2)cc(C[NH+]2CCCC2)c1 ZINC000480674291 1112539914 /nfs/dbraw/zinc/53/99/14/1112539914.db2.gz YACDUMBERLXCDG-UHFFFAOYSA-N 2 0 350.506 4.361 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000480691059 1112547229 /nfs/dbraw/zinc/54/72/29/1112547229.db2.gz AACFXLOMMOLILF-JOCHJYFZSA-N 2 0 366.553 4.027 20 0 FIADRP CCC[N@H+](C)[C@H](CNC(=O)Nc1cccc(C[NH3+])c1)c1ccc(Cl)cc1 ZINC000667733359 1112564450 /nfs/dbraw/zinc/56/44/50/1112564450.db2.gz AURPDBLQYVJZPU-LJQANCHMSA-N 2 0 374.916 4.003 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000480714987 1112566688 /nfs/dbraw/zinc/56/66/88/1112566688.db2.gz RMEUQMSSNWDTGN-QFIPXVFZSA-N 2 0 356.485 4.323 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000480723165 1112571328 /nfs/dbraw/zinc/57/13/28/1112571328.db2.gz RJYFKHPTYTVZRC-OAQYLSRUSA-N 2 0 356.485 4.323 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc2ccccc2c1 ZINC000480888682 1112649635 /nfs/dbraw/zinc/64/96/35/1112649635.db2.gz IRRUSFDGIUBZMR-HXUWFJFHSA-N 2 0 373.544 4.438 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000480879155 1112651643 /nfs/dbraw/zinc/65/16/43/1112651643.db2.gz GTSJJGZYQLYZKE-XLIONFOSSA-N 2 0 366.977 4.344 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Cl)cc1 ZINC000480923475 1112676312 /nfs/dbraw/zinc/67/63/12/1112676312.db2.gz ZXSZTMVPPVSPGM-JOCHJYFZSA-N 2 0 371.956 4.328 20 0 FIADRP CCCCc1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000481244743 1112820639 /nfs/dbraw/zinc/82/06/39/1112820639.db2.gz DKWMKMIDHMZDFM-LJQANCHMSA-N 2 0 366.553 4.027 20 0 FIADRP Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000481261161 1112834784 /nfs/dbraw/zinc/83/47/84/1112834784.db2.gz URCDIFXYUBQXPU-QFIPXVFZSA-N 2 0 366.553 4.019 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)[C@@H](C)C1 ZINC000481421641 1112937875 /nfs/dbraw/zinc/93/78/75/1112937875.db2.gz IYXVJBXQOZCBCD-KKSFZXQISA-N 2 0 357.542 4.011 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccc(F)c3)CC2)cc1 ZINC000481721430 1113054218 /nfs/dbraw/zinc/05/42/18/1113054218.db2.gz XFIKEUYUMNHAOW-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000481730095 1113057063 /nfs/dbraw/zinc/05/70/63/1113057063.db2.gz SPXMKVNDGOVTSZ-AOMKIAJQSA-N 2 0 356.485 4.179 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000481730097 1113058117 /nfs/dbraw/zinc/05/81/17/1113058117.db2.gz SPXMKVNDGOVTSZ-OPAMFIHVSA-N 2 0 356.485 4.179 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C(=O)OC)cc1 ZINC000556051162 1113127549 /nfs/dbraw/zinc/12/75/49/1113127549.db2.gz QVJLCRJJLHPDDA-QFIPXVFZSA-N 2 0 366.505 4.310 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000481943038 1113135790 /nfs/dbraw/zinc/13/57/90/1113135790.db2.gz DYASQBIGVUHUCK-ILWGZMRPSA-N 2 0 369.553 4.163 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](CCc2ccc(Cl)cc2)C(C)C)CC1 ZINC000481937666 1113140068 /nfs/dbraw/zinc/14/00/68/1113140068.db2.gz KWQFYMDDHXNQRV-NRFANRHFSA-N 2 0 366.977 4.388 20 0 FIADRP CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Br)cc1 ZINC001168366382 1113144855 /nfs/dbraw/zinc/14/48/55/1113144855.db2.gz REZUETBRCUSKNE-GOSISDBHSA-N 2 0 351.332 4.364 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc4c(c3)CCCO4)cc2)CC[N@@H+]1C ZINC000482121605 1113181820 /nfs/dbraw/zinc/18/18/20/1113181820.db2.gz DCSBZUIGEAFHPB-VGSWGCGISA-N 2 0 350.506 4.251 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(OC)c(OC)cc2F)c1 ZINC000482309658 1113221791 /nfs/dbraw/zinc/22/17/91/1113221791.db2.gz CBSVMUQJNAXIFU-OAHLLOKOSA-N 2 0 360.473 4.145 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000482321808 1113226324 /nfs/dbraw/zinc/22/63/24/1113226324.db2.gz BTGARJAHFALOQC-HSZRJFAPSA-N 2 0 352.522 4.301 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(-c2cccs2)cc1 ZINC000482361522 1113232785 /nfs/dbraw/zinc/23/27/85/1113232785.db2.gz UTZVNPDCPVMBNC-SFHVURJKSA-N 2 0 371.594 4.339 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000482438627 1113255672 /nfs/dbraw/zinc/25/56/72/1113255672.db2.gz MTPPNJBBWAZZIL-ICSRJNTNSA-N 2 0 369.528 4.107 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)OCCCO2 ZINC000162941380 1113268988 /nfs/dbraw/zinc/26/89/88/1113268988.db2.gz JQFBYTKZLRYXAV-GOSISDBHSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482532789 1113285951 /nfs/dbraw/zinc/28/59/51/1113285951.db2.gz KGUVJHKEAFFKGL-QVKFZJNVSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482548650 1113290819 /nfs/dbraw/zinc/29/08/19/1113290819.db2.gz NCMLQXAHWQQHHW-HTAPYJJXSA-N 2 0 367.512 4.306 20 0 FIADRP CCC[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482539191 1113290985 /nfs/dbraw/zinc/29/09/85/1113290985.db2.gz VTMIMBFJLQKHQD-GOSISDBHSA-N 2 0 359.341 4.129 20 0 FIADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000482554474 1113297778 /nfs/dbraw/zinc/29/77/78/1113297778.db2.gz WNXUKKZFZWITOJ-YSZBQJHXSA-N 2 0 358.570 4.194 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000482570021 1113299781 /nfs/dbraw/zinc/29/97/81/1113299781.db2.gz YLEGNSGYMSDORH-HXUWFJFHSA-N 2 0 374.525 4.135 20 0 FIADRP CC[NH+](CC)[C@@H](C(=O)Nc1cc(C[NH+](C)C)ccc1C)c1ccccc1 ZINC000482579655 1113301896 /nfs/dbraw/zinc/30/18/96/1113301896.db2.gz IFKOUSOCXAGXQE-OAQYLSRUSA-N 2 0 353.510 4.078 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482638262 1113316991 /nfs/dbraw/zinc/31/69/91/1113316991.db2.gz ZPZLQYNQPXRBIB-CVDCTZTESA-N 2 0 367.537 4.156 20 0 FIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000482873126 1113385294 /nfs/dbraw/zinc/38/52/94/1113385294.db2.gz KELPWFXHHMLAIO-NHCUHLMSSA-N 2 0 372.578 4.167 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(F)c1 ZINC000482905522 1113396638 /nfs/dbraw/zinc/39/66/38/1113396638.db2.gz UDHOHEUONZCTOI-KRWDZBQOSA-N 2 0 372.484 4.160 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1cccc(OCCCc2ccccc2)c1 ZINC000482906911 1113396664 /nfs/dbraw/zinc/39/66/64/1113396664.db2.gz WPMKRSDLBDXZNQ-YKSBVNFPSA-N 2 0 366.549 4.171 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000483219527 1113467341 /nfs/dbraw/zinc/46/73/41/1113467341.db2.gz UGCOASIGJKXVSF-JXFKEZNVSA-N 2 0 370.562 4.369 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@H]2CCCC[NH+]2C)cc1 ZINC000483276400 1113478512 /nfs/dbraw/zinc/47/85/12/1113478512.db2.gz NAAJYYYSENOOFV-GHTZIAJQSA-N 2 0 357.542 4.264 20 0 FIADRP COc1ccccc1/C=C\C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486461859 1113572630 /nfs/dbraw/zinc/57/26/30/1113572630.db2.gz PQAOILFBWFSTDI-VOLZKQTNSA-N 2 0 350.506 4.209 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(-c2cnn(C)c2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486489868 1113577213 /nfs/dbraw/zinc/57/72/13/1113577213.db2.gz PFPCJMJRTUMCPP-CVDCTZTESA-N 2 0 374.532 4.087 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486708758 1113627229 /nfs/dbraw/zinc/62/72/29/1113627229.db2.gz KHDXSYZFXXNAEB-IERDGZPVSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000486717113 1113628191 /nfs/dbraw/zinc/62/81/91/1113628191.db2.gz MZQHMMYSCUNQFB-OXQOHEQNSA-N 2 0 351.469 4.450 20 0 FIADRP Clc1ccsc1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000486935661 1113683825 /nfs/dbraw/zinc/68/38/25/1113683825.db2.gz LTCOJEYPSAGWLV-UHFFFAOYSA-N 2 0 363.958 4.094 20 0 FIADRP CCOc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1F ZINC000486970744 1113686394 /nfs/dbraw/zinc/68/63/94/1113686394.db2.gz NWJJDKSASCDHED-UHFFFAOYSA-N 2 0 362.514 4.288 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000488071764 1113850255 /nfs/dbraw/zinc/85/02/55/1113850255.db2.gz HOZCOSPXFATLIQ-VSKRKVRLSA-N 2 0 354.538 4.110 20 0 FIADRP c1cc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000488089566 1113852856 /nfs/dbraw/zinc/85/28/56/1113852856.db2.gz POVPIMNVMKTXSM-YPAWHYETSA-N 2 0 354.538 4.110 20 0 FIADRP Cc1cc2oc(=O)cc(CN3CC[C@H](C[NH+]4CCCC4)C3)c2cc1C(C)C ZINC000150766329 1114112085 /nfs/dbraw/zinc/11/20/85/1114112085.db2.gz ZEIGGPBBMNYTCA-GOSISDBHSA-N 2 0 368.521 4.143 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)c(F)c2)C1 ZINC000489524338 1114124178 /nfs/dbraw/zinc/12/41/78/1114124178.db2.gz VCLGGPAQBCGLGD-KBPBESRZSA-N 2 0 357.311 4.359 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(Br)c1 ZINC000570603872 1114201495 /nfs/dbraw/zinc/20/14/95/1114201495.db2.gz ITDKCSWKNDAWMG-UHFFFAOYSA-N 2 0 369.347 4.010 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc(-c3ccc(C[NH+]4CCCC4)cc3)n2)cc1 ZINC000490301052 1114264408 /nfs/dbraw/zinc/26/44/08/1114264408.db2.gz RXAASDZWLTWYAS-UHFFFAOYSA-N 2 0 362.477 4.061 20 0 FIADRP Cc1ccc(-c2noc([C@@H](N)CCCC[NH2+]C(C)C)n2)c(C(F)(F)F)c1 ZINC001212145019 1114416804 /nfs/dbraw/zinc/41/68/04/1114416804.db2.gz JLXJPSXBXHHCGH-HNNXBMFYSA-N 2 0 370.419 4.232 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000571006382 1114427788 /nfs/dbraw/zinc/42/77/88/1114427788.db2.gz ROBYWWQJAMIWCM-QXAHSBQVSA-N 2 0 356.460 4.323 20 0 FIADRP CCCCC/C(=C/c1ccccc1)C[NH2+]CC(C)(C)N1CC[NH+](C)CC1 ZINC000588177665 1114549206 /nfs/dbraw/zinc/54/92/06/1114549206.db2.gz UXEIWVWUKMPMJJ-PYCFMQQDSA-N 2 0 357.586 4.266 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(N2CCCC2=O)cc1 ZINC000156788399 1114564294 /nfs/dbraw/zinc/56/42/94/1114564294.db2.gz VHENBCIBCYLWPG-SFHVURJKSA-N 2 0 369.553 4.261 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(Br)cc2F)CC1 ZINC000589836476 1114847206 /nfs/dbraw/zinc/84/72/06/1114847206.db2.gz KJNSRLLYWZJFSR-UHFFFAOYSA-N 2 0 357.311 4.190 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000589836841 1114847488 /nfs/dbraw/zinc/84/74/88/1114847488.db2.gz DDTKJGNEZIZSJI-UHFFFAOYSA-N 2 0 368.344 4.004 20 0 FIADRP C[NH+]1CCC2(CC1)CN([C@@H](c1ccccc1)c1ccc(Cl)cc1)CCO2 ZINC000646103474 1114968145 /nfs/dbraw/zinc/96/81/45/1114968145.db2.gz VMRQDHQZKWCAEF-NRFANRHFSA-N 2 0 370.924 4.226 20 0 FIADRP FC(F)(F)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000573034441 1115002297 /nfs/dbraw/zinc/00/22/97/1115002297.db2.gz WJJGRLVCUCEBCE-MOPGFXCFSA-N 2 0 370.459 4.262 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001168400310 1115033249 /nfs/dbraw/zinc/03/32/49/1115033249.db2.gz MBNUCMNKLJMXPA-XQUALCHDSA-N 2 0 364.508 4.468 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000591708114 1115125556 /nfs/dbraw/zinc/12/55/56/1115125556.db2.gz OOXIZHZFYDHJGT-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP C[C@H](C[NH2+]CC1(N2CCCC2)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000574081822 1115285244 /nfs/dbraw/zinc/28/52/44/1115285244.db2.gz NHAAQJIDXVYRNV-MRXNPFEDSA-N 2 0 370.459 4.044 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CCc2ccc(F)cc2F)[C@@H](C)C1 ZINC000574062424 1115288375 /nfs/dbraw/zinc/28/83/75/1115288375.db2.gz TZZIUVHSOJESPB-FIKGOQFSSA-N 2 0 368.512 4.013 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)cc1C[NH+]1CCCCC1 ZINC000157768407 1115293456 /nfs/dbraw/zinc/29/34/56/1115293456.db2.gz ABXCCODDBOCTJK-HYVJGQCMSA-N 2 0 372.553 4.289 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)ccc1OC ZINC000157829902 1115345219 /nfs/dbraw/zinc/34/52/19/1115345219.db2.gz NTJCSGYYZFJXKY-BUKVSMQUSA-N 2 0 360.542 4.145 20 0 FIADRP Cc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000574395583 1115359780 /nfs/dbraw/zinc/35/97/80/1115359780.db2.gz CGXZRMMUEPSFGC-LAUBAEHRSA-N 2 0 351.494 4.008 20 0 FIADRP FC(F)(F)[C@@H]1CC[NH+](CCCCCC[N@H+]2CC[C@@H](C(F)(F)F)C2)C1 ZINC000761049515 1115405029 /nfs/dbraw/zinc/40/50/29/1115405029.db2.gz HWYYWNKAPHDNIB-ZIAGYGMSSA-N 2 0 360.386 4.315 20 0 FIADRP C[N@@H+]1CC[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C[C@H]1c1ccccc1 ZINC000574624089 1115429927 /nfs/dbraw/zinc/42/99/27/1115429927.db2.gz HOQPEPGMJRQEHT-GGAORHGYSA-N 2 0 355.570 4.209 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(Br)cn1 ZINC000574811641 1115496919 /nfs/dbraw/zinc/49/69/19/1115496919.db2.gz LSQUIZZYCPZDLZ-GJZGRUSLSA-N 2 0 354.336 4.007 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](Cc2ccccc2Cl)C2CC2)C[C@@H](C)O1 ZINC000575110139 1115546337 /nfs/dbraw/zinc/54/63/37/1115546337.db2.gz RETBSCKXQAFOQG-LZJOCLMNSA-N 2 0 364.961 4.140 20 0 FIADRP COc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000669613143 1115664702 /nfs/dbraw/zinc/66/47/02/1115664702.db2.gz PZILLZPCWFNGTK-JOCHJYFZSA-N 2 0 350.506 4.458 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000669614185 1115665869 /nfs/dbraw/zinc/66/58/69/1115665869.db2.gz CTEQNYKJCMBZHJ-VQTJNVASSA-N 2 0 359.517 4.137 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000669614184 1115666019 /nfs/dbraw/zinc/66/60/19/1115666019.db2.gz CTEQNYKJCMBZHJ-UXHICEINSA-N 2 0 359.517 4.137 20 0 FIADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000669614550 1115668121 /nfs/dbraw/zinc/66/81/21/1115668121.db2.gz YLSRVWJVXMPCTO-NFBKMPQASA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1cccc(O)c1 ZINC000669617958 1115673047 /nfs/dbraw/zinc/67/30/47/1115673047.db2.gz MIRPLCFMBPGTRZ-HQAQVQPGSA-N 2 0 350.506 4.344 20 0 FIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc(C[NH+](CC)CC)cc2)C1 ZINC000599333839 1115808687 /nfs/dbraw/zinc/80/86/87/1115808687.db2.gz ZYJQRMNMBAWOGS-IBGZPJMESA-N 2 0 373.585 4.159 20 0 FIADRP c1ccc(C[C@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C2CC2)cc1 ZINC000605827338 1115918122 /nfs/dbraw/zinc/91/81/22/1115918122.db2.gz LHPFENHHRXETLQ-DEOSSOPVSA-N 2 0 364.533 4.272 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC[N@@H+]1C ZINC000608061483 1116079841 /nfs/dbraw/zinc/07/98/41/1116079841.db2.gz FMQIQWJMYVKTHX-LPHOPBHVSA-N 2 0 358.913 4.491 20 0 FIADRP Cc1nc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c(C)s1 ZINC000534229672 1116170995 /nfs/dbraw/zinc/17/09/95/1116170995.db2.gz HVXYJFUWSQIARA-UHFFFAOYSA-N 2 0 355.551 4.248 20 0 FIADRP C[N@H+](CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)Cc1ccccc1 ZINC000534354020 1116188133 /nfs/dbraw/zinc/18/81/33/1116188133.db2.gz XCCIWSHIFYVRDX-JTHBVZDNSA-N 2 0 352.522 4.266 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000534453971 1116200738 /nfs/dbraw/zinc/20/07/38/1116200738.db2.gz ZLUBOOUXWXXLBY-UHFFFAOYSA-N 2 0 356.558 4.385 20 0 FIADRP CCC[C@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000535230303 1116283288 /nfs/dbraw/zinc/28/32/88/1116283288.db2.gz RAIXMFMWPZLXTL-IBGZPJMESA-N 2 0 372.384 4.452 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(c2)ncn3C)CC1 ZINC000539405570 1116331982 /nfs/dbraw/zinc/33/19/82/1116331982.db2.gz CYFXCLGKMPSVNH-GOSISDBHSA-N 2 0 354.542 4.050 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)[C@@H](C)C1 ZINC000539835170 1116388928 /nfs/dbraw/zinc/38/89/28/1116388928.db2.gz HSUCKNYYWSUSRN-YCRPNKLZSA-N 2 0 374.960 4.305 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)o1 ZINC000539852542 1116392998 /nfs/dbraw/zinc/39/29/98/1116392998.db2.gz VWRIFGKUEMOFDA-UHFFFAOYSA-N 2 0 356.514 4.066 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(C3CCCC3)cc2)CC1 ZINC000462783465 1117765566 /nfs/dbraw/zinc/76/55/66/1117765566.db2.gz PDUHEJFDBSNCTO-DHIUTWEWSA-N 2 0 356.554 4.202 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@@](C)(O)C2CC2)c2ccc(F)cc2)CC1 ZINC000462815470 1117793356 /nfs/dbraw/zinc/79/33/56/1117793356.db2.gz HYZFZBXGEPJNHE-FGZHOGPDSA-N 2 0 362.533 4.130 20 0 FIADRP COc1ccc([C@H](OC)[C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)cc1 ZINC000540146664 1117898068 /nfs/dbraw/zinc/89/80/68/1117898068.db2.gz KDFSLKKXKXWJIL-ZVEOBBNSSA-N 2 0 374.569 4.404 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000540136992 1117900380 /nfs/dbraw/zinc/90/03/80/1117900380.db2.gz COYFFVYXDSICKS-WENLIBGGSA-N 2 0 356.554 4.397 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000540187652 1117919556 /nfs/dbraw/zinc/91/95/56/1117919556.db2.gz ACOUACQUFFSGKS-LJQANCHMSA-N 2 0 357.567 4.310 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000540262759 1117962947 /nfs/dbraw/zinc/96/29/47/1117962947.db2.gz HTPBALLKZWMMTA-XMMPIXPASA-N 2 0 363.549 4.065 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000463109394 1117967842 /nfs/dbraw/zinc/96/78/42/1117967842.db2.gz QWNKVUACQVMJGM-OAQYLSRUSA-N 2 0 368.569 4.323 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C[C@H](C)O1 ZINC000540320795 1117983446 /nfs/dbraw/zinc/98/34/46/1117983446.db2.gz NBCVVPQVYKWUJS-YRNRMSPPSA-N 2 0 350.934 4.270 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2c3cc(Br)ccc3SC[C@@H]2C)C1 ZINC000540409273 1118037417 /nfs/dbraw/zinc/03/74/17/1118037417.db2.gz UZFOLHSJSAKFIN-OGHNNQOOSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@@H]1C[C@H](N[C@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463279886 1118067095 /nfs/dbraw/zinc/06/70/95/1118067095.db2.gz KIIMKFKCLGHTJJ-OUJCMCIWSA-N 2 0 363.549 4.075 20 0 FIADRP Cn1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(-c2cccs2)n1 ZINC000540504326 1118104284 /nfs/dbraw/zinc/10/42/84/1118104284.db2.gz CTTRVNURLMNTDS-UHFFFAOYSA-N 2 0 372.582 4.237 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000540748029 1118231754 /nfs/dbraw/zinc/23/17/54/1118231754.db2.gz NWCVFWRBRLCMEX-CVDCTZTESA-N 2 0 351.538 4.379 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](CC2CCC2)c2ccccc2)C1 ZINC000540988115 1118340033 /nfs/dbraw/zinc/34/00/33/1118340033.db2.gz GKEMNGJJZGSXCX-BJKOFHAPSA-N 2 0 364.533 4.274 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000540990145 1118340978 /nfs/dbraw/zinc/34/09/78/1118340978.db2.gz DOHYCVOUZAJYIY-DVECYGJZSA-N 2 0 366.549 4.447 20 0 FIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000540992370 1118342030 /nfs/dbraw/zinc/34/20/30/1118342030.db2.gz VTPMGSYITYDTFY-UGKGYDQZSA-N 2 0 352.522 4.111 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)CC2)c1 ZINC000464073781 1118431971 /nfs/dbraw/zinc/43/19/71/1118431971.db2.gz JKOCYOXZVMMEOE-VAMGGRTRSA-N 2 0 362.583 4.145 20 0 FIADRP COC1CCN(C(C)(C)C[NH2+]C2CC(c3cccc(Cl)c3)C2)CC1 ZINC000541249189 1118445924 /nfs/dbraw/zinc/44/59/24/1118445924.db2.gz JNJSAVAGPWZHIB-UHFFFAOYSA-N 2 0 350.934 4.065 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000541550833 1118559372 /nfs/dbraw/zinc/55/93/72/1118559372.db2.gz OKVPOPYEPXLORB-QFIPXVFZSA-N 2 0 355.501 4.412 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000541550832 1118559512 /nfs/dbraw/zinc/55/95/12/1118559512.db2.gz OKVPOPYEPXLORB-JOCHJYFZSA-N 2 0 355.501 4.412 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000541914737 1118699211 /nfs/dbraw/zinc/69/92/11/1118699211.db2.gz IXBJQEQHXFUOIN-GQIGUUNPSA-N 2 0 354.485 4.141 20 0 FIADRP C[N@@H+](CCc1cccc(F)c1F)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000542256949 1118871110 /nfs/dbraw/zinc/87/11/10/1118871110.db2.gz CRIOGTVPAVWEBI-UHFFFAOYSA-N 2 0 359.464 4.141 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Br)C[C@@H]1C ZINC000542279467 1118879543 /nfs/dbraw/zinc/87/95/43/1118879543.db2.gz XWBWSVOORDZIFE-DOTOQJQBSA-N 2 0 353.348 4.186 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc4c(c3)CCCC4)cc2)CC1 ZINC000491389177 1118941526 /nfs/dbraw/zinc/94/15/26/1118941526.db2.gz MOYBWNRGDSKXJI-UHFFFAOYSA-N 2 0 364.533 4.328 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000173364847 1119035770 /nfs/dbraw/zinc/03/57/70/1119035770.db2.gz WGRKDADGUTWAOT-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000311072870 1119357097 /nfs/dbraw/zinc/35/70/97/1119357097.db2.gz KLIAHLOXIYVSHG-APWZRJJASA-N 2 0 358.913 4.349 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000178117230 1119372505 /nfs/dbraw/zinc/37/25/05/1119372505.db2.gz IVXNCBWEANWBPH-BZSNNMDCSA-N 2 0 354.542 4.057 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3sc(C)nc3C)CC2)cc1 ZINC000178157246 1119374225 /nfs/dbraw/zinc/37/42/25/1119374225.db2.gz QPSSRPMNACQUJB-OAHLLOKOSA-N 2 0 373.566 4.331 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCc2cccc(OCc3ccccc3)c2)CC1 ZINC000311481508 1119376036 /nfs/dbraw/zinc/37/60/36/1119376036.db2.gz HWRCRKBQOMCWIK-UHFFFAOYSA-N 2 0 352.522 4.272 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000178281715 1119382027 /nfs/dbraw/zinc/38/20/27/1119382027.db2.gz MUEGPOZSDBQLTH-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP Fc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1C(F)(F)F ZINC000311803564 1119389926 /nfs/dbraw/zinc/38/99/26/1119389926.db2.gz NXBDADUTKBHUEY-QGZVFWFLSA-N 2 0 366.402 4.456 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1ccc(OCc2ccccc2)cc1 ZINC000311821914 1119390787 /nfs/dbraw/zinc/39/07/87/1119390787.db2.gz QOIJKFPAGQKHEI-MSYCTHLASA-N 2 0 352.522 4.126 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccnn1-c1ccccc1 ZINC000467311243 1119407339 /nfs/dbraw/zinc/40/73/39/1119407339.db2.gz OEVAPBJOZGSQTP-LJQANCHMSA-N 2 0 360.505 4.319 20 0 FIADRP COc1ccc2cc(C[N@H+](C)Cc3cn(-c4cc[nH+]cc4)nc3C)ccc2c1 ZINC000542466442 1119451219 /nfs/dbraw/zinc/45/12/19/1119451219.db2.gz KDNHRSZNOWSVCH-UHFFFAOYSA-N 2 0 372.472 4.370 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]CCC1CC[NH+](C)CC1)CC2 ZINC000493936270 1119511555 /nfs/dbraw/zinc/51/15/55/1119511555.db2.gz KJFYBGNHBJLGJU-QGZVFWFLSA-N 2 0 351.332 4.066 20 0 FIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000493978388 1119523107 /nfs/dbraw/zinc/52/31/07/1119523107.db2.gz SCVLUNVIKASOER-AUSIDOKSSA-N 2 0 368.521 4.027 20 0 FIADRP CCCc1csc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000494177104 1119551394 /nfs/dbraw/zinc/55/13/94/1119551394.db2.gz UNCODCHYXALAQJ-PKOBYXMFSA-N 2 0 357.567 4.486 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000183155286 1119567280 /nfs/dbraw/zinc/56/72/80/1119567280.db2.gz GSSAIRGZWAVIIX-YPVJZLTNSA-N 2 0 367.537 4.285 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2c(c1)CCCO2 ZINC000153004370 1119821982 /nfs/dbraw/zinc/82/19/82/1119821982.db2.gz WSSFIVRBWVBXLJ-JOCHJYFZSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3F)CC2)C1 ZINC000542484738 1119904810 /nfs/dbraw/zinc/90/48/10/1119904810.db2.gz RXKFHUZGCULSHU-WMLDXEAASA-N 2 0 354.460 4.279 20 0 FIADRP Cc1cnn(CCCCC[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000189949120 1119922037 /nfs/dbraw/zinc/92/20/37/1119922037.db2.gz XPAPQNFTGUMDSW-NHCUHLMSSA-N 2 0 368.569 4.108 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCS2 ZINC000191547258 1119983359 /nfs/dbraw/zinc/98/33/59/1119983359.db2.gz JPOVLYGLMQDKSX-TWOQFEAHSA-N 2 0 360.567 4.475 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)CC1 ZINC000191571197 1119985094 /nfs/dbraw/zinc/98/50/94/1119985094.db2.gz ABTDOMDKHDNJSH-HSZRJFAPSA-N 2 0 368.569 4.111 20 0 FIADRP CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000192727647 1120078801 /nfs/dbraw/zinc/07/88/01/1120078801.db2.gz JZJUYAZFAHHKKK-DHIUTWEWSA-N 2 0 357.586 4.061 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000192918018 1120090744 /nfs/dbraw/zinc/09/07/44/1120090744.db2.gz LOGYDZLGZSKIOM-LJQANCHMSA-N 2 0 356.535 4.029 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000192935405 1120091476 /nfs/dbraw/zinc/09/14/76/1120091476.db2.gz JHHSCCURISSMBP-SFLYRZDNSA-N 2 0 369.597 4.141 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2cnc(-c3ccco3)s2)cc1 ZINC000193082971 1120099020 /nfs/dbraw/zinc/09/90/20/1120099020.db2.gz MPDMUZILUVHGJD-UHFFFAOYSA-N 2 0 371.506 4.023 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cnn1C(C)(C)C ZINC000195132428 1120119364 /nfs/dbraw/zinc/11/93/64/1120119364.db2.gz JRXJOOUDBYLEMS-XLIONFOSSA-N 2 0 354.542 4.119 20 0 FIADRP C[C@@H]([NH2+]CCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534264 1120435866 /nfs/dbraw/zinc/43/58/66/1120435866.db2.gz RNHNTTUBGLLMTL-IAGOWNOFSA-N 2 0 350.934 4.352 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)C1CCCC1 ZINC000495034019 1120439512 /nfs/dbraw/zinc/43/95/12/1120439512.db2.gz ZPZFPGJTPIFBHW-HSZRJFAPSA-N 2 0 367.537 4.352 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000228927307 1120454725 /nfs/dbraw/zinc/45/47/25/1120454725.db2.gz BBUSTTIOUWKNMR-IXDOHACOSA-N 2 0 350.934 4.222 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)C1CCCC1 ZINC000495080585 1120464223 /nfs/dbraw/zinc/46/42/23/1120464223.db2.gz RBSXKADDWUCJLT-XPWALMASSA-N 2 0 356.554 4.194 20 0 FIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000495261130 1120596540 /nfs/dbraw/zinc/59/65/40/1120596540.db2.gz UTUTXEBEDHZOEY-LAUBAEHRSA-N 2 0 355.913 4.093 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495443816 1120817906 /nfs/dbraw/zinc/81/79/06/1120817906.db2.gz FHZXCRXAFPTHML-RZUBCFFCSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000235482761 1120948318 /nfs/dbraw/zinc/94/83/18/1120948318.db2.gz MXZFKUMSIMGTPR-CYBMUJFWSA-N 2 0 353.348 4.279 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cc(Br)ncc1F ZINC000762736734 1120956715 /nfs/dbraw/zinc/95/67/15/1120956715.db2.gz RRFLNDBMTBEWCX-UONOGXRCSA-N 2 0 372.326 4.288 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(Cl)c2)C[C@@H](C)O1 ZINC000237412796 1120976904 /nfs/dbraw/zinc/97/69/04/1120976904.db2.gz QOSPTRDBFVITFY-IAGOWNOFSA-N 2 0 358.913 4.239 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(-c2ccccc2)s1 ZINC000542666114 1121025375 /nfs/dbraw/zinc/02/53/75/1121025375.db2.gz JKNXKKLZWXGSFE-GOSISDBHSA-N 2 0 371.594 4.339 20 0 FIADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Br)s3)s2)C1 ZINC001235750973 1121116024 /nfs/dbraw/zinc/11/60/24/1121116024.db2.gz TXXYXMRPHGSZIZ-SNVBAGLBSA-N 2 0 357.342 4.020 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1Cl ZINC000397562849 1121222296 /nfs/dbraw/zinc/22/22/96/1121222296.db2.gz YTIMCHXBQSIIER-QGZVFWFLSA-N 2 0 358.913 4.018 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc4ccccc4c3)cc2)CC1 ZINC000061070069 1121507016 /nfs/dbraw/zinc/50/70/16/1121507016.db2.gz RLPCTNJHTQSFED-UHFFFAOYSA-N 2 0 373.544 4.267 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(C)c(C)c3)CC2)cc1 ZINC000063319671 1121558980 /nfs/dbraw/zinc/55/89/80/1121558980.db2.gz XPNUDCUJXQXZMG-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP C[C@@H](C[NH2+]C1CC(c2cccc(Br)c2)C1)C[NH+]1CCCC1 ZINC000062078467 1121595815 /nfs/dbraw/zinc/59/58/15/1121595815.db2.gz BUBHXJOPBRDJSM-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@H](C[NH2+]C1CC(c2ccc(Br)cc2)C1)C[NH+]1CCCC1 ZINC000062078481 1121596867 /nfs/dbraw/zinc/59/68/67/1121596867.db2.gz CFLYYJTYMISPNV-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cc(-c3ccccc3)cs2)C[C@H](C)O1 ZINC000062252842 1121616285 /nfs/dbraw/zinc/61/62/85/1121616285.db2.gz DXMUMCUGESPYOS-ROUUACIJSA-N 2 0 358.551 4.394 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000671744588 1121649554 /nfs/dbraw/zinc/64/95/54/1121649554.db2.gz NMBVCNQCXCYIOX-WMZOPIPTSA-N 2 0 365.477 4.096 20 0 FIADRP COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000124602015 1121707416 /nfs/dbraw/zinc/70/74/16/1121707416.db2.gz AHWSGHCEMWOZDJ-FHWLQOOXSA-N 2 0 368.521 4.155 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000125183385 1121754094 /nfs/dbraw/zinc/75/40/94/1121754094.db2.gz YVNKMZIRSOTVBU-OALUTQOASA-N 2 0 354.542 4.281 20 0 FIADRP COCc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)o1 ZINC000125554012 1121790826 /nfs/dbraw/zinc/79/08/26/1121790826.db2.gz ARWHRRDEHLYNEB-ROUUACIJSA-N 2 0 356.510 4.194 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)s1 ZINC000671764911 1121815325 /nfs/dbraw/zinc/81/53/25/1121815325.db2.gz UYKYVFXNUGVICK-KBPBESRZSA-N 2 0 369.372 4.149 20 0 FIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608276 1121970576 /nfs/dbraw/zinc/97/05/76/1121970576.db2.gz CRNDTMNGIZNDQI-SIKLNZKXSA-N 2 0 360.542 4.158 20 0 FIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)s1 ZINC000126663036 1121973439 /nfs/dbraw/zinc/97/34/39/1121973439.db2.gz NJQASEZGNJWDAH-CVEARBPZSA-N 2 0 361.530 4.359 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc2ccccc2o1 ZINC000126746719 1121982685 /nfs/dbraw/zinc/98/26/85/1121982685.db2.gz XKSWOJKACAACLU-GOSISDBHSA-N 2 0 363.505 4.031 20 0 FIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000126757097 1121983160 /nfs/dbraw/zinc/98/31/60/1121983160.db2.gz IXJPMWZMOXYIEY-ROUUACIJSA-N 2 0 355.501 4.298 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000126756864 1121983203 /nfs/dbraw/zinc/98/32/03/1121983203.db2.gz IXJPMWZMOXYIEY-MSOLQXFVSA-N 2 0 355.501 4.298 20 0 FIADRP Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000126762691 1121984314 /nfs/dbraw/zinc/98/43/14/1121984314.db2.gz PNJMXWJPXFJYEV-ROUUACIJSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc(F)c3)cc2)C1 ZINC000917006229 1121999347 /nfs/dbraw/zinc/99/93/47/1121999347.db2.gz MLCUDSVNYZZXHS-IXFSTUDKSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)cc2F)cc1 ZINC000917008228 1122000696 /nfs/dbraw/zinc/00/06/96/1122000696.db2.gz HKXZEZNXUSBREA-OPAMFIHVSA-N 2 0 374.475 4.162 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cccs2)CC1 ZINC000127236568 1122067984 /nfs/dbraw/zinc/06/79/84/1122067984.db2.gz WLAYFJHSUULOBQ-HZPDHXFCSA-N 2 0 361.530 4.441 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+](Cc3ccccc3)C[C@@H](C)C[NH3+])CCO2)cc1 ZINC001168615493 1122069642 /nfs/dbraw/zinc/06/96/42/1122069642.db2.gz OFDINLDFYPIIFB-ZEYPLWLESA-N 2 0 368.521 4.012 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000127329373 1122079412 /nfs/dbraw/zinc/07/94/12/1122079412.db2.gz HOIFANMSLUSUCM-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000497387236 1122199616 /nfs/dbraw/zinc/19/96/16/1122199616.db2.gz QTELJIRKRUWCAA-HCUBDLJJSA-N 2 0 364.533 4.264 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000655825911 1122202699 /nfs/dbraw/zinc/20/26/99/1122202699.db2.gz OMBCGLXJIRNZMN-MOBUCQHHSA-N 2 0 371.912 4.022 20 0 FIADRP [NH3+]CCCCCC[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000843126775 1122256108 /nfs/dbraw/zinc/25/61/08/1122256108.db2.gz IZEKRDUBJLXGGD-UHFFFAOYSA-N 2 0 357.445 4.438 20 0 FIADRP C[C@@H]([NH2+]C1(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000497593055 1122301090 /nfs/dbraw/zinc/30/10/90/1122301090.db2.gz WNPKVYUKGWPVLX-CTNGQTDRSA-N 2 0 371.569 4.031 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000129475830 1122611071 /nfs/dbraw/zinc/61/10/71/1122611071.db2.gz BUUQGHAKIVVAQS-UHFFFAOYSA-N 2 0 354.338 4.156 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000556058721 1122628287 /nfs/dbraw/zinc/62/82/87/1122628287.db2.gz NNBDCXFKGGSJKO-SFHVURJKSA-N 2 0 357.517 4.047 20 0 FIADRP C[C@@H]1CC[N@H+](C)CCN1C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000556089802 1122643704 /nfs/dbraw/zinc/64/37/04/1122643704.db2.gz MKWVMGISOCEJHT-GOSISDBHSA-N 2 0 372.557 4.009 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(Br)cc2Cl)CC[N@@H+]1C ZINC000556228697 1122745604 /nfs/dbraw/zinc/74/56/04/1122745604.db2.gz DJEOUPBNTXESJZ-JSGCOSHPSA-N 2 0 373.766 4.452 20 0 FIADRP CC[C@@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000556408949 1122874978 /nfs/dbraw/zinc/87/49/78/1122874978.db2.gz LFHGAFRUINIVTF-FQEVSTJZSA-N 2 0 352.522 4.443 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)c1 ZINC000556589592 1122984206 /nfs/dbraw/zinc/98/42/06/1122984206.db2.gz NMPZORBQFNJLKT-HNNXBMFYSA-N 2 0 361.917 4.436 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000556590123 1122984228 /nfs/dbraw/zinc/98/42/28/1122984228.db2.gz ZESYGHSVCZZDCS-QFIPXVFZSA-N 2 0 359.602 4.298 20 0 FIADRP Cc1n[nH]cc1C1CC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000556608734 1123003040 /nfs/dbraw/zinc/00/30/40/1123003040.db2.gz NNZYBNAMFKKRJF-UHFFFAOYSA-N 2 0 354.542 4.056 20 0 FIADRP CCC[C@H](CCO)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556871808 1123152783 /nfs/dbraw/zinc/15/27/83/1123152783.db2.gz MXXHRQKNRHDLBI-JMJGKCIBSA-N 2 0 358.570 4.066 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556890735 1123176316 /nfs/dbraw/zinc/17/63/16/1123176316.db2.gz VMCZYFFMKBSXIF-SQNIBIBYSA-N 2 0 360.542 4.316 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]CCC(=O)Nc2ccccc2)cc1 ZINC000556926412 1123228210 /nfs/dbraw/zinc/22/82/10/1123228210.db2.gz LCSAEDILSBQQJH-IBGZPJMESA-N 2 0 365.521 4.179 20 0 FIADRP C[N@H+](CCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1)C1CCCCC1 ZINC000499141161 1123282538 /nfs/dbraw/zinc/28/25/38/1123282538.db2.gz ZIBUREWRPJOVML-MUSUJDOFSA-N 2 0 355.570 4.036 20 0 FIADRP Fc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1F ZINC000499218920 1123333910 /nfs/dbraw/zinc/33/39/10/1123333910.db2.gz ZIZCTOMDVNGEJX-ACDBMABISA-N 2 0 356.460 4.293 20 0 FIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1cccc(F)c1 ZINC000499232946 1123341540 /nfs/dbraw/zinc/34/15/40/1123341540.db2.gz ZFUNUWZLYUSKAJ-MVWVFHAYSA-N 2 0 368.496 4.378 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1cccc(F)c1 ZINC000499232944 1123341635 /nfs/dbraw/zinc/34/16/35/1123341635.db2.gz ZFUNUWZLYUSKAJ-CIQXWFTPSA-N 2 0 368.496 4.378 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000237075225 1123593325 /nfs/dbraw/zinc/59/33/25/1123593325.db2.gz UJSPUORPKSDQAI-FQEVSTJZSA-N 2 0 374.532 4.279 20 0 FIADRP Cc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000237767039 1123655816 /nfs/dbraw/zinc/65/58/16/1123655816.db2.gz ORVZNBSRHRZAKU-UHFFFAOYSA-N 2 0 370.512 4.295 20 0 FIADRP c1ccc(COc2cccc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)c2)cc1 ZINC000245618296 1124145790 /nfs/dbraw/zinc/14/57/90/1124145790.db2.gz VZJVCWSIMCLKNG-VXKWHMMOSA-N 2 0 350.506 4.025 20 0 FIADRP Cc1cc(Br)cc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236458102 1124183536 /nfs/dbraw/zinc/18/35/36/1124183536.db2.gz UJRZWZIBRIVUNZ-UHFFFAOYSA-N 2 0 353.348 4.358 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2[C@@H]4CCO[C@H]4C24CCCC4)C3)cc1 ZINC000245695095 1124204072 /nfs/dbraw/zinc/20/40/72/1124204072.db2.gz KYRYLTQLEWPNSF-BRXKOZLESA-N 2 0 366.549 4.119 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ncc(Br)s1 ZINC000245696300 1124205324 /nfs/dbraw/zinc/20/53/24/1124205324.db2.gz VPFAMMABDYGWGD-MGPQQGTHSA-N 2 0 374.392 4.314 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245750751 1124238835 /nfs/dbraw/zinc/23/88/35/1124238835.db2.gz TZHHCWDQVWYPKN-TWDDROGUSA-N 3 0 369.597 4.284 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000180130814 1124239315 /nfs/dbraw/zinc/23/93/15/1124239315.db2.gz ZCCGVRSWTPZUOB-LMDPOFIKSA-N 2 0 367.578 4.067 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245756036 1124241296 /nfs/dbraw/zinc/24/12/96/1124241296.db2.gz UWDSUTWGZVLODV-BKFWDETESA-N 3 0 363.549 4.033 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CN[C@H](c3nccn3C)C3CC3)cc2)C1 ZINC000245843372 1124260900 /nfs/dbraw/zinc/26/09/00/1124260900.db2.gz DEJQXSYCYXFPDL-HMFYCAOWSA-N 2 0 366.553 4.139 20 0 FIADRP CCCO[C@@H]1CCC[NH+](C/C=C/C[N@H+]2CCC[C@H](OCCC)CC2)CC1 ZINC000108392868 1124306659 /nfs/dbraw/zinc/30/66/59/1124306659.db2.gz YJVXXAKTHGWQHL-WKEQBZBWSA-N 2 0 366.590 4.105 20 0 FIADRP CSC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000542847265 1124446353 /nfs/dbraw/zinc/44/63/53/1124446353.db2.gz UQQKIGMFFYYYHX-INIZCTEOSA-N 2 0 360.489 4.431 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000246346868 1124460787 /nfs/dbraw/zinc/46/07/87/1124460787.db2.gz HHWHUUWGPOANML-ZOCIIQOWSA-N 2 0 370.459 4.124 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cc(C)c(C)cc3C)cc2)CC1 ZINC000642627043 1124531317 /nfs/dbraw/zinc/53/13/17/1124531317.db2.gz KCQZLBNJJGUBCX-UHFFFAOYSA-N 2 0 365.565 4.039 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCCO1)c1cccc(OCC[NH+](C)C)c1 ZINC000246920116 1124573268 /nfs/dbraw/zinc/57/32/68/1124573268.db2.gz GHRWQBKWOVDVOU-NMNUPHIUSA-N 2 0 368.521 4.198 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000247234225 1124601603 /nfs/dbraw/zinc/60/16/03/1124601603.db2.gz YMSLOHIVUGIMOA-YOEHRIQHSA-N 2 0 359.514 4.258 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cccc(N2CCCC2=O)c1 ZINC000247253374 1124612078 /nfs/dbraw/zinc/61/20/78/1124612078.db2.gz ZVCMAMCQXWQRRT-RBUKOAKNSA-N 2 0 357.542 4.119 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)c(F)c2)[C@H](C)C1 ZINC000247969033 1124734856 /nfs/dbraw/zinc/73/48/56/1124734856.db2.gz HBUJSOUOFGADAX-MDZRGWNJSA-N 2 0 368.562 4.335 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248396051 1124760286 /nfs/dbraw/zinc/76/02/86/1124760286.db2.gz GSSAIRGZWAVIIX-XUFNMVPLSA-N 2 0 367.537 4.285 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248402541 1124762784 /nfs/dbraw/zinc/76/27/84/1124762784.db2.gz NHPKBHIHABRBKT-WFXMLNOXSA-N 2 0 366.553 4.484 20 0 FIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168678346 1124769127 /nfs/dbraw/zinc/76/91/27/1124769127.db2.gz VOIGMRFGKOYVKD-UNMCSNQZSA-N 2 0 360.542 4.112 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1C ZINC000248460357 1124774300 /nfs/dbraw/zinc/77/43/00/1124774300.db2.gz WHTKISJGPBSYRS-XXBNENTESA-N 2 0 352.522 4.111 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000249579461 1124866825 /nfs/dbraw/zinc/86/68/25/1124866825.db2.gz NBECPCHCXZEEEX-XLIONFOSSA-N 2 0 370.562 4.216 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000089214799 1124891218 /nfs/dbraw/zinc/89/12/18/1124891218.db2.gz XOQMUGXIMRWAKQ-LJQANCHMSA-N 2 0 357.498 4.264 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000089520319 1124913644 /nfs/dbraw/zinc/91/36/44/1124913644.db2.gz PRTDLILWIIORCH-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cnn1-c1ccccc1 ZINC000765953810 1124980295 /nfs/dbraw/zinc/98/02/95/1124980295.db2.gz JKDGXHNYZRLGKD-IBGZPJMESA-N 2 0 354.542 4.488 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1 ZINC000090524992 1125000996 /nfs/dbraw/zinc/00/09/96/1125000996.db2.gz UPIIHTRZCIDING-KYNGSXCRSA-N 2 0 370.459 4.124 20 0 FIADRP CC(C)COc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000090523879 1125001489 /nfs/dbraw/zinc/00/14/89/1125001489.db2.gz DAWHEUAAUNYBGT-NMNUPHIUSA-N 2 0 374.569 4.140 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1 ZINC000090523411 1125001591 /nfs/dbraw/zinc/00/15/91/1125001591.db2.gz ZCWIYFCUWCZROR-UFYCRDLUSA-N 2 0 350.934 4.149 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000090775328 1125020182 /nfs/dbraw/zinc/02/01/82/1125020182.db2.gz YXYIDIOMQNZEHJ-RYHLMMNBSA-N 2 0 357.542 4.339 20 0 FIADRP CC(C)[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091367564 1125068703 /nfs/dbraw/zinc/06/87/03/1125068703.db2.gz VIXBHZDTAFIHEA-IBGZPJMESA-N 2 0 371.491 4.018 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1 ZINC000618466322 1125186498 /nfs/dbraw/zinc/18/64/98/1125186498.db2.gz RCHSSKJISGDEBF-HXUWFJFHSA-N 2 0 374.532 4.279 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)OCO3)ccc1OC ZINC000182192333 1125284796 /nfs/dbraw/zinc/28/47/96/1125284796.db2.gz NKPKJHXETLVMEO-INIZCTEOSA-N 2 0 370.493 4.117 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2)cc1C[NH+]1CCCCC1 ZINC000182202418 1125287885 /nfs/dbraw/zinc/28/78/85/1125287885.db2.gz ZISFSSTZXPVSPW-GCJKJVERSA-N 2 0 368.521 4.065 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(C)c(F)c2)c1 ZINC000615324055 1125295839 /nfs/dbraw/zinc/29/58/39/1125295839.db2.gz AOYGHONUWYVICP-KRWDZBQOSA-N 2 0 371.500 4.093 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(C)ccc1OC ZINC000093399079 1125318391 /nfs/dbraw/zinc/31/83/91/1125318391.db2.gz DTQKZWFTWKVCKH-OAQYLSRUSA-N 2 0 356.510 4.185 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCCCC1CCOCC1 ZINC000499625401 1125389447 /nfs/dbraw/zinc/38/94/47/1125389447.db2.gz LRZDVKRFYSSHHA-WOJBJXKFSA-N 2 0 358.570 4.330 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccnc5ccccc45)C[C@@H]3C2)cc1 ZINC000312643737 1125438957 /nfs/dbraw/zinc/43/89/57/1125438957.db2.gz INSGGPVNAFWPMT-IRLDBZIGSA-N 2 0 357.501 4.189 20 0 FIADRP C(=C/C[N@@H+]1CCC=C(c2ccco2)C1)\C[NH+]1CCC=C(c2ccco2)C1 ZINC000511145362 370687463 /nfs/dbraw/zinc/68/74/63/370687463.db2.gz VMTDARFAMUKKMC-OWOJBTEDSA-N 2 0 350.462 4.307 20 0 FIADRP CCCCC/C(=C/c1ccccc1)C[NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000602278692 567962731 /nfs/dbraw/zinc/96/27/31/567962731.db2.gz YDFYQMURUWZTKU-NMFWXREBSA-N 2 0 369.597 4.408 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ncc(Br)cc1F ZINC000186902554 568007399 /nfs/dbraw/zinc/00/73/99/568007399.db2.gz FCIQNNPWHQDOSJ-CHWSQXEVSA-N 2 0 360.315 4.144 20 0 FIADRP CC(C)[N@H+](C)CC1CCN(C(=O)c2cccc(Oc3ccncc3)c2)CC1 ZINC000602754868 568031255 /nfs/dbraw/zinc/03/12/55/568031255.db2.gz ZEGGFVIJKQIQOD-UHFFFAOYSA-N 2 0 367.493 4.066 20 0 FIADRP CC(C)(C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)Oc1ccccc1 ZINC000604079215 568208508 /nfs/dbraw/zinc/20/85/08/568208508.db2.gz APZYYVMEMCXYJS-UHFFFAOYSA-N 2 0 368.521 4.108 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCN[C@@H]1CC[NH+](Cc2ccccc2)C2(CC2)C1 ZINC000563120066 568224891 /nfs/dbraw/zinc/22/48/91/568224891.db2.gz QNZOPSGHSADHDO-IFMALSPDSA-N 2 0 355.570 4.038 20 0 FIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@@H]2CC[NH+]2CCCC2)nc1 ZINC001165049187 721978176 /nfs/dbraw/zinc/97/81/76/721978176.db2.gz ICDNWORHQYDHTF-YADHBBJMSA-N 2 0 370.585 4.473 20 0 FIADRP Fc1cc(F)cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000163073539 1125513921 /nfs/dbraw/zinc/51/39/21/1125513921.db2.gz AQJHKBYNYGQBHW-UHFFFAOYSA-N 2 0 374.475 4.126 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)ccc1OC ZINC000182574652 1125572716 /nfs/dbraw/zinc/57/27/16/1125572716.db2.gz KSYDHQWNRWIWNX-MSOLQXFVSA-N 2 0 370.537 4.441 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cn(C)nc2C)cc1C[NH+]1CCCCC1 ZINC000182827881 1125641943 /nfs/dbraw/zinc/64/19/43/1125641943.db2.gz GTMMSQDOKUQJJI-IAGOWNOFSA-N 2 0 370.541 4.135 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)Cc2c(C)noc2C)ccc1OC ZINC000182998518 1125714177 /nfs/dbraw/zinc/71/41/77/1125714177.db2.gz LEFFIMZILKWXRF-HZPDHXFCSA-N 2 0 373.541 4.424 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4c3CCC4)cc2)C[C@H](C)O1 ZINC001648785905 1079577999 /nfs/dbraw/zinc/57/79/99/1079577999.db2.gz LBLOSJDIVYPRAN-OALUTQOASA-N 2 0 364.533 4.074 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)ccc1OC ZINC000183229736 1125784756 /nfs/dbraw/zinc/78/47/56/1125784756.db2.gz SHJQKSDEWKVTOY-VHHKXPHXSA-N 2 0 372.553 4.145 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000154846303 1080443168 /nfs/dbraw/zinc/44/31/68/1080443168.db2.gz MHYPMSRSUFSOSI-KRWDZBQOSA-N 2 0 353.510 4.336 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1c(C)noc1C ZINC000180180956 1080469817 /nfs/dbraw/zinc/46/98/17/1080469817.db2.gz KBAJRHXHKSEEHJ-XSDIEEQYSA-N 2 0 353.510 4.243 20 0 FIADRP CC(C)[C@@H](CN[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC001648791881 1080495818 /nfs/dbraw/zinc/49/58/18/1080495818.db2.gz CQSHYYJQVCOPJW-AKIFATBCSA-N 2 0 357.586 4.168 20 0 FIADRP COc1ccc(C[N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)c(OC)c1 ZINC001167193237 1080820753 /nfs/dbraw/zinc/82/07/53/1080820753.db2.gz UMSSIDGOVQCXLS-UHFFFAOYSA-N 2 0 368.521 4.322 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cnc2cc(C)nn2c1C ZINC000120452897 1080925986 /nfs/dbraw/zinc/92/59/86/1080925986.db2.gz OURIALDMYAUWDZ-QGZVFWFLSA-N 2 0 365.525 4.039 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547834867 1080947827 /nfs/dbraw/zinc/94/78/27/1080947827.db2.gz MLWHRUQVPJSBCJ-PXNSSMCTSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(OC(F)F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000237570089 1080975621 /nfs/dbraw/zinc/97/56/21/1080975621.db2.gz JCGOLNRAIJXZIA-QFBILLFUSA-N 2 0 360.448 4.431 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(OC(F)F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000237595463 1080976459 /nfs/dbraw/zinc/97/64/59/1080976459.db2.gz JCGOLNRAIJXZIA-VQIMIIECSA-N 2 0 360.448 4.431 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(C)c1 ZINC000137568311 1080983232 /nfs/dbraw/zinc/98/32/32/1080983232.db2.gz GYNYUCMUHSLYMX-NRFANRHFSA-N 2 0 371.569 4.281 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000655745313 1081164906 /nfs/dbraw/zinc/16/49/06/1081164906.db2.gz LOVPWDGVOWJESO-CVDCTZTESA-N 2 0 371.569 4.116 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000655803718 1081213030 /nfs/dbraw/zinc/21/30/30/1081213030.db2.gz CHGBFCHOFSHGAP-BEVDRBHNSA-N 2 0 373.338 4.468 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)C1 ZINC000655825149 1081233565 /nfs/dbraw/zinc/23/35/65/1081233565.db2.gz YKGKVHFWCMMTJX-UEDWGHLCSA-N 2 0 352.526 4.095 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)C1 ZINC000655824934 1081233695 /nfs/dbraw/zinc/23/36/95/1081233695.db2.gz QYVMGUSJQLYRSA-NZVRTJDESA-N 2 0 350.506 4.209 20 0 FIADRP Cc1cc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc(C)c1F ZINC001143379621 1081268180 /nfs/dbraw/zinc/26/81/80/1081268180.db2.gz TZMLPKPXXWSTCW-UHFFFAOYSA-N 2 0 367.512 4.326 20 0 FIADRP [NH3+]Cc1cnc2c(ccn2-c2ccc3c(c2)C[N@@H+](Cc2ccccc2)C3)c1 ZINC001167316250 1081347346 /nfs/dbraw/zinc/34/73/46/1081347346.db2.gz LWVXBBAXJMIORD-UHFFFAOYSA-N 2 0 354.457 4.000 20 0 FIADRP CC(C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000683692945 1081392412 /nfs/dbraw/zinc/39/24/12/1081392412.db2.gz YHWZRBVNUUCJJM-CIAFKFPVSA-N 2 0 356.554 4.367 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+]([C@H]3CCC[C@H]3O)CC1)CCC2 ZINC000537955319 1081448498 /nfs/dbraw/zinc/44/84/98/1081448498.db2.gz RDIDVKJJEITZKH-XPWALMASSA-N 2 0 356.554 4.155 20 0 FIADRP CCCN(CCC[NH+]1CCCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001167333766 1081456539 /nfs/dbraw/zinc/45/65/39/1081456539.db2.gz ZNIFFRJYZLRHKT-HSZRJFAPSA-N 2 0 357.586 4.239 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000123667527 1081517580 /nfs/dbraw/zinc/51/75/80/1081517580.db2.gz DHMKHBGSJIONFH-UHFFFAOYSA-N 2 0 371.956 4.156 20 0 FIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2ccncc2OCC[NH+](C)C)c1 ZINC000580240226 1081768523 /nfs/dbraw/zinc/76/85/23/1081768523.db2.gz GYVSUJRKIIGRBM-GOSISDBHSA-N 2 0 355.526 4.071 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000580315327 1081835438 /nfs/dbraw/zinc/83/54/38/1081835438.db2.gz COQPSPCVPFXZLE-LPHOPBHVSA-N 2 0 367.518 4.184 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](CC(F)(F)F)c2ccc(Br)cc2)C1 ZINC000656198013 1081905064 /nfs/dbraw/zinc/90/50/64/1081905064.db2.gz FXJYSOGXXVMHJX-RDBSUJKOSA-N 2 0 365.237 4.302 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cc4ccccc4[nH]3)cc2)C[C@H](C)O1 ZINC000683927261 1081929074 /nfs/dbraw/zinc/92/90/74/1081929074.db2.gz ICANOOUDXPCYFU-HDICACEKSA-N 2 0 363.505 4.067 20 0 FIADRP CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154095 1082295857 /nfs/dbraw/zinc/29/58/57/1082295857.db2.gz ZOCUBVIVUISAQG-CFFRYYMNSA-N 2 0 370.512 4.402 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCOCC2CCCC2)cc1 ZINC000656404943 1082330903 /nfs/dbraw/zinc/33/09/03/1082330903.db2.gz HIYFBLANNAOSJU-KIHHCIJBSA-N 2 0 368.565 4.036 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548157569 1082419665 /nfs/dbraw/zinc/41/96/65/1082419665.db2.gz PBBBBICGJHWWHK-CRAIPNDOSA-N 2 0 362.439 4.147 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[NH+]1CCCCCC1 ZINC000510389112 1082470395 /nfs/dbraw/zinc/47/03/95/1082470395.db2.gz NUKMAMBTSNPFIZ-MOPGFXCFSA-N 2 0 357.542 4.122 20 0 FIADRP CCCC[C@H](CC)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000581384495 1082507121 /nfs/dbraw/zinc/50/71/21/1082507121.db2.gz YQJXNHNRMSTLIS-VXKWHMMOSA-N 2 0 358.570 4.474 20 0 FIADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000430602581 1082572543 /nfs/dbraw/zinc/57/25/43/1082572543.db2.gz WLSQMHQMFAXAAO-UWJYYQICSA-N 2 0 353.510 4.305 20 0 FIADRP CC[N@H+](Cc1ccc(-c2cnn(C)c2)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000581515691 1082631549 /nfs/dbraw/zinc/63/15/49/1082631549.db2.gz CRUIMKDTQJQTRB-UHFFFAOYSA-N 2 0 368.550 4.232 20 0 FIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000581518263 1082634595 /nfs/dbraw/zinc/63/45/95/1082634595.db2.gz UBHVRGQQHIUSCS-AWEZNQCLSA-N 2 0 356.963 4.217 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1Cl ZINC000656683740 1082717694 /nfs/dbraw/zinc/71/76/94/1082717694.db2.gz QALVRJAJGAGPNE-MRXNPFEDSA-N 2 0 373.928 4.306 20 0 FIADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000684367037 1082768930 /nfs/dbraw/zinc/76/89/30/1082768930.db2.gz KQOFVJILNXFVFS-VXKWHMMOSA-N 2 0 352.522 4.462 20 0 FIADRP COc1ccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)cc1 ZINC000656785103 1082769532 /nfs/dbraw/zinc/76/95/32/1082769532.db2.gz IKGDDYIPFQWUAX-SFHVURJKSA-N 2 0 371.550 4.030 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccccc3OC(F)F)CC2)C1 ZINC000471781747 1082983610 /nfs/dbraw/zinc/98/36/10/1082983610.db2.gz RJKYSDFLFMYQJB-APWZRJJASA-N 2 0 366.496 4.463 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000090971329 1083096209 /nfs/dbraw/zinc/09/62/09/1083096209.db2.gz JWBGVALWHDJGPU-SFHVURJKSA-N 2 0 369.578 4.439 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cccc(F)c1 ZINC000090971343 1083097322 /nfs/dbraw/zinc/09/73/22/1083097322.db2.gz LXKVULDITHTVQJ-GOSISDBHSA-N 2 0 367.512 4.209 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000581973059 1083120675 /nfs/dbraw/zinc/12/06/75/1083120675.db2.gz VVVHOVOPPBZOAK-NIFLVVHWSA-N 2 0 352.469 4.401 20 0 FIADRP Cn1cc(C[C@H]2CCC[C@H]2[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000658236087 1083374978 /nfs/dbraw/zinc/37/49/78/1083374978.db2.gz SYIMPHRUPLXRRE-TZIWHRDSSA-N 2 0 374.617 4.400 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)c2nnc(-c3ccccc3)o2)CC1 ZINC000101726832 1083378191 /nfs/dbraw/zinc/37/81/91/1083378191.db2.gz KNOJECYIVDYQSJ-QGZVFWFLSA-N 2 0 356.514 4.242 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCC4)C[C@H]2C1 ZINC000658318866 1083406035 /nfs/dbraw/zinc/40/60/35/1083406035.db2.gz TVRUZLWZWVEGDR-LILXYRQWSA-N 2 0 368.565 4.082 20 0 FIADRP CC(C)n1cc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000658320215 1083406214 /nfs/dbraw/zinc/40/62/14/1083406214.db2.gz RUZDZRMPUAYGLH-KNQAVFIVSA-N 2 0 366.553 4.417 20 0 FIADRP c1csc([C@@H](Cc2ccncc2)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000658352707 1083423985 /nfs/dbraw/zinc/42/39/85/1083423985.db2.gz IBTAHEDZTZRYFT-HXUWFJFHSA-N 2 0 355.551 4.139 20 0 FIADRP Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000658352659 1083426009 /nfs/dbraw/zinc/42/60/09/1083426009.db2.gz HPCXAKJXUBCVTB-UGKGYDQZSA-N 2 0 360.517 4.005 20 0 FIADRP Cc1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1Oc1cccnc1 ZINC000535806065 1083691413 /nfs/dbraw/zinc/69/14/13/1083691413.db2.gz CFXDUBRQECAMSL-PZJWPPBQSA-N 2 0 351.494 4.098 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccc(Br)cn1 ZINC000926336355 1084098197 /nfs/dbraw/zinc/09/81/97/1084098197.db2.gz FKIIEQJZBDTHFL-UONOGXRCSA-N 2 0 362.315 4.318 20 0 FIADRP C[C@@H]1C[C@@H](N(C)Cc2sccc2NC(=O)OC(C)(C)C)CC[N@@H+]1C ZINC000892104697 1084299181 /nfs/dbraw/zinc/29/91/81/1084299181.db2.gz DPNJHZGKJYVWFZ-KGLIPLIRSA-N 2 0 353.532 4.010 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c(C)n1 ZINC000157661105 1084442900 /nfs/dbraw/zinc/44/29/00/1084442900.db2.gz IGVQEQOECPLIIT-IRXDYDNUSA-N 2 0 352.526 4.319 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc3ccncc3s2)cc1 ZINC000657312810 1084447584 /nfs/dbraw/zinc/44/75/84/1084447584.db2.gz MUIHEOISQLEKKE-UHFFFAOYSA-N 2 0 369.534 4.307 20 0 FIADRP CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523636 1084449355 /nfs/dbraw/zinc/44/93/55/1084449355.db2.gz OMTYIDWRVXRFNI-QZTJIDSGSA-N 2 0 359.558 4.191 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2c(C3CC3)cnn2C)C1 ZINC000657312881 1084449742 /nfs/dbraw/zinc/44/97/42/1084449742.db2.gz OXLAUKROGBKWER-ROUUACIJSA-N 2 0 366.553 4.065 20 0 FIADRP CCc1ccc(-c2ccc(C[NH2+]C(C)(C)CCN3CC[NH+](C)CC3)o2)cc1 ZINC000472139020 1084481414 /nfs/dbraw/zinc/48/14/14/1084481414.db2.gz VLSWBRFWJPAGHF-UHFFFAOYSA-N 2 0 369.553 4.015 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccnn3CC3CC3)cc2)C1 ZINC000657314475 1084495961 /nfs/dbraw/zinc/49/59/61/1084495961.db2.gz WALUUSHHZZITJS-OALUTQOASA-N 2 0 366.553 4.061 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3ccnn3CC3CC3)cc2)C1 ZINC000657314474 1084496460 /nfs/dbraw/zinc/49/64/60/1084496460.db2.gz WALUUSHHZZITJS-KDURUIRLSA-N 2 0 366.553 4.061 20 0 FIADRP C[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@@H](CCO)c1ccccc1 ZINC001167544465 1084548924 /nfs/dbraw/zinc/54/89/24/1084548924.db2.gz NQWXCQPPRGIIRP-QHCPKHFHSA-N 2 0 352.522 4.228 20 0 FIADRP c1c2ccncc2sc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000657329055 1084581653 /nfs/dbraw/zinc/58/16/53/1084581653.db2.gz IQBPPEALZXRFFI-UHFFFAOYSA-N 2 0 351.519 4.298 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)CSc1ccc(C)cc1 ZINC000472162329 1084611528 /nfs/dbraw/zinc/61/15/28/1084611528.db2.gz YNZCTBWSDIWWKC-MRXNPFEDSA-N 2 0 352.507 4.155 20 0 FIADRP Cn1ncc(C2CCC2)c1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000657338191 1084631689 /nfs/dbraw/zinc/63/16/89/1084631689.db2.gz IQSFEPGXXKIEOJ-UHFFFAOYSA-N 2 0 366.553 4.353 20 0 FIADRP C[C@@H](NCc1ccn(-c2ccc(Cl)cc2)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000467185401 1084658467 /nfs/dbraw/zinc/65/84/67/1084658467.db2.gz FFKOTSKFTDTLDX-IAGOWNOFSA-N 2 0 372.944 4.268 20 0 FIADRP CSC1(C[NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH+](C)CC1 ZINC000414142620 1084692342 /nfs/dbraw/zinc/69/23/42/1084692342.db2.gz IYWOJIBOPKBECP-WMZOPIPTSA-N 2 0 352.975 4.393 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000414183693 1084761137 /nfs/dbraw/zinc/76/11/37/1084761137.db2.gz OAXOWFHDWUTSNH-OSGQAZFXSA-N 2 0 368.924 4.062 20 0 FIADRP Cn1cncc1CCC[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000563350498 1084981014 /nfs/dbraw/zinc/98/10/14/1084981014.db2.gz OQWFWHVDINKSSV-LJQANCHMSA-N 2 0 369.900 4.233 20 0 FIADRP CC(C)(C)[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657534719 1085449517 /nfs/dbraw/zinc/44/95/17/1085449517.db2.gz CTUAXVUYEPWCRE-UXHICEINSA-N 2 0 350.591 4.462 20 0 FIADRP c1csc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)cc2)c1 ZINC000657537185 1085453470 /nfs/dbraw/zinc/45/34/70/1085453470.db2.gz BUFXZYOHWPJYJA-UHFFFAOYSA-N 2 0 370.562 4.396 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)CCCc2ccc(Br)cc2)CC1 ZINC001207322430 1085457391 /nfs/dbraw/zinc/45/73/91/1085457391.db2.gz PKVNLSFEJLFZLL-UHFFFAOYSA-N 2 0 367.375 4.434 20 0 FIADRP CC1(C)CC([NH2+][C@@H]2CCc3cc(Br)ccc32)CC(C)(C)[NH2+]1 ZINC000040226560 1085550888 /nfs/dbraw/zinc/55/08/88/1085550888.db2.gz DNMURIJWNLPTJG-MRXNPFEDSA-N 2 0 351.332 4.335 20 0 FIADRP C[NH+]1CCC2(CC1)CC[NH+](CCCc1ccc(Br)cc1)CC2 ZINC001207323110 1085602966 /nfs/dbraw/zinc/60/29/66/1085602966.db2.gz PJSPFIYWOBKNGV-UHFFFAOYSA-N 2 0 365.359 4.190 20 0 FIADRP c1sc2ccccc2c1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657612381 1085687715 /nfs/dbraw/zinc/68/77/15/1085687715.db2.gz MZDHQCLWCXQHOI-UHFFFAOYSA-N 2 0 351.519 4.298 20 0 FIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(F)c(OC(F)(F)F)c1)CC2 ZINC001143447449 1085712882 /nfs/dbraw/zinc/71/28/82/1085712882.db2.gz VCLLVVYGGJJWTN-UHFFFAOYSA-N 2 0 360.395 4.032 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347988 1085919634 /nfs/dbraw/zinc/91/96/34/1085919634.db2.gz QTEIBWOQEBOWEA-MJXUCMMTSA-N 2 0 357.325 4.273 20 0 FIADRP FC1(F)CC12CCC([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CC2 ZINC000657717533 1086029988 /nfs/dbraw/zinc/02/99/88/1086029988.db2.gz YQGGWOMYFLNMRQ-UHFFFAOYSA-N 2 0 364.480 4.219 20 0 FIADRP FC(F)(F)C[C@@H]1CC[NH+](CCCC[N@H+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000583063573 1086128652 /nfs/dbraw/zinc/12/86/52/1086128652.db2.gz AXECKMVWUJXTNF-KBPBESRZSA-N 2 0 360.386 4.315 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC(C)C)cc2)[C@@H](C)C1 ZINC000247167373 1086150370 /nfs/dbraw/zinc/15/03/70/1086150370.db2.gz UMKVFLYSISMJED-IPJJNNNSSA-N 2 0 362.558 4.261 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1C ZINC000248451393 1086168734 /nfs/dbraw/zinc/16/87/34/1086168734.db2.gz PILGECBPRQWEKI-SIKLNZKXSA-N 2 0 352.522 4.029 20 0 FIADRP Fc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000248832262 1086175917 /nfs/dbraw/zinc/17/59/17/1086175917.db2.gz HUBYCMCGTLFTAF-ACDBMABISA-N 2 0 356.460 4.293 20 0 FIADRP Fc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000248832274 1086176794 /nfs/dbraw/zinc/17/67/94/1086176794.db2.gz HUBYCMCGTLFTAF-OWZKRDHZSA-N 2 0 356.460 4.293 20 0 FIADRP CC(C)Oc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000063551822 1086308769 /nfs/dbraw/zinc/30/87/69/1086308769.db2.gz OLQPAWVXOARCSD-UHFFFAOYSA-N 2 0 352.522 4.476 20 0 FIADRP c1c(C2CC[NH+]([C@@H]3CCCc4ccccc43)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662328718 1086420415 /nfs/dbraw/zinc/42/04/15/1086420415.db2.gz TZTLBFZMBVUMCV-HSZRJFAPSA-N 2 0 364.537 4.134 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(SC(F)F)cc2)CC1 ZINC000159213333 1086443778 /nfs/dbraw/zinc/44/37/78/1086443778.db2.gz ZASFRENJOODFBO-CQSZACIVSA-N 2 0 358.498 4.153 20 0 FIADRP FC(F)Oc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663346572 1086447596 /nfs/dbraw/zinc/44/75/96/1086447596.db2.gz VNMBIEFBQJBEAL-HNNXBMFYSA-N 2 0 358.860 4.153 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]CCCn1ccnc1)CCCS2 ZINC000663435247 1086540371 /nfs/dbraw/zinc/54/03/71/1086540371.db2.gz ANGRPGDKNXCDDR-OAHLLOKOSA-N 2 0 366.328 4.253 20 0 FIADRP C[C@H](C[NH2+]C1CCN([C@H]2CCOC2)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000657751324 1086560875 /nfs/dbraw/zinc/56/08/75/1086560875.db2.gz QBQHXJGERFKSMZ-AVRDEDQJSA-N 2 0 358.570 4.006 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)n1nc(-c2ccc(F)cc2)c2c1CC[NH2+]CC2 ZINC001167825131 1086612465 /nfs/dbraw/zinc/61/24/65/1086612465.db2.gz REUIKDUOSRRJQH-QGZVFWFLSA-N 2 0 372.532 4.060 20 0 FIADRP Cc1noc(C)c1[C@@H](C)[NH2+]CCC(C)CC[NH2+][C@H](C)c1c(C)noc1C ZINC000663597662 1086695599 /nfs/dbraw/zinc/69/55/99/1086695599.db2.gz FXWSODXPEBRGGR-ZIAGYGMSSA-N 2 0 362.518 4.314 20 0 FIADRP CCC[N@H+]([C@H](C)CCC[NH+](CC)CC)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167839571 1086716452 /nfs/dbraw/zinc/71/64/52/1086716452.db2.gz ALTOXBWLAANDAZ-MOPGFXCFSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@]2(CCCN2Cc2ccccc2)C1 ZINC001167842376 1086745502 /nfs/dbraw/zinc/74/55/02/1086745502.db2.gz WPVYFNVGUUHCDZ-JTHBVZDNSA-N 2 0 357.586 4.237 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC000650705605 1086750664 /nfs/dbraw/zinc/75/06/64/1086750664.db2.gz NNGKHBCKIKRPDI-MZKRTTBSSA-N 2 0 366.505 4.197 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(F)c(-c4cccs4)c3)C2)C1 ZINC000650706065 1086753859 /nfs/dbraw/zinc/75/38/59/1086753859.db2.gz CRWIZOJVOJNHGT-MBOZVWFJSA-N 2 0 374.525 4.273 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCC[C@@H]1[C@H](C(=O)OC)c1ccccc1 ZINC001167842541 1086753943 /nfs/dbraw/zinc/75/39/43/1086753943.db2.gz YJMKLDZTSYWLCP-KSEOMHKRSA-N 2 0 374.569 4.308 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H](C(=O)OC)C[C@H]1c1ccccc1 ZINC001167842557 1086754265 /nfs/dbraw/zinc/75/42/65/1086754265.db2.gz YKLNLLKBCZTUGG-JBACZVJFSA-N 2 0 360.542 4.123 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000650706803 1086759484 /nfs/dbraw/zinc/75/94/84/1086759484.db2.gz SOWKFFSQKQLNQZ-JXXFODFXSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CC3CCC(c4ccccc4)CC3)C2)C1 ZINC000650708988 1086763104 /nfs/dbraw/zinc/76/31/04/1086763104.db2.gz XVCTYWYQXNSJGK-RIYCBMTJSA-N 2 0 356.554 4.179 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)cn1 ZINC000512113482 1086782406 /nfs/dbraw/zinc/78/24/06/1086782406.db2.gz DGIYRKPLRGRHQK-KDURUIRLSA-N 2 0 351.538 4.412 20 0 FIADRP COc1cc(C[NH2+]CCC2(C[NH3+])CC2)ccc1OCc1ccc(Cl)cc1 ZINC000650713270 1086784360 /nfs/dbraw/zinc/78/43/60/1086784360.db2.gz MRULYUTVWNWRNR-UHFFFAOYSA-N 2 0 374.912 4.146 20 0 FIADRP Fc1ccc(/C=C\C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1F ZINC000512135413 1086813276 /nfs/dbraw/zinc/81/32/76/1086813276.db2.gz JYGATWGJJDFPOJ-DHBDYNCWSA-N 2 0 356.460 4.132 20 0 FIADRP COCc1csc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000657772294 1086813314 /nfs/dbraw/zinc/81/33/14/1086813314.db2.gz LPZFQCXEOQLKDM-FQEVSTJZSA-N 2 0 370.562 4.286 20 0 FIADRP CCCCCOc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1 ZINC000650722041 1086827414 /nfs/dbraw/zinc/82/74/14/1086827414.db2.gz JDHGMXMCAOUJBN-NNWRFLSQSA-N 2 0 360.542 4.116 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)cc(Br)c1 ZINC000650754503 1086962117 /nfs/dbraw/zinc/96/21/17/1086962117.db2.gz KIBTWFKVLLBZMQ-QGZVFWFLSA-N 2 0 369.253 4.427 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCc2c1ccc(F)c2Br ZINC000650756037 1086964649 /nfs/dbraw/zinc/96/46/49/1086964649.db2.gz SAVGPJYSRLEJLW-QGZVFWFLSA-N 2 0 363.274 4.085 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCc2ccc(Br)cc21 ZINC000650757181 1086970113 /nfs/dbraw/zinc/97/01/13/1086970113.db2.gz QPUJPACWZDCXJB-LJQANCHMSA-N 2 0 359.311 4.336 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(Br)ccc1F ZINC000650757980 1086971523 /nfs/dbraw/zinc/97/15/23/1086971523.db2.gz FZOLCDOUECRMMW-LBPRGKRZSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(OC(F)(F)F)c1 ZINC000151167513 1086984434 /nfs/dbraw/zinc/98/44/34/1086984434.db2.gz ICUDQPRDCKNSEZ-CQSZACIVSA-N 2 0 352.400 4.498 20 0 FIADRP Cc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000583869284 1087004093 /nfs/dbraw/zinc/00/40/93/1087004093.db2.gz GHAXJKDAPWQYAE-NRFANRHFSA-N 2 0 351.494 4.010 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(SC(F)F)cc1 ZINC000133132169 1087123396 /nfs/dbraw/zinc/12/33/96/1087123396.db2.gz KRJZBCVSAPWJCA-HUUCEWRRSA-N 2 0 370.509 4.153 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C/C(C)=C\c2ccccc2OC(F)F)CC1 ZINC000584320624 1087264895 /nfs/dbraw/zinc/26/48/95/1087264895.db2.gz DUXTUNCWTKULBD-PEZBUJJGSA-N 2 0 352.469 4.403 20 0 FIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCc3ncc(C)cc3C)C2)s1 ZINC000584354743 1087276621 /nfs/dbraw/zinc/27/66/21/1087276621.db2.gz WAWVMAGVDXTHJK-IBGZPJMESA-N 2 0 357.567 4.065 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)c(Cl)c1 ZINC000657839870 1087277238 /nfs/dbraw/zinc/27/72/38/1087277238.db2.gz IITACHDVHPVTLK-FPMFFAJLSA-N 2 0 357.723 4.380 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)c(Cl)c1 ZINC000657839872 1087277401 /nfs/dbraw/zinc/27/74/01/1087277401.db2.gz IITACHDVHPVTLK-UBHSHLNASA-N 2 0 357.723 4.380 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(C[NH+](CC)CC)CC3)co2)cc1 ZINC000584390209 1087330528 /nfs/dbraw/zinc/33/05/28/1087330528.db2.gz IKHWGWZPCNWXAC-UHFFFAOYSA-N 2 0 371.525 4.294 20 0 FIADRP [NH3+]CCC1CC[NH+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000584414281 1087367321 /nfs/dbraw/zinc/36/73/21/1087367321.db2.gz OAYQNOXFQCXNRD-UHFFFAOYSA-N 2 0 371.912 4.153 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2ccncc2s1 ZINC000657863825 1087430464 /nfs/dbraw/zinc/43/04/64/1087430464.db2.gz WKSJRXVGJUBIGC-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2ccncc2s1 ZINC000657863826 1087430568 /nfs/dbraw/zinc/43/05/68/1087430568.db2.gz WKSJRXVGJUBIGC-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CCC3CC[NH+](C)CC3)cc2cc1OC ZINC000657869874 1087479426 /nfs/dbraw/zinc/47/94/26/1087479426.db2.gz BGECALIPNQXGII-INIZCTEOSA-N 2 0 356.510 4.240 20 0 FIADRP C[N@H+](Cc1ccc(OCc2cccc(F)c2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000685443826 1087569429 /nfs/dbraw/zinc/56/94/29/1087569429.db2.gz WQMHWLQORRYQBX-CBQGHPETSA-N 2 0 368.496 4.462 20 0 FIADRP COc1c(C)cnc(CN2CCC([N@H+](C)Cc3sccc3C)CC2)c1C ZINC000685468759 1087577709 /nfs/dbraw/zinc/57/77/09/1087577709.db2.gz TUIMTXQDTYNDSN-UHFFFAOYSA-N 2 0 373.566 4.173 20 0 FIADRP CCc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)cc1 ZINC000658067114 1087709898 /nfs/dbraw/zinc/70/98/98/1087709898.db2.gz JVLPPKNBLRZGEX-QHCPKHFHSA-N 2 0 358.570 4.427 20 0 FIADRP Clc1ccc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CC2)cc1 ZINC000658067200 1087710333 /nfs/dbraw/zinc/71/03/33/1087710333.db2.gz LSCLBZMFDKDHSH-OAQYLSRUSA-N 2 0 362.945 4.272 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)c(F)c1 ZINC000658070133 1087711199 /nfs/dbraw/zinc/71/11/99/1087711199.db2.gz MFGPSUKXBLZFPK-OAQYLSRUSA-N 2 0 366.496 4.143 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc2ccccc2s1 ZINC000658071837 1087711287 /nfs/dbraw/zinc/71/12/87/1087711287.db2.gz ZPXNQEKIUHLMQZ-MRXNPFEDSA-N 2 0 358.551 4.443 20 0 FIADRP CSc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CCOCC3)CC1)CCC2 ZINC000658070511 1087711502 /nfs/dbraw/zinc/71/15/02/1087711502.db2.gz PPYADVVTIWSAHC-QFIPXVFZSA-N 2 0 374.594 4.267 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccnc4ccccc34)CC2)C1 ZINC000658125361 1087732802 /nfs/dbraw/zinc/73/28/02/1087732802.db2.gz BFJJAIOGLJLVSH-NQIIRXRSSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccnc3ccccc23)CC1 ZINC000658128198 1087733316 /nfs/dbraw/zinc/73/33/16/1087733316.db2.gz TYBZJLJGFULGBQ-MBSDFSHPSA-N 2 0 351.538 4.410 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccs1 ZINC000658137529 1087742596 /nfs/dbraw/zinc/74/25/96/1087742596.db2.gz HIIJQMLYZJFJKB-VQTJNVASSA-N 2 0 358.551 4.192 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(C)ccc1OC ZINC000658165392 1087762892 /nfs/dbraw/zinc/76/28/92/1087762892.db2.gz JHDMVNNGXIRTAM-QFIPXVFZSA-N 2 0 367.537 4.352 20 0 FIADRP CSc1ccccc1C[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168430 1087764444 /nfs/dbraw/zinc/76/44/44/1087764444.db2.gz XBYGMFXFYIBGOD-SFHVURJKSA-N 2 0 369.578 4.236 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[N@@H+]3CCCC[C@H]3C)C[C@H]2C1 ZINC000424260729 1087880843 /nfs/dbraw/zinc/88/08/43/1087880843.db2.gz DLEQASDLDJUYKF-KJWUJUMESA-N 2 0 356.554 4.354 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[N@@H+]3CCC[C@H](C)C3)C[C@H]2C1 ZINC000424269633 1087892558 /nfs/dbraw/zinc/89/25/58/1087892558.db2.gz PLAIFVIPFKORQO-GBCNUAAFSA-N 2 0 356.554 4.212 20 0 FIADRP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]CCc1cn3c(n1)CCCC3)CC2 ZINC000134314118 1087906794 /nfs/dbraw/zinc/90/67/94/1087906794.db2.gz XHGVXABDSMSLHD-INIZCTEOSA-N 2 0 350.293 4.346 20 0 FIADRP COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000414342936 1087910571 /nfs/dbraw/zinc/91/05/71/1087910571.db2.gz PUYMWSBCMPBUMS-VPJOFFEXSA-N 2 0 364.533 4.299 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000163568474 1088292246 /nfs/dbraw/zinc/29/22/46/1088292246.db2.gz KINHUXCSSAWVDI-CRICUBBOSA-N 2 0 358.551 4.117 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414836490 1088402526 /nfs/dbraw/zinc/40/25/26/1088402526.db2.gz SPXKOPZYOMWJEK-OAHLLOKOSA-N 2 0 360.933 4.048 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@@H]2[NH2+]Cc3ccccc32)cc1 ZINC000659285869 1088416739 /nfs/dbraw/zinc/41/67/39/1088416739.db2.gz SMEXWIPTMJZDDG-VGSWGCGISA-N 2 0 363.505 4.234 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCc4c3cccc4F)CC2)cc1 ZINC000513872335 1088477630 /nfs/dbraw/zinc/47/76/30/1088477630.db2.gz GVUGSANRKABKQX-HSZRJFAPSA-N 2 0 368.496 4.323 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000514249489 1088929632 /nfs/dbraw/zinc/92/96/32/1088929632.db2.gz GUQOJAXHWFJOFI-PFSBYRDKSA-N 2 0 370.924 4.100 20 0 FIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]CC1CC[NH+](C)CC1 ZINC000236629906 1088967388 /nfs/dbraw/zinc/96/73/88/1088967388.db2.gz CHEPTCZPLGJSEZ-UHFFFAOYSA-N 2 0 360.933 4.081 20 0 FIADRP C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414860065 1088972246 /nfs/dbraw/zinc/97/22/46/1088972246.db2.gz OCLNFNLVKSGULC-CQSZACIVSA-N 2 0 371.447 4.064 20 0 FIADRP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](CC2CCC(c3ccccc3)CC2)CC1 ZINC000189018383 1089034018 /nfs/dbraw/zinc/03/40/18/1089034018.db2.gz XGCXKOFLKQHLAS-FOJYNEPKSA-N 2 0 369.597 4.062 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H](C)CCCC[NH3+])o1 ZINC000415012486 1089039682 /nfs/dbraw/zinc/03/96/82/1089039682.db2.gz IYHGSAQBAVJMSP-MRXNPFEDSA-N 2 0 352.482 4.048 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000415026052 1089054984 /nfs/dbraw/zinc/05/49/84/1089054984.db2.gz RSBQLUVAKOSKCW-QAQDUYKDSA-N 2 0 373.928 4.169 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000415028578 1089063285 /nfs/dbraw/zinc/06/32/85/1089063285.db2.gz YYSJPDJZAZBHMC-LBPRGKRZSA-N 2 0 353.329 4.395 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415049269 1089085287 /nfs/dbraw/zinc/08/52/87/1089085287.db2.gz XROLECQLZPREDO-REWPJTCUSA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cccc(OCC(F)(F)F)c1)c1ccccc1 ZINC000415060358 1089094443 /nfs/dbraw/zinc/09/44/43/1089094443.db2.gz WMDBYQMCQJAVGV-SFHVURJKSA-N 2 0 352.400 4.198 20 0 FIADRP FC(F)(F)c1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000415103714 1089162972 /nfs/dbraw/zinc/16/29/72/1089162972.db2.gz JUNVTFOTYOVRMH-KZNAEPCWSA-N 2 0 352.444 4.247 20 0 FIADRP FC(F)(F)c1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000415103722 1089163515 /nfs/dbraw/zinc/16/35/15/1089163515.db2.gz JUNVTFOTYOVRMH-RCCFBDPRSA-N 2 0 352.444 4.247 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3CC[NH2+][C@H](C)C3)s2)cc1 ZINC000415107398 1089168339 /nfs/dbraw/zinc/16/83/39/1089168339.db2.gz NUZVEMYGDHHJEA-YCPHGPKFSA-N 2 0 359.539 4.166 20 0 FIADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000415116912 1089175974 /nfs/dbraw/zinc/17/59/74/1089175974.db2.gz IKNUQZMPWHOWFD-IFXJQAMLSA-N 2 0 370.368 4.078 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)C1 ZINC000415126562 1089178351 /nfs/dbraw/zinc/17/83/51/1089178351.db2.gz POZIGNBCEGXZDG-ICSRJNTNSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000415138150 1089200216 /nfs/dbraw/zinc/20/02/16/1089200216.db2.gz YLEKUYWXDQGFLA-SFTDATJTSA-N 2 0 356.535 4.133 20 0 FIADRP C[NH+](C)[C@H]1CCOc2c(N[C@H]3CCC[N@H+](Cc4ccccc4)C3)cccc21 ZINC000435023454 1089210133 /nfs/dbraw/zinc/21/01/33/1089210133.db2.gz KKONVTUCWYMUMP-UGKGYDQZSA-N 2 0 365.521 4.148 20 0 FIADRP C[C@@H]1CC(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C[C@@H](C)O1 ZINC000549236937 1089309326 /nfs/dbraw/zinc/30/93/26/1089309326.db2.gz IQBLJMBOHYODJC-UDMCKFQASA-N 2 0 356.554 4.080 20 0 FIADRP C[N@H+](Cc1cccc(NC(=O)c2ccccc2Cl)c1)CC(C)(C)C[NH3+] ZINC000435374915 1089568226 /nfs/dbraw/zinc/56/82/26/1089568226.db2.gz SIPDHOBGPLONDI-UHFFFAOYSA-N 2 0 359.901 4.009 20 0 FIADRP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000893019337 1089674637 /nfs/dbraw/zinc/67/46/37/1089674637.db2.gz RJGFAXWFTWBSDE-UHFFFAOYSA-N 2 0 353.466 4.060 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc([S@](C)=O)cc1 ZINC000163782038 1089783680 /nfs/dbraw/zinc/78/36/80/1089783680.db2.gz YNOXVWFEPUOHCI-CRICUBBOSA-N 2 0 358.551 4.117 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000515251268 1089914396 /nfs/dbraw/zinc/91/43/96/1089914396.db2.gz KABUHUTUFRLIGI-UHFFFAOYSA-N 2 0 366.933 4.055 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000163937409 1090280318 /nfs/dbraw/zinc/28/03/18/1090280318.db2.gz BICOZYLOIZBTHV-QYBDOPJKSA-N 2 0 370.562 4.261 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000382072934 1090431229 /nfs/dbraw/zinc/43/12/29/1090431229.db2.gz ZXLXFFQFJJLFDY-KNQAVFIVSA-N 2 0 352.522 4.474 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310967 1090805657 /nfs/dbraw/zinc/80/56/57/1090805657.db2.gz LELUWSLBEXWJAN-AYWYSENESA-N 2 0 354.563 4.394 20 0 FIADRP Oc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000397589376 1091012254 /nfs/dbraw/zinc/01/22/54/1091012254.db2.gz LGYIUUZXAXQRKS-QHCPKHFHSA-N 2 0 350.506 4.271 20 0 FIADRP CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000500086769 1091029501 /nfs/dbraw/zinc/02/95/01/1091029501.db2.gz DQTKVMDTCRIDQP-PZJWPPBQSA-N 2 0 361.574 4.031 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000500098523 1091036482 /nfs/dbraw/zinc/03/64/82/1091036482.db2.gz MPKREJSHPISINB-RBUKOAKNSA-N 2 0 365.993 4.180 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000500098521 1091036919 /nfs/dbraw/zinc/03/69/19/1091036919.db2.gz MPKREJSHPISINB-OALUTQOASA-N 2 0 365.993 4.180 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)C[NH2+]C2CCC3(COC(C)(C)C3)CC2)C1 ZINC001648927174 1091151589 /nfs/dbraw/zinc/15/15/89/1091151589.db2.gz LJXYERASWRXUEL-JREAUHRESA-N 2 0 350.591 4.460 20 0 FIADRP C[C@@H]1C[C@@H](NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000390519701 1091162666 /nfs/dbraw/zinc/16/26/66/1091162666.db2.gz FSMVHZYGHNLXAZ-QPPBQGQZSA-N 2 0 365.565 4.151 20 0 FIADRP C[N@H+](CCC[NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)C1CCCCC1 ZINC000311245986 1091239830 /nfs/dbraw/zinc/23/98/30/1091239830.db2.gz XAULFHZGKFDECR-UHFFFAOYSA-N 2 0 367.578 4.067 20 0 FIADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390551007 1091244805 /nfs/dbraw/zinc/24/48/05/1091244805.db2.gz KCGCMNGZXRCDHD-UAYLSCSNSA-N 2 0 355.570 4.082 20 0 FIADRP O[C@@H](C[NH+]1CCC(CCC[NH+]2CCCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000759848990 1091315734 /nfs/dbraw/zinc/31/57/34/1091315734.db2.gz MTPYSZQNQLRVRV-FQEVSTJZSA-N 2 0 368.924 4.101 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000500366718 1091371892 /nfs/dbraw/zinc/37/18/92/1091371892.db2.gz ADSVREIWRYMGGN-OAHLLOKOSA-N 2 0 371.903 4.007 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@@H]3O)CC1)CCS2 ZINC000187377346 1091878577 /nfs/dbraw/zinc/87/85/77/1091878577.db2.gz RRSYBIGFBYGNEY-NJYVYQBISA-N 2 0 374.594 4.198 20 0 FIADRP Cc1cc(N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428166788 1092219242 /nfs/dbraw/zinc/21/92/42/1092219242.db2.gz STHQMSRRQKCQLQ-RDTXWAMCSA-N 2 0 361.436 4.065 20 0 FIADRP CCc1nc(C)c(CN2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)o1 ZINC000428218577 1092268292 /nfs/dbraw/zinc/26/82/92/1092268292.db2.gz MPVGHVZXEDMQPJ-QFIPXVFZSA-N 2 0 353.510 4.034 20 0 FIADRP CCC[NH+]1CCC(N[C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428233111 1092273685 /nfs/dbraw/zinc/27/36/85/1092273685.db2.gz XUCPJZLBVDKYIN-OEMFJLHTSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@H]2Cc3ccccc3O2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011932 1092309209 /nfs/dbraw/zinc/30/92/09/1092309209.db2.gz UJFDDQINVYCORQ-JBYIUTFZSA-N 2 0 350.506 4.021 20 0 FIADRP C[C@@H]1CC([NH+]2C(C)(C)CC([NH3+])CC2(C)C)C[C@@H](C)N1Cc1ccccc1 ZINC001168012461 1092339291 /nfs/dbraw/zinc/33/92/91/1092339291.db2.gz ANVXJIAWGSJMRN-QZTJIDSGSA-N 2 0 357.586 4.408 20 0 FIADRP C[C@@H]1CC(N[C@H](C[NH+](C)C)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012211 1092346659 /nfs/dbraw/zinc/34/66/59/1092346659.db2.gz XXOMYWSBHUWLKP-YOSAUDMPSA-N 2 0 365.565 4.321 20 0 FIADRP COc1ncc(C[NH+]2CCC3(CC2)CC[NH+](Cc2ccccc2)CC3)s1 ZINC001139820650 1092380680 /nfs/dbraw/zinc/38/06/80/1092380680.db2.gz BAEMEVBLTBHCRT-UHFFFAOYSA-N 2 0 371.550 4.030 20 0 FIADRP Cc1cc(-c2noc([C@H](C)[N@@H+]3CC[C@@H](C)[C@H](n4ccnc4)C3)n2)ccc1F ZINC000245572078 1092664332 /nfs/dbraw/zinc/66/43/32/1092664332.db2.gz GWBBYACWVZJDHF-QIIPPGSGSA-N 2 0 369.444 4.025 20 0 FIADRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000521514025 1092734738 /nfs/dbraw/zinc/73/47/38/1092734738.db2.gz FVPDYZSUHKLJOK-YJBOKZPZSA-N 2 0 361.942 4.380 20 0 FIADRP C[C@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000442825137 1092780175 /nfs/dbraw/zinc/78/01/75/1092780175.db2.gz IEHPVXNOPAMFRH-YSIASYRMSA-N 2 0 359.517 4.135 20 0 FIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2ccccc2)s1 ZINC000442869733 1092817363 /nfs/dbraw/zinc/81/73/63/1092817363.db2.gz FFDVAFFJIHERIX-QGZVFWFLSA-N 2 0 357.567 4.092 20 0 FIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(-c2ccccc2)c1 ZINC000442894474 1092847913 /nfs/dbraw/zinc/84/79/13/1092847913.db2.gz ZOBRGLNIPRBFEU-LJQANCHMSA-N 2 0 351.538 4.030 20 0 FIADRP C[C@@H]1CC(N2C[C@H](CC[NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014922 1092901372 /nfs/dbraw/zinc/90/13/72/1092901372.db2.gz NHOCLRSBQCZDSY-SBHAEUEKSA-N 2 0 363.549 4.381 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000443063959 1092924994 /nfs/dbraw/zinc/92/49/94/1092924994.db2.gz XNRHJLNQETVDAP-ZWKOTPCHSA-N 2 0 351.494 4.061 20 0 FIADRP C[N@H+](Cc1ccc(OCc2ccc(F)cc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512563214 1092932624 /nfs/dbraw/zinc/93/26/24/1092932624.db2.gz CSVVMFDNBJXUGQ-CBQGHPETSA-N 2 0 368.496 4.462 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)C[N@@H+]1Cc1ccccc1 ZINC000474039817 1092950496 /nfs/dbraw/zinc/95/04/96/1092950496.db2.gz TWOLZINXHHLXJL-DXVXXHEXSA-N 2 0 370.581 4.472 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000443193773 1092984111 /nfs/dbraw/zinc/98/41/11/1092984111.db2.gz NDLLPFLYWGUUIX-CVDCTZTESA-N 2 0 357.586 4.373 20 0 FIADRP C[C@@H]1CC(NCCC[N@H+]2CCCC[C@H]2C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015285 1092998347 /nfs/dbraw/zinc/99/83/47/1092998347.db2.gz QMDRBHSAFFVSEB-NJDAHSKKSA-N 2 0 357.586 4.282 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H](O)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168015832 1093039153 /nfs/dbraw/zinc/03/91/53/1093039153.db2.gz SMWQPCYCNSNXRW-YDLSIGKMSA-N 2 0 352.522 4.141 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000474056067 1093159316 /nfs/dbraw/zinc/15/93/16/1093159316.db2.gz MGBRHMLRTQVCSR-OAQYLSRUSA-N 2 0 368.521 4.148 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCCC[NH+]2CCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020381 1093211948 /nfs/dbraw/zinc/21/19/48/1093211948.db2.gz MUAFSTKDJYBUGY-IUTQVRIDSA-N 3 0 357.586 4.284 20 0 FIADRP c1ccc(N2CCC[C@H](C[NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000433093516 1093236573 /nfs/dbraw/zinc/23/65/73/1093236573.db2.gz QYDUQJFQOIGPHH-HXUWFJFHSA-N 2 0 355.570 4.290 20 0 FIADRP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000443584877 1093284926 /nfs/dbraw/zinc/28/49/26/1093284926.db2.gz TXGNBUYMPFWZCA-YJYMSZOUSA-N 2 0 371.352 4.005 20 0 FIADRP C[C@@H]1CC(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168022651 1093312838 /nfs/dbraw/zinc/31/28/38/1093312838.db2.gz AVOOOVGUTFYMBP-QPJZEMMPSA-N 2 0 355.570 4.033 20 0 FIADRP c1cnn(CCCCC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000433170872 1093362400 /nfs/dbraw/zinc/36/24/00/1093362400.db2.gz ADSWAQPAWLTEKI-UHFFFAOYSA-N 2 0 366.553 4.042 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-n2cccn2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168023526 1093363645 /nfs/dbraw/zinc/36/36/45/1093363645.db2.gz XFBUFAZMQSUELW-JHDGKUDLSA-N 2 0 374.532 4.404 20 0 FIADRP CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000443646763 1093386931 /nfs/dbraw/zinc/38/69/31/1093386931.db2.gz WSEBJRDWUGSVEN-OFNKIYASSA-N 2 0 361.618 4.107 20 0 FIADRP Cc1ccn(C2CC[NH+](Cc3cccc(C[NH+]4CCCCC4)c3)CC2)n1 ZINC000411687266 1093417733 /nfs/dbraw/zinc/41/77/33/1093417733.db2.gz MDJZPNGICZAMTJ-UHFFFAOYSA-N 2 0 352.526 4.015 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168025322 1093431899 /nfs/dbraw/zinc/43/18/99/1093431899.db2.gz JJFKGNNSVATDHC-SKPFHBQLSA-N 2 0 366.549 4.275 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CCCCC4CCOCC4)C[C@@H]3C2)cc1 ZINC000389160267 1093479319 /nfs/dbraw/zinc/47/93/19/1093479319.db2.gz YNNLUGBLTUQPNA-DHIUTWEWSA-N 2 0 356.554 4.037 20 0 FIADRP C[C@H]1CC(NC2CC[NH+](C3CCCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168027992 1093528530 /nfs/dbraw/zinc/52/85/30/1093528530.db2.gz NWQLTFDDGDCBFH-PMACEKPBSA-N 2 0 369.597 4.425 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N2CCOC2=O)cc1 ZINC000158566896 1093535684 /nfs/dbraw/zinc/53/56/84/1093535684.db2.gz OGWZSXYFKSUPNQ-OTWHNJEPSA-N 2 0 373.541 4.052 20 0 FIADRP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000433319449 1093579181 /nfs/dbraw/zinc/57/91/81/1093579181.db2.gz OLPNWPQBTMBRAR-JOCHJYFZSA-N 2 0 369.553 4.061 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3CCC[C@H](c4ccccc4)N3)n2)cc1 ZINC001211884882 1093630787 /nfs/dbraw/zinc/63/07/87/1093630787.db2.gz ICKYJEUEVBLSBE-WOJBJXKFSA-N 2 0 362.477 4.354 20 0 FIADRP C[C@H]1CC([NH2+]C(C)(C)Cc2ccccn2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032462 1093654828 /nfs/dbraw/zinc/65/48/28/1093654828.db2.gz GKSQEXZNSHZJBV-OALUTQOASA-N 2 0 351.538 4.434 20 0 FIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000474350308 1093703945 /nfs/dbraw/zinc/70/39/45/1093703945.db2.gz IMXONACKUWQWPD-UHFFFAOYSA-N 2 0 372.940 4.149 20 0 FIADRP C[C@@H]1CC(N[C@H]2CC[N@H+](CC3CCCC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168034086 1093738560 /nfs/dbraw/zinc/73/85/60/1093738560.db2.gz OHFUEWBGNDUZNT-VIZSFHNOSA-N 2 0 369.597 4.282 20 0 FIADRP CCOC(=O)[C@H]1CCCC[C@H]1[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168034642 1093750326 /nfs/dbraw/zinc/75/03/26/1093750326.db2.gz QHZIRVNGORJXNB-YHDSQAASSA-N 2 0 372.553 4.140 20 0 FIADRP C[C@H]1CC([NH2+]CC[C@@H](O)c2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168035071 1093791838 /nfs/dbraw/zinc/79/18/38/1093791838.db2.gz SMWQPCYCNSNXRW-SFYKDHMMSA-N 2 0 352.522 4.141 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)C1CCSCC1 ZINC000474491600 1093843869 /nfs/dbraw/zinc/84/38/69/1093843869.db2.gz QMHLYDYOFVNJLI-QGZVFWFLSA-N 2 0 350.572 4.029 20 0 FIADRP C[N@H+](CCCCOc1cccc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513152985 1093911459 /nfs/dbraw/zinc/91/14/59/1093911459.db2.gz HHAAVBCKFBOXKO-JWTNVVGKSA-N 2 0 370.459 4.421 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000513337691 1094064320 /nfs/dbraw/zinc/06/43/20/1094064320.db2.gz JMDUIDIDWBMCCU-VOSMRYOYSA-N 2 0 364.533 4.348 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(OC)c1 ZINC000513510501 1094184689 /nfs/dbraw/zinc/18/46/89/1094184689.db2.gz DDNMHCOUICJICE-UYAOXDASSA-N 2 0 368.521 4.094 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(OC)c1 ZINC000513510499 1094184938 /nfs/dbraw/zinc/18/49/38/1094184938.db2.gz DDNMHCOUICJICE-ICSRJNTNSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]CC2=Cc3ccccc3OC2)C[N@@H+]1Cc1ccccc1 ZINC000513513838 1094186568 /nfs/dbraw/zinc/18/65/68/1094186568.db2.gz UWKXZBBWDVQKNG-TZIWHRDSSA-N 2 0 362.517 4.353 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)C3CCCCC3)c2)[C@@H]2CCC[C@H]21 ZINC000513667013 1094264215 /nfs/dbraw/zinc/26/42/15/1094264215.db2.gz PFTMIWSXYNXPLW-FDFHNCONSA-N 2 0 369.553 4.168 20 0 FIADRP C[C@H]1CC(N[C@H](CO)c2ccccc2Cl)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168036620 1094294661 /nfs/dbraw/zinc/29/46/61/1094294661.db2.gz VIXZYQONZYWNSD-PNLZDCPESA-N 2 0 372.940 4.405 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474596994 1094376614 /nfs/dbraw/zinc/37/66/14/1094376614.db2.gz IHBMSHGEOMAMJQ-BRSBDYLESA-N 2 0 352.950 4.311 20 0 FIADRP COCCC[NH+]1CCC(NCc2c(Cl)cccc2SC(C)C)CC1 ZINC000474602998 1094389392 /nfs/dbraw/zinc/38/93/92/1094389392.db2.gz DEZMCIZNRMSVPB-UHFFFAOYSA-N 2 0 370.990 4.431 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000501006089 1094416483 /nfs/dbraw/zinc/41/64/83/1094416483.db2.gz FJOVEDQTCDCDMJ-QFIPXVFZSA-N 2 0 361.549 4.063 20 0 FIADRP CC(C)c1ccc(C[C@H]2CC[N@@H+](CCCN3CC[NH+](C(C)C)CC3)C2)cc1 ZINC000501030363 1094430031 /nfs/dbraw/zinc/43/00/31/1094430031.db2.gz UTJPGYTVRRLGKD-HSZRJFAPSA-N 2 0 371.613 4.091 20 0 FIADRP C[C@@H]1C[C@@H](N2CCC([NH+]3CCCCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039011 1094439266 /nfs/dbraw/zinc/43/92/66/1094439266.db2.gz AVPLUEQLBQFJNB-RUMRUAAYSA-N 2 0 369.597 4.378 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501135533 1094523992 /nfs/dbraw/zinc/52/39/92/1094523992.db2.gz PKCQDAPGMWBBOE-KRWDZBQOSA-N 2 0 371.491 4.114 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CCCCC1 ZINC000474720100 1094540035 /nfs/dbraw/zinc/54/00/35/1094540035.db2.gz ORLUKERUKNQJAI-IBGZPJMESA-N 2 0 374.569 4.235 20 0 FIADRP CC(C)[NH+]1CCC(O)(C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474794719 1094608935 /nfs/dbraw/zinc/60/89/35/1094608935.db2.gz KPXHOQOJTUHQSY-UHFFFAOYSA-N 2 0 373.368 4.141 20 0 FIADRP Fc1ccc(C(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccc(F)cc2)cc1 ZINC000501404008 1094696437 /nfs/dbraw/zinc/69/64/37/1094696437.db2.gz FDRAPBHRRPYMRL-RTWAWAEBSA-N 2 0 356.460 4.313 20 0 FIADRP Clc1ccc(CCC[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1 ZINC000420313747 1094878200 /nfs/dbraw/zinc/87/82/00/1094878200.db2.gz PVUSAXUAVSTZKU-NRFANRHFSA-N 2 0 357.929 4.312 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C[NH3+])c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000420364467 1094901194 /nfs/dbraw/zinc/90/11/94/1094901194.db2.gz CWRWOYWOUXKRRG-QAPCUYQASA-N 2 0 364.436 4.080 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)nc(-c2ccc(Cl)cc2)n1 ZINC000420390974 1094909576 /nfs/dbraw/zinc/90/95/76/1094909576.db2.gz IEAXLRAAIHNERE-PXNSSMCTSA-N 2 0 370.928 4.069 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000420416906 1094913902 /nfs/dbraw/zinc/91/39/02/1094913902.db2.gz WAXHYJDNMNBJSY-UKRRQHHQSA-N 2 0 352.400 4.107 20 0 FIADRP C[C@@H](C(=O)Nc1cccc2ccccc21)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501788020 1094924738 /nfs/dbraw/zinc/92/47/38/1094924738.db2.gz CDPKMPGOBRQIBB-SFHVURJKSA-N 2 0 367.537 4.221 20 0 FIADRP CC(C)C[C@@H](C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1)c1ccccc1 ZINC000474935485 1094934245 /nfs/dbraw/zinc/93/42/45/1094934245.db2.gz VEOCRKZRYNZNJU-QHCPKHFHSA-N 2 0 371.613 4.166 20 0 FIADRP C[C@H](CC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)OCc1ccccc1 ZINC000474960308 1094951268 /nfs/dbraw/zinc/95/12/68/1094951268.db2.gz OCUMPSZDQMGYLW-HXUWFJFHSA-N 2 0 367.537 4.225 20 0 FIADRP CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000502059016 1095077095 /nfs/dbraw/zinc/07/70/95/1095077095.db2.gz VHRQNFNWRLLPCZ-REWPJTCUSA-N 2 0 374.569 4.235 20 0 FIADRP CCc1ccc(C[NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)s1 ZINC000237144715 1095200931 /nfs/dbraw/zinc/20/09/31/1095200931.db2.gz ZFSRPXHXBXXUFX-UHFFFAOYSA-N 2 0 363.958 4.006 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCO[C@]3(CCSC3)C2)CC1 ZINC000280953144 1095462520 /nfs/dbraw/zinc/46/25/20/1095462520.db2.gz IWLADRHVKYSOJF-OEXSPLCWSA-N 2 0 374.594 4.074 20 0 FIADRP FC(F)(F)c1ncc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000443988752 1095588229 /nfs/dbraw/zinc/58/82/29/1095588229.db2.gz JSSADKYEYKSGMB-UHFFFAOYSA-N 2 0 369.456 4.164 20 0 FIADRP CC[N@H+](CCCCn1ccnc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000502693894 1095717357 /nfs/dbraw/zinc/71/73/57/1095717357.db2.gz LXRFROCERYZJBB-DENIHFKCSA-N 2 0 354.542 4.129 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)oc1C ZINC000502699454 1095722363 /nfs/dbraw/zinc/72/23/63/1095722363.db2.gz YYVOKKWCZDKNPE-KURKYZTESA-N 2 0 356.510 4.356 20 0 FIADRP COCCC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000281933380 1095747493 /nfs/dbraw/zinc/74/74/93/1095747493.db2.gz KOXKKVIHJNPIQD-QFIPXVFZSA-N 2 0 374.500 4.024 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CC2)c(F)c1 ZINC000421823953 1095937189 /nfs/dbraw/zinc/93/71/89/1095937189.db2.gz GDGHXXAAOLIOBN-QFIPXVFZSA-N 2 0 372.484 4.016 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccncc2Cl)cc1 ZINC000421823397 1095937382 /nfs/dbraw/zinc/93/73/82/1095937382.db2.gz ZKIWFUJUBQHQAV-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000503162527 1096100965 /nfs/dbraw/zinc/10/09/65/1096100965.db2.gz VBAUMFGEYBXHRI-YRXWBPOGSA-N 2 0 357.542 4.261 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000503162526 1096101249 /nfs/dbraw/zinc/10/12/49/1096101249.db2.gz VBAUMFGEYBXHRI-XWSJACJDSA-N 2 0 357.542 4.261 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3=CC[N@H+](C)CC3)s2)cc1 ZINC000271817147 1096131081 /nfs/dbraw/zinc/13/10/81/1096131081.db2.gz BSGUNQHTZLXYGZ-AWEZNQCLSA-N 2 0 357.523 4.040 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](COc1ccccc1F)C(C)(C)C ZINC000422710987 1096459822 /nfs/dbraw/zinc/45/98/22/1096459822.db2.gz METPSSDPVMCIBD-QRWLVFNGSA-N 2 0 359.489 4.132 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](COc1ccccc1F)C(C)(C)C ZINC000422710985 1096460122 /nfs/dbraw/zinc/46/01/22/1096460122.db2.gz METPSSDPVMCIBD-FOIQADDNSA-N 2 0 359.489 4.132 20 0 FIADRP CC(C)CC(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422720770 1096470422 /nfs/dbraw/zinc/47/04/22/1096470422.db2.gz MVBZRXKFRSTJTH-PWRODBHTSA-N 2 0 357.542 4.072 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422720673 1096470569 /nfs/dbraw/zinc/47/05/69/1096470569.db2.gz SWYHGLKKNRZIRF-IBGZPJMESA-N 2 0 362.521 4.206 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1OC ZINC000422724093 1096471744 /nfs/dbraw/zinc/47/17/44/1096471744.db2.gz UJVBIKBGJILSPH-CGTJXYLNSA-N 2 0 366.933 4.148 20 0 FIADRP FC(F)(F)c1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422759272 1096475394 /nfs/dbraw/zinc/47/53/94/1096475394.db2.gz KZCCUZVMXRNPRE-PKOBYXMFSA-N 2 0 362.395 4.051 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(-c2ccncc2)cc1 ZINC000422754794 1096483936 /nfs/dbraw/zinc/48/39/36/1096483936.db2.gz ATTZZNFQFNTTNW-UPVQGACJSA-N 2 0 371.484 4.094 20 0 FIADRP [NH3+][C@H]1C[C@@H](NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000422778893 1096488830 /nfs/dbraw/zinc/48/88/30/1096488830.db2.gz FGMKEJRPCHZNAT-LEWJYISDSA-N 2 0 355.913 4.039 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422778490 1096489045 /nfs/dbraw/zinc/48/90/45/1096489045.db2.gz AQMHRVPXUANCCB-AWEZNQCLSA-N 2 0 367.415 4.500 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2cc(F)ccc2F)c1 ZINC000422785355 1096489960 /nfs/dbraw/zinc/48/99/60/1096489960.db2.gz JKTBDKCVVVSARW-YJYMSZOUSA-N 2 0 350.478 4.493 20 0 FIADRP FC(F)(F)COc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422805591 1096496523 /nfs/dbraw/zinc/49/65/23/1096496523.db2.gz MEPDOFCCRJQSTF-OKZBNKHCSA-N 2 0 356.432 4.028 20 0 FIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422838327 1096502640 /nfs/dbraw/zinc/50/26/40/1096502640.db2.gz OEFCWPBFAPSKKT-PCCBWWKXSA-N 2 0 374.594 4.147 20 0 FIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422866579 1096508055 /nfs/dbraw/zinc/50/80/55/1096508055.db2.gz QSFYSTFSJCAPTQ-TZIWHRDSSA-N 2 0 372.509 4.034 20 0 FIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422879458 1096510800 /nfs/dbraw/zinc/51/08/00/1096510800.db2.gz KNIWLESRRUCGLG-LXBDKUERSA-N 2 0 366.505 4.380 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000422879570 1096511096 /nfs/dbraw/zinc/51/10/96/1096511096.db2.gz MOZCNRSVMCZAIJ-VIZZQPHQSA-N 2 0 360.860 4.386 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000422879529 1096511254 /nfs/dbraw/zinc/51/12/54/1096511254.db2.gz MIWHVNJFTVYURV-SLFFLAALSA-N 2 0 364.961 4.145 20 0 FIADRP c1ccc(Sc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422891740 1096512258 /nfs/dbraw/zinc/51/22/58/1096512258.db2.gz WHQBWQPZMRKFKQ-QHAWAJNXSA-N 2 0 368.546 4.085 20 0 FIADRP Fc1ccc(Oc2ccnc(CN[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2)cc1 ZINC000422886278 1096512944 /nfs/dbraw/zinc/51/29/44/1096512944.db2.gz IRNMASFDOKZXPK-FDFHNCONSA-N 2 0 369.484 4.413 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000422886581 1096513870 /nfs/dbraw/zinc/51/38/70/1096513870.db2.gz XCCPQPFGSMQNBW-MSOLQXFVSA-N 3 0 366.553 4.074 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422897366 1096517954 /nfs/dbraw/zinc/51/79/54/1096517954.db2.gz ZTGMLPXVTALCOD-GMAHTHKFSA-N 2 0 366.505 4.211 20 0 FIADRP CC(C)COc1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422894689 1096524813 /nfs/dbraw/zinc/52/48/13/1096524813.db2.gz CVUDGQQNIBORIU-GMAHTHKFSA-N 2 0 366.505 4.067 20 0 FIADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCN(c2nc3ccccc3s2)CC1 ZINC000422929960 1096527603 /nfs/dbraw/zinc/52/76/03/1096527603.db2.gz ANJCEJKLWZYNSZ-WMZOPIPTSA-N 2 0 372.582 4.166 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000422936969 1096528967 /nfs/dbraw/zinc/52/89/67/1096528967.db2.gz NJCTZPFMTPGZIA-QWHCGFSZSA-N 2 0 351.416 4.149 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422943866 1096529491 /nfs/dbraw/zinc/52/94/91/1096529491.db2.gz LCJLVPRNEUPHCV-FCGDIQPGSA-N 2 0 362.583 4.324 20 0 FIADRP c1nc2ccccc2n1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422935651 1096529552 /nfs/dbraw/zinc/52/95/52/1096529552.db2.gz HGIYWEFDOWAZHB-BHDDXSALSA-N 2 0 374.532 4.095 20 0 FIADRP Clc1ccc(C2([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422937590 1096529925 /nfs/dbraw/zinc/52/99/25/1096529925.db2.gz OIRZQUGDXAUATJ-QUCCMNQESA-N 2 0 354.881 4.175 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1C[NH3+])C1CCCCC1 ZINC000414705573 1096531678 /nfs/dbraw/zinc/53/16/78/1096531678.db2.gz FMYAAWYPQQDCNF-PXNSSMCTSA-N 2 0 372.557 4.090 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954626 1096539075 /nfs/dbraw/zinc/53/90/75/1096539075.db2.gz JKKFPFJPNGILLM-DIFFPNOSSA-N 2 0 350.293 4.494 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422990331 1096539982 /nfs/dbraw/zinc/53/99/82/1096539982.db2.gz BQXSUENXLMXBDJ-PKTZIBPZSA-N 2 0 361.489 4.146 20 0 FIADRP CC(C)c1ccccc1OCC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422960320 1096540602 /nfs/dbraw/zinc/54/06/02/1096540602.db2.gz VUAIRGKYALFVQN-NFBKMPQASA-N 2 0 366.505 4.034 20 0 FIADRP Brc1cccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)c1 ZINC000422990834 1096541517 /nfs/dbraw/zinc/54/15/17/1096541517.db2.gz AAXSNNGUQGYWKP-JWTNVVGKSA-N 2 0 363.343 4.134 20 0 FIADRP CCC(CC)(C[NH3+])NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414709323 1096542516 /nfs/dbraw/zinc/54/25/16/1096542516.db2.gz JRRBOZRVQZIPHZ-UHFFFAOYSA-N 2 0 360.546 4.090 20 0 FIADRP FC(F)(F)COCc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423000700 1096546624 /nfs/dbraw/zinc/54/66/24/1096546624.db2.gz HEMJRCWGXKUGTE-IPMKNSEASA-N 2 0 370.459 4.166 20 0 FIADRP c1ccc(Sc2ccc(C[NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000423001717 1096546890 /nfs/dbraw/zinc/54/68/90/1096546890.db2.gz XNXMKDUORYIMNP-BHIFYINESA-N 2 0 368.546 4.085 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]CC1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC000423008070 1096547836 /nfs/dbraw/zinc/54/78/36/1096547836.db2.gz ZGAVQXIREIBJIF-IOMROCGXSA-N 2 0 358.570 4.138 20 0 FIADRP Cc1cc([C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)ccc1F ZINC000423009857 1096549107 /nfs/dbraw/zinc/54/91/07/1096549107.db2.gz FEQPAABCBBNGHC-WWNPGLIZSA-N 2 0 366.480 4.431 20 0 FIADRP CC(C)(C)c1ccc(C(C)(C)C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000423015077 1096550059 /nfs/dbraw/zinc/55/00/59/1096550059.db2.gz QJOCFGHMXFSVLR-NJDAHSKKSA-N 2 0 358.570 4.008 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CC(F)(F)F)c1ccc(Br)cc1 ZINC000423041886 1096558239 /nfs/dbraw/zinc/55/82/39/1096558239.db2.gz YALSNMVZOVVSLN-GWCFXTLKSA-N 2 0 353.226 4.160 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccc(C(F)(F)F)cc1 ZINC000423066828 1096562298 /nfs/dbraw/zinc/56/22/98/1096562298.db2.gz FKGISMPIBNHSLJ-ZDUSSCGKSA-N 2 0 365.443 4.496 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000423077654 1096565954 /nfs/dbraw/zinc/56/59/54/1096565954.db2.gz MNTXFWXNKUDGLF-CQSZACIVSA-N 2 0 359.464 4.290 20 0 FIADRP Fc1cccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423094002 1096572853 /nfs/dbraw/zinc/57/28/53/1096572853.db2.gz IWKVEJDEHJQUDE-DYJCROTPSA-N 2 0 366.480 4.307 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423125468 1096580280 /nfs/dbraw/zinc/58/02/80/1096580280.db2.gz QNPDEEZBOGMIKP-ZBEGNZNMSA-N 2 0 350.304 4.025 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423113088 1096586173 /nfs/dbraw/zinc/58/61/73/1096586173.db2.gz YIVXSSRVGYSJLT-SPLOXXLWSA-N 2 0 373.928 4.321 20 0 FIADRP Fc1cc(F)c2c(c1)[C@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146246 1096587216 /nfs/dbraw/zinc/58/72/16/1096587216.db2.gz OVMVWBVCASAQOH-URVUXULASA-N 2 0 370.443 4.188 20 0 FIADRP FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423153391 1096588589 /nfs/dbraw/zinc/58/85/89/1096588589.db2.gz GKVOIGFPQHLEAA-XPYUAMARSA-N 2 0 368.443 4.343 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1OC(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503909255 1096592829 /nfs/dbraw/zinc/59/28/29/1096592829.db2.gz LEIKDJJSYKQBRF-QXCFHYIPSA-N 2 0 352.469 4.037 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH+]1CCC(Cc2cc(F)ccc2F)CC1 ZINC000423164846 1096599459 /nfs/dbraw/zinc/59/94/59/1096599459.db2.gz TUICRSQWJMEPQV-HNNXBMFYSA-N 2 0 359.464 4.143 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423213735 1096616011 /nfs/dbraw/zinc/61/60/11/1096616011.db2.gz NXMBVXZJIDNWNO-GHMZBOCLSA-N 2 0 365.237 4.118 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]C2CCC([NH3+])CC2)nc1 ZINC000423234071 1096617106 /nfs/dbraw/zinc/61/71/06/1096617106.db2.gz PASPIWAWLFENOO-AOMIVXANSA-N 2 0 371.956 4.311 20 0 FIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH3+])CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000423214608 1096618150 /nfs/dbraw/zinc/61/81/50/1096618150.db2.gz LLTQVHYNILHGGC-QGLTVNCISA-N 2 0 367.324 4.408 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]C[C@@H]2CCC[NH2+]C2)nc1 ZINC000423214065 1096619393 /nfs/dbraw/zinc/61/93/93/1096619393.db2.gz OJGNPGNQYFRWHF-DENIHFKCSA-N 2 0 371.956 4.040 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423222142 1096622666 /nfs/dbraw/zinc/62/26/66/1096622666.db2.gz ZVNWLAHDLNGLHG-RYQLBKOJSA-N 2 0 355.551 4.474 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Br)c1 ZINC000423291103 1096635798 /nfs/dbraw/zinc/63/57/98/1096635798.db2.gz GUHIXOAOLHSIJH-CHWSQXEVSA-N 2 0 363.299 4.328 20 0 FIADRP C[C@H]1C[C@@H](C[NH+]2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]1 ZINC000414731233 1096641539 /nfs/dbraw/zinc/64/15/39/1096641539.db2.gz AHLALPPYEAKRCO-GJZGRUSLSA-N 2 0 371.352 4.363 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000423317803 1096642126 /nfs/dbraw/zinc/64/21/26/1096642126.db2.gz AZOCICPYEOCOCG-NSHDSACASA-N 2 0 368.344 4.271 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OC(F)F ZINC000423293827 1096643445 /nfs/dbraw/zinc/64/34/45/1096643445.db2.gz SDLCTNDBAJJQDS-OLZOCXBDSA-N 2 0 350.409 4.167 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423297291 1096644632 /nfs/dbraw/zinc/64/46/32/1096644632.db2.gz JQRCOFLPIRCRBF-MNOVXSKESA-N 2 0 368.344 4.126 20 0 FIADRP C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@H]1CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423339597 1096650839 /nfs/dbraw/zinc/65/08/39/1096650839.db2.gz IYPOWVWGVJQZJP-HUUMMWPTSA-N 2 0 366.549 4.126 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1Cl)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414739237 1096668545 /nfs/dbraw/zinc/66/85/45/1096668545.db2.gz PXUZRDQLVRJUMJ-KBPBESRZSA-N 2 0 372.340 4.032 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423426558 1096671632 /nfs/dbraw/zinc/67/16/32/1096671632.db2.gz FILZYNOEGKQTOP-AFAVFJNCSA-N 2 0 358.473 4.380 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000423427729 1096674707 /nfs/dbraw/zinc/67/47/07/1096674707.db2.gz ISIRVUAJAIINPN-ROUUACIJSA-N 2 0 366.509 4.081 20 0 FIADRP COCC1(C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)CC[NH2+]CC1 ZINC000423413309 1096674917 /nfs/dbraw/zinc/67/49/17/1096674917.db2.gz YTLZPJLHAWDGJU-GFCCVEGCSA-N 2 0 363.354 4.038 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H](C)CCC[NH3+])cnn1-c1ccc(Cl)cc1Cl ZINC000423458600 1096689666 /nfs/dbraw/zinc/68/96/66/1096689666.db2.gz QGYSLERVXVWONQ-NEPJUHHUSA-N 2 0 355.313 4.266 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1nccc2ccccc21 ZINC000423463997 1096691799 /nfs/dbraw/zinc/69/17/99/1096691799.db2.gz GHPBYFBZHRVICO-LKUPVBHCSA-N 2 0 363.480 4.418 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)CCC3)cc1 ZINC000423472141 1096694007 /nfs/dbraw/zinc/69/40/07/1096694007.db2.gz MQNZYRYYOPQCEJ-QGPMSJSTSA-N 2 0 371.550 4.303 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cnc2ccsc2c1 ZINC000423474447 1096695248 /nfs/dbraw/zinc/69/52/48/1096695248.db2.gz OXOONVQYCWCYEI-DKSSEZFCSA-N 2 0 369.509 4.479 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000423508623 1096702312 /nfs/dbraw/zinc/70/23/12/1096702312.db2.gz NUKXLGXCINBGPS-CCKFTAQKSA-N 2 0 359.311 4.256 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2ccccc2Br)C1 ZINC000423508803 1096702637 /nfs/dbraw/zinc/70/26/37/1096702637.db2.gz OFBODZWTIFUPHH-IDHHARJASA-N 2 0 359.311 4.256 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000423496280 1096707922 /nfs/dbraw/zinc/70/79/22/1096707922.db2.gz GKCGSLBYHBVKSY-MDASCCDHSA-N 2 0 359.311 4.256 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423550591 1096719206 /nfs/dbraw/zinc/71/92/06/1096719206.db2.gz SWNURGWCDFOWTC-XJWCYLOLSA-N 2 0 352.444 4.319 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(F)cc(Br)c1 ZINC000423553213 1096720017 /nfs/dbraw/zinc/72/00/17/1096720017.db2.gz VZBOEKNHEGVAKZ-BHADISHBSA-N 2 0 355.295 4.017 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000423579730 1096725142 /nfs/dbraw/zinc/72/51/42/1096725142.db2.gz WQIFQZBOPLJLFT-SFHVURJKSA-N 2 0 369.578 4.053 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)cc1 ZINC000423842201 1096775704 /nfs/dbraw/zinc/77/57/04/1096775704.db2.gz KBUAEAVROUPRLR-SFHVURJKSA-N 2 0 365.521 4.233 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000436233567 1098856056 /nfs/dbraw/zinc/85/60/56/1098856056.db2.gz TVTLEZASLNVVED-FGZHOGPDSA-N 2 0 352.522 4.095 20 0 FIADRP CCCO[C@H]1CCC[NH+](CC(C)C[N@H+]2CCC[C@H](OCCC)CC2)CC1 ZINC000533280629 1098944864 /nfs/dbraw/zinc/94/48/64/1098944864.db2.gz LRGIUMLOLVNAOK-VXKWHMMOSA-N 2 0 368.606 4.185 20 0 FIADRP C[C@H]1OCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000533362465 1098981128 /nfs/dbraw/zinc/98/11/28/1098981128.db2.gz XDUKHRVGQRRYRX-WZONZLPQSA-N 2 0 350.506 4.216 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1cccc(N2CC[NH+](C)CC2)c1 ZINC001211994291 1099156558 /nfs/dbraw/zinc/15/65/58/1099156558.db2.gz QVLYNPFLHZTCMT-UHFFFAOYSA-N 2 0 352.526 4.024 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1c(F)cccc1N1CC[NH+](C)CC1 ZINC001211996331 1099218033 /nfs/dbraw/zinc/21/80/33/1099218033.db2.gz WBZMWZOVTXFEEG-UHFFFAOYSA-N 2 0 370.516 4.163 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OCc1cccnc1 ZINC000067691377 1099487934 /nfs/dbraw/zinc/48/79/34/1099487934.db2.gz RQWZDIDIIZEQPM-FQEVSTJZSA-N 2 0 367.537 4.405 20 0 FIADRP CC1(C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC[NH2+]CC1 ZINC000414898490 1099620238 /nfs/dbraw/zinc/62/02/38/1099620238.db2.gz GCWIWCZMJUHMHZ-UHFFFAOYSA-N 2 0 371.912 4.072 20 0 FIADRP FC(F)(F)Oc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167961934 1099750327 /nfs/dbraw/zinc/75/03/27/1099750327.db2.gz QQNHOILBXWAQRT-ALOPSCKCSA-N 2 0 354.416 4.080 20 0 FIADRP C[NH2+]CCc1ccccc1C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000516773626 1099789926 /nfs/dbraw/zinc/78/99/26/1099789926.db2.gz XQEPPPXWPBXTJL-SFHVURJKSA-N 2 0 365.521 4.075 20 0 FIADRP C[C@H]([NH2+]CCOCc1ccc(Cl)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693517 1099825231 /nfs/dbraw/zinc/82/52/31/1099825231.db2.gz CVCMDXPYEWRFFT-RXVVDRJESA-N 2 0 372.940 4.357 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508697996 1099830307 /nfs/dbraw/zinc/83/03/07/1099830307.db2.gz KPYCSKMQAGRMIZ-FUPPJEDESA-N 3 0 357.586 4.141 20 0 FIADRP C[C@@H](NCCC[N@H+](C)C1CCCCC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508699233 1099833355 /nfs/dbraw/zinc/83/33/55/1099833355.db2.gz NRMSSHLNPVEMOW-IFMALSPDSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@H](NCCC[N@H+](C)C1CCCCC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508699238 1099833960 /nfs/dbraw/zinc/83/39/60/1099833960.db2.gz NRMSSHLNPVEMOW-UNMCSNQZSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1Cl ZINC000162550952 1099835662 /nfs/dbraw/zinc/83/56/62/1099835662.db2.gz KEGMLPSZHGZNOS-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000508703637 1099858217 /nfs/dbraw/zinc/85/82/17/1099858217.db2.gz ZEWFWECILGOBCE-JTAQYXEDSA-N 2 0 374.532 4.434 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)o1 ZINC000079919043 1099863116 /nfs/dbraw/zinc/86/31/16/1099863116.db2.gz HIZTVQVPTSZPNG-UHFFFAOYSA-N 2 0 352.482 4.108 20 0 FIADRP COc1c(F)cc(F)cc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001143563060 1099869316 /nfs/dbraw/zinc/86/93/16/1099869316.db2.gz LAHGQIIYMIGEEQ-UHFFFAOYSA-N 2 0 374.475 4.317 20 0 FIADRP C[C@H]([NH2+]CCCCN(C)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715622 1099885627 /nfs/dbraw/zinc/88/56/27/1099885627.db2.gz DRVUWMFURVRBBB-JTHBVZDNSA-N 2 0 365.565 4.403 20 0 FIADRP COc1cc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508717887 1099907923 /nfs/dbraw/zinc/90/79/23/1099907923.db2.gz MQRAWUKTVMYHBN-SIKLNZKXSA-N 2 0 352.522 4.046 20 0 FIADRP CO[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000508721164 1099939120 /nfs/dbraw/zinc/93/91/20/1099939120.db2.gz UANVVRIKQWTLBG-RBDMOPTHSA-N 2 0 356.485 4.013 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)Cc1ccccc1 ZINC000508720926 1099939392 /nfs/dbraw/zinc/93/93/92/1099939392.db2.gz NWSOJSNYWGPJPN-ZFGGDYGUSA-N 2 0 365.565 4.007 20 0 FIADRP CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)C[NH2+]CC2 ZINC000517034929 1099996337 /nfs/dbraw/zinc/99/63/37/1099996337.db2.gz CPKHWLCLRCRZMN-JOCHJYFZSA-N 2 0 360.505 4.039 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnn(Cc3ccc(F)cc3)c2)CC1 ZINC000437580611 1099997884 /nfs/dbraw/zinc/99/78/84/1099997884.db2.gz NUOCGBOOVJFIFL-UHFFFAOYSA-N 2 0 372.532 4.014 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000509700259 1100072085 /nfs/dbraw/zinc/07/20/85/1100072085.db2.gz TWFUKLNMDHCUAL-UHFFFAOYSA-N 2 0 374.532 4.363 20 0 FIADRP CCCOc1c(Cl)cc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1OCC ZINC000261947319 1100126178 /nfs/dbraw/zinc/12/61/78/1100126178.db2.gz FNAHCFPPAOLKMT-UHFFFAOYSA-N 2 0 366.933 4.103 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2c(C)nc3scc(C4CC4)n23)c1 ZINC000459413680 1100136266 /nfs/dbraw/zinc/13/62/66/1100136266.db2.gz USKZGHZYVJXMQL-UHFFFAOYSA-N 2 0 368.550 4.323 20 0 FIADRP CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459447348 1100182960 /nfs/dbraw/zinc/18/29/60/1100182960.db2.gz QJKGZTUBIWMIKR-FOIQADDNSA-N 2 0 359.901 4.070 20 0 FIADRP C[C@@H](Cc1cccc(Br)c1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459458732 1100203068 /nfs/dbraw/zinc/20/30/68/1100203068.db2.gz DSMFTDZNFARGAV-HNNXBMFYSA-N 2 0 374.326 4.034 20 0 FIADRP COc1cccc([C@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000536703542 1100208751 /nfs/dbraw/zinc/20/87/51/1100208751.db2.gz ROBGJFMOZXXRDJ-SFHVURJKSA-N 2 0 353.510 4.390 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000379628414 1100244095 /nfs/dbraw/zinc/24/40/95/1100244095.db2.gz IXHGKJJKKQZJSB-KNKQGSTJSA-N 2 0 352.522 4.356 20 0 FIADRP CCCn1ccnc1CCC[N@H+](C)Cc1cc(Cl)c(O)c(OCC)c1 ZINC000459551035 1100298812 /nfs/dbraw/zinc/29/88/12/1100298812.db2.gz LTLXRLRHOWXWNE-UHFFFAOYSA-N 2 0 365.905 4.115 20 0 FIADRP COc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000425934567 1100314304 /nfs/dbraw/zinc/31/43/04/1100314304.db2.gz DCDCXOBDHZPEME-JOCHJYFZSA-N 2 0 364.533 4.054 20 0 FIADRP Fc1cc(C(F)(F)F)c(F)cc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459567451 1100317096 /nfs/dbraw/zinc/31/70/96/1100317096.db2.gz VYTWGZAUHBOZDR-UHFFFAOYSA-N 2 0 371.353 4.137 20 0 FIADRP CC[C@@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000536830783 1100329421 /nfs/dbraw/zinc/32/94/21/1100329421.db2.gz CQKAXJJQHYVVTA-OAQYLSRUSA-N 2 0 354.542 4.153 20 0 FIADRP Cc1ccc2cc(C[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)ccc2n1 ZINC000437991753 1100355259 /nfs/dbraw/zinc/35/52/59/1100355259.db2.gz YGGXSVSKRZZTHC-UHFFFAOYSA-N 2 0 360.505 4.287 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000536855087 1100371356 /nfs/dbraw/zinc/37/13/56/1100371356.db2.gz YHXLYEYVGOAFDR-ORYQWCPZSA-N 2 0 362.583 4.217 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000438093287 1100416343 /nfs/dbraw/zinc/41/63/43/1100416343.db2.gz BUIKPXMIUOOSRJ-FYYLOGMGSA-N 2 0 358.570 4.320 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)Cc3ccccc3F)CC2)cc1 ZINC000438210722 1100513313 /nfs/dbraw/zinc/51/33/13/1100513313.db2.gz DYYQEYDMVWOGSS-SFHVURJKSA-N 2 0 370.512 4.267 20 0 FIADRP COCC1(C[NH2+]Cc2ccc(-c3ccccc3Cl)s2)CC[NH2+]CC1 ZINC000414941288 1100852864 /nfs/dbraw/zinc/85/28/64/1100852864.db2.gz ABZAZKBAAJFABB-UHFFFAOYSA-N 2 0 364.942 4.174 20 0 FIADRP FC(F)(F)c1cc(Br)cc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000414981511 1101162379 /nfs/dbraw/zinc/16/23/79/1101162379.db2.gz XXDWVHDJTQNTCO-AWEZNQCLSA-N 2 0 365.237 4.090 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@H]1OCCc2sccc21 ZINC000426308179 1101240774 /nfs/dbraw/zinc/24/07/74/1101240774.db2.gz VDNJEOLFCQDSDX-GCKMJXCFSA-N 2 0 374.550 4.042 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(c2cccc(Br)c2)CC1 ZINC000439325026 1101347463 /nfs/dbraw/zinc/34/74/63/1101347463.db2.gz HRCGLBOUEZFNQV-SFHVURJKSA-N 2 0 351.332 4.113 20 0 FIADRP CC(C)[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000536963024 1101358706 /nfs/dbraw/zinc/35/87/06/1101358706.db2.gz NOEKHOMBTBITOY-FQEVSTJZSA-N 2 0 359.514 4.475 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000537104860 1101451155 /nfs/dbraw/zinc/45/11/55/1101451155.db2.gz XQFAYWSPEYLCGO-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1cncs1 ZINC000537093172 1101459970 /nfs/dbraw/zinc/45/99/70/1101459970.db2.gz AANNPMVQVYOPRD-KSZLIROESA-N 2 0 373.566 4.003 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1cncs1 ZINC000537093171 1101460281 /nfs/dbraw/zinc/46/02/81/1101460281.db2.gz AANNPMVQVYOPRD-FGTMMUONSA-N 2 0 373.566 4.003 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)C1 ZINC000518750250 1101502104 /nfs/dbraw/zinc/50/21/04/1101502104.db2.gz LLVMNOCMQQRPLM-SFHVURJKSA-N 2 0 352.526 4.097 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc(Br)cs2)C1 ZINC000518763528 1101519582 /nfs/dbraw/zinc/51/95/82/1101519582.db2.gz SQPAKFVCTBMAHY-OKILXGFUSA-N 2 0 359.377 4.358 20 0 FIADRP CC(C)[NH+](CCCN[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)C ZINC000537189938 1101541110 /nfs/dbraw/zinc/54/11/10/1101541110.db2.gz LOKDJLFPGMCKGT-OAQYLSRUSA-N 2 0 373.585 4.073 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCc3cc(F)ccc31)c1ccccc1O2 ZINC000537190025 1101541825 /nfs/dbraw/zinc/54/18/25/1101541825.db2.gz OFRYIDNGDILHQC-RTWAWAEBSA-N 2 0 366.480 4.391 20 0 FIADRP c1cnn(CCCCC[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000475748177 1101587443 /nfs/dbraw/zinc/58/74/43/1101587443.db2.gz MKUGIIBOZJABQA-HSZRJFAPSA-N 2 0 366.553 4.042 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000537295221 1101615101 /nfs/dbraw/zinc/61/51/01/1101615101.db2.gz PKEFPMUKGZLITB-UHFFFAOYSA-N 2 0 359.901 4.024 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)oc21 ZINC000537303644 1101627772 /nfs/dbraw/zinc/62/77/72/1101627772.db2.gz HEBAGZGGBGXKII-KSZLIROESA-N 2 0 374.525 4.372 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@H](C)O[C@@H](C)C3)oc21 ZINC000537303638 1101627966 /nfs/dbraw/zinc/62/79/66/1101627966.db2.gz HEBAGZGGBGXKII-BZSNNMDCSA-N 2 0 374.525 4.372 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N[C@@H](C)c2ccccc2C)CC1 ZINC000519222203 1102020249 /nfs/dbraw/zinc/02/02/49/1102020249.db2.gz SFFBTFOBBXAMNJ-PMACEKPBSA-N 2 0 373.585 4.005 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1OCC ZINC000415009032 1102047932 /nfs/dbraw/zinc/04/79/32/1102047932.db2.gz SZONBTMRHIUBKC-HOCLYGCPSA-N 2 0 354.922 4.135 20 0 FIADRP C[N@@H+](Cc1ccccc1)C[C@@H](C[NH+]1CC[C@]2(CCOC2)C1)c1ccccc1 ZINC001168184421 1102106732 /nfs/dbraw/zinc/10/67/32/1102106732.db2.gz PIAJMEMUOIXWFE-ZEQRLZLVSA-N 2 0 364.533 4.015 20 0 FIADRP Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1 ZINC001168284803 1102158180 /nfs/dbraw/zinc/15/81/80/1102158180.db2.gz NUGWBBOJSAKTFP-UEVCKROQSA-N 2 0 352.522 4.140 20 0 FIADRP CC(C)(C)c1ccncc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000666417192 1102191931 /nfs/dbraw/zinc/19/19/31/1102191931.db2.gz BWYNGASTNRLFNI-UHFFFAOYSA-N 2 0 367.537 4.144 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000415010849 1102221938 /nfs/dbraw/zinc/22/19/38/1102221938.db2.gz GVMYPXWJQFLXPR-GFCCVEGCSA-N 2 0 368.344 4.180 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC(OCC[NH+](C)C)CC3)s2)cc1 ZINC000537630429 1102228245 /nfs/dbraw/zinc/22/82/45/1102228245.db2.gz VZYKAXHACFVTKW-UHFFFAOYSA-N 2 0 358.551 4.266 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000415012835 1102248924 /nfs/dbraw/zinc/24/89/24/1102248924.db2.gz XRYDZVWRFGZCPO-ATLSCFEFSA-N 2 0 358.423 4.230 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(C(C)C)cc2)CC1 ZINC000061070346 1102257044 /nfs/dbraw/zinc/25/70/44/1102257044.db2.gz FFGWUYVAMZDLPG-UHFFFAOYSA-N 2 0 365.565 4.237 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1Cl ZINC000120876776 1102261230 /nfs/dbraw/zinc/26/12/30/1102261230.db2.gz KKNQRMJLFMHAJR-CYBMUJFWSA-N 2 0 350.865 4.400 20 0 FIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120964415 1102290735 /nfs/dbraw/zinc/29/07/35/1102290735.db2.gz IHJQBJZROUVSGQ-CYBMUJFWSA-N 2 0 350.865 4.400 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1OC(F)F ZINC000120973065 1102292113 /nfs/dbraw/zinc/29/21/13/1102292113.db2.gz UIZANEFSBREMLM-GFCCVEGCSA-N 2 0 370.390 4.479 20 0 FIADRP [NH3+]CCCc1nc2ccc(Cl)cc2n1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167967963 1102304097 /nfs/dbraw/zinc/30/40/97/1102304097.db2.gz MWOKUQFOTHMXAI-JWTNVVGKSA-N 2 0 372.944 4.159 20 0 FIADRP Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000187780780 1102316441 /nfs/dbraw/zinc/31/64/41/1102316441.db2.gz BYXUPDNCQYCIDD-ZIFCJYIRSA-N 2 0 352.526 4.114 20 0 FIADRP c1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CCOCC2)cc1 ZINC001167969254 1102365753 /nfs/dbraw/zinc/36/57/53/1102365753.db2.gz AVFGZPBVHHZWGC-WVUPVLJSSA-N 2 0 354.538 4.149 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3CCC[NH2+][C@@H]3c3ccccc3)n2)cc1 ZINC001211850196 1102377167 /nfs/dbraw/zinc/37/71/67/1102377167.db2.gz WLWLCGIDCKPFRT-WOJBJXKFSA-N 2 0 362.477 4.007 20 0 FIADRP COc1cc(C)ccc1[C@H](C)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485521 1102426493 /nfs/dbraw/zinc/42/64/93/1102426493.db2.gz SQTLPMXQBGSCJD-PZJWPPBQSA-N 2 0 352.522 4.219 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)C1CCOCC1 ZINC000532514567 1102449888 /nfs/dbraw/zinc/44/98/88/1102449888.db2.gz WMOKQMDBZVLXOS-OAQYLSRUSA-N 2 0 364.961 4.347 20 0 FIADRP Cc1c(Br)cccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167972786 1102503825 /nfs/dbraw/zinc/50/38/25/1102503825.db2.gz BNEGNGVYVGPWOE-AYHJJNSGSA-N 2 0 363.343 4.253 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000122361684 1102578555 /nfs/dbraw/zinc/57/85/55/1102578555.db2.gz UDHQXKMXDWMEBV-HXUWFJFHSA-N 2 0 366.505 4.163 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000550881722 1102653536 /nfs/dbraw/zinc/65/35/36/1102653536.db2.gz BFOHWTZCDGSBII-MLGOLLRUSA-N 2 0 373.766 4.310 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)ccn1 ZINC000550889756 1102661930 /nfs/dbraw/zinc/66/19/30/1102661930.db2.gz CZSLAWDJDWZNAK-QRVBRYPASA-N 2 0 367.537 4.419 20 0 FIADRP COc1cnccc1[C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000550911168 1102685859 /nfs/dbraw/zinc/68/58/59/1102685859.db2.gz METZQHLXWRMFTM-KKXNLOMOSA-N 2 0 353.510 4.184 20 0 FIADRP C[C@H](c1cnccn1)[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837042 1102697175 /nfs/dbraw/zinc/69/71/75/1102697175.db2.gz YYANQLCFTMVPCB-XMSQKQJNSA-N 2 0 364.537 4.160 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000123036663 1102751061 /nfs/dbraw/zinc/75/10/61/1102751061.db2.gz VJHPKNDVXRWPGT-GOSISDBHSA-N 2 0 355.551 4.469 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000123142820 1102791935 /nfs/dbraw/zinc/79/19/35/1102791935.db2.gz WRLKHLJCUIAVBI-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP C[C@H](CCN[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000551034752 1102824355 /nfs/dbraw/zinc/82/43/55/1102824355.db2.gz ONDWSQHSIROEJV-QDSKXPNFSA-N 2 0 365.565 4.322 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C2CCN(C3CC3)CC2)cc1 ZINC000459366340 1102930967 /nfs/dbraw/zinc/93/09/67/1102930967.db2.gz MVHPAYUEMKJDRZ-UHFFFAOYSA-N 2 0 363.549 4.132 20 0 FIADRP COc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)c(-c2ccccc2)cc1OC ZINC000506885664 1102932006 /nfs/dbraw/zinc/93/20/06/1102932006.db2.gz RIDWLCIWRYNBKD-UHFFFAOYSA-N 2 0 368.521 4.144 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000506874389 1102935426 /nfs/dbraw/zinc/93/54/26/1102935426.db2.gz JKDVFWWOTFWUII-UHFFFAOYSA-N 2 0 360.933 4.284 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+]C1CCN(C2CC2)CC1)C1CCCCC1 ZINC000459373730 1102999536 /nfs/dbraw/zinc/99/95/36/1102999536.db2.gz MYRRFJXESYCLRR-UHFFFAOYSA-N 2 0 355.570 4.168 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCCC[NH+]2CCCC2)CC1 ZINC000551262594 1103020100 /nfs/dbraw/zinc/02/01/00/1103020100.db2.gz DEEWPQVEHMHWLA-UHFFFAOYSA-N 3 0 357.586 4.285 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCCCN2C2CC2)CC1 ZINC000551278106 1103038499 /nfs/dbraw/zinc/03/84/99/1103038499.db2.gz LQDIUFMTIJIFOF-BBHUYCHWSA-N 2 0 355.570 4.036 20 0 FIADRP COc1ncc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1Cl ZINC000551539826 1103318568 /nfs/dbraw/zinc/31/85/68/1103318568.db2.gz HBBSMKMJCUFRLK-JYJNAYRXSA-N 2 0 353.938 4.152 20 0 FIADRP Fc1ccc(COc2cccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)c2)cc1 ZINC000666995579 1103347670 /nfs/dbraw/zinc/34/76/70/1103347670.db2.gz SLAJUJQRCOWQNR-FQEVSTJZSA-N 2 0 354.469 4.169 20 0 FIADRP CCc1cccc(F)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551582036 1103411457 /nfs/dbraw/zinc/41/14/57/1103411457.db2.gz YMBPJKQDXNMXCP-UHFFFAOYSA-N 2 0 356.485 4.151 20 0 FIADRP C[C@H](C[NH2+]C1CCN(CCC(F)(F)F)CC1)Oc1ccc(Cl)cc1 ZINC000507511127 1103451747 /nfs/dbraw/zinc/45/17/47/1103451747.db2.gz NUXZTNWVYNZPTJ-CYBMUJFWSA-N 2 0 364.839 4.114 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccsc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000894849597 1103522191 /nfs/dbraw/zinc/52/21/91/1103522191.db2.gz YFEOTYKOYTYFLB-UHFFFAOYSA-N 2 0 358.467 4.033 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H](c3ccnn3C)C2)c1 ZINC000519863491 1103912320 /nfs/dbraw/zinc/91/23/20/1103912320.db2.gz TXSFJQKDAJRARH-NHCUHLMSSA-N 2 0 354.542 4.076 20 0 FIADRP COC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000538206176 1104048537 /nfs/dbraw/zinc/04/85/37/1104048537.db2.gz GZSSZVKAYYMOIN-QINHECLXSA-N 2 0 354.485 4.000 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000461085680 1104068743 /nfs/dbraw/zinc/06/87/43/1104068743.db2.gz GEBOKSOQUFIWTK-YQVWRLOYSA-N 2 0 362.558 4.080 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000461085681 1104069525 /nfs/dbraw/zinc/06/95/25/1104069525.db2.gz GEBOKSOQUFIWTK-ZHALLVOQSA-N 2 0 362.558 4.080 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O2 ZINC000538293222 1104110019 /nfs/dbraw/zinc/11/00/19/1104110019.db2.gz JDIURYJKZLMPLX-FQEVSTJZSA-N 2 0 372.459 4.085 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OCc1ccncc1 ZINC000520204785 1104171070 /nfs/dbraw/zinc/17/10/70/1104171070.db2.gz HJJYIFROYASYFP-HXUWFJFHSA-N 2 0 367.537 4.405 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(F)c(C)c3)CC2)cc1 ZINC000520220969 1104184804 /nfs/dbraw/zinc/18/48/04/1104184804.db2.gz AYILGRFLLJBIEJ-UHFFFAOYSA-N 2 0 356.485 4.145 20 0 FIADRP FC(F)(F)c1ccccc1OCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441413465 1104338845 /nfs/dbraw/zinc/33/88/45/1104338845.db2.gz XOLSBLCUIFUXEX-MAUKXSAKSA-N 2 0 368.443 4.033 20 0 FIADRP FC(F)(F)c1ccc(OCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441419873 1104382085 /nfs/dbraw/zinc/38/20/85/1104382085.db2.gz YFDRUTRGUOWKNY-BEFAXECRSA-N 2 0 368.443 4.033 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2sccc2NC(=O)OC(C)(C)C)CC1 ZINC000894978166 1104412534 /nfs/dbraw/zinc/41/25/34/1104412534.db2.gz LCWZTHJYZUYXAD-UHFFFAOYSA-N 2 0 353.532 4.058 20 0 FIADRP Fc1ccc(COC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995590 1104525154 /nfs/dbraw/zinc/52/51/54/1104525154.db2.gz KDKMOSJWHODATR-CBQGHPETSA-N 2 0 372.528 4.212 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2Cn2ccnc2)CC1 ZINC000520459680 1104760679 /nfs/dbraw/zinc/76/06/79/1104760679.db2.gz CGVCGCATMWWJIF-AUSIDOKSSA-N 2 0 366.553 4.064 20 0 FIADRP Fc1ccc(OCC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001168004260 1105029527 /nfs/dbraw/zinc/02/95/27/1105029527.db2.gz SAJSREHWUUXMQB-CBQGHPETSA-N 2 0 372.528 4.322 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(OCc2ccccc2)c1 ZINC000152366494 1105035736 /nfs/dbraw/zinc/03/57/36/1105035736.db2.gz ATLUSEQOOUXYDE-QUCCMNQESA-N 2 0 350.506 4.401 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152394578 1105075830 /nfs/dbraw/zinc/07/58/30/1105075830.db2.gz QEVKVYHOLCHCOX-QAPCUYQASA-N 2 0 353.535 4.261 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2COc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168005195 1105076400 /nfs/dbraw/zinc/07/64/00/1105076400.db2.gz HUDSRRRUDKSMTR-UDKICSLYSA-N 2 0 350.506 4.021 20 0 FIADRP Cc1ccccc1C1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CCOCC1 ZINC000152405682 1105088011 /nfs/dbraw/zinc/08/80/11/1105088011.db2.gz PTOIHLUVDUKBHS-UHFFFAOYSA-N 2 0 370.581 4.430 20 0 FIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152406779 1105088297 /nfs/dbraw/zinc/08/82/97/1105088297.db2.gz AIKTVXSDKUICLE-QZTJIDSGSA-N 2 0 350.506 4.497 20 0 FIADRP C[C@H]1CC([NH2+]CCN(C)c2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008135 1105161205 /nfs/dbraw/zinc/16/12/05/1105161205.db2.gz CVHVMCQBACKHKZ-PMACEKPBSA-N 2 0 351.538 4.154 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCN(C)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008136 1105161956 /nfs/dbraw/zinc/16/19/56/1105161956.db2.gz CVHVMCQBACKHKZ-VTYHHJSWSA-N 2 0 351.538 4.154 20 0 FIADRP C[C@@H]1CC([NH2+]CCc2ccc(N(C)C)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008143 1105167737 /nfs/dbraw/zinc/16/77/37/1105167737.db2.gz CVOUUWYVUFHJQD-WOJBJXKFSA-N 2 0 365.565 4.326 20 0 FIADRP CCN(C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@H]1CC[N@H+](C)C1 ZINC000665193458 1105197905 /nfs/dbraw/zinc/19/79/05/1105197905.db2.gz YIVJENNLQJZCLH-FQEVSTJZSA-N 2 0 372.557 4.009 20 0 FIADRP COc1ccc(OCC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168009936 1105228063 /nfs/dbraw/zinc/22/80/63/1105228063.db2.gz IPWLDQXXUOPEBQ-OALUTQOASA-N 2 0 368.521 4.105 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCOCc2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168010057 1105230970 /nfs/dbraw/zinc/23/09/70/1105230970.db2.gz IZZJFTKMKVWJGB-JHDGKUDLSA-N 2 0 352.522 4.234 20 0 FIADRP CC(C)[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1F ZINC000665240454 1105258175 /nfs/dbraw/zinc/25/81/75/1105258175.db2.gz LKCVGTJEFLSVPN-ILWGZMRPSA-N 2 0 354.469 4.368 20 0 FIADRP CCOc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1O ZINC000390666214 1106739136 /nfs/dbraw/zinc/73/91/36/1106739136.db2.gz QXZWSXVYJVGOQW-SEJPIABJSA-N 2 0 366.505 4.076 20 0 FIADRP Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CC2 ZINC000655710698 1106744183 /nfs/dbraw/zinc/74/41/83/1106744183.db2.gz CPESPFYPNYMDLM-QHCPKHFHSA-N 2 0 364.533 4.037 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CCC([NH+](C)C)CC2)c1C ZINC000301379669 1107010656 /nfs/dbraw/zinc/01/06/56/1107010656.db2.gz YDWRRDLGTHYZGL-UHFFFAOYSA-N 2 0 362.315 4.145 20 0 FIADRP Cc1ccc2[nH+]ccc(N3CCC([NH2+]CCOc4ccccc4)CC3)c2c1 ZINC000302148543 1107316836 /nfs/dbraw/zinc/31/68/36/1107316836.db2.gz JDNQHCCHNWMJRG-UHFFFAOYSA-N 2 0 361.489 4.181 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc4cc[nH]c43)CC2)cc1 ZINC000237521400 1107719814 /nfs/dbraw/zinc/71/98/14/1107719814.db2.gz ASISZSRUANFKDK-UHFFFAOYSA-N 2 0 363.505 4.178 20 0 FIADRP C[C@H](C[NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Br)c1 ZINC000475566002 1107752597 /nfs/dbraw/zinc/75/25/97/1107752597.db2.gz GACHJSOBUXUIQW-RWBZWWBESA-N 2 0 351.332 4.159 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCCSc1ccccc1Br ZINC000531713912 1108094293 /nfs/dbraw/zinc/09/42/93/1108094293.db2.gz VBLVQKOUDJUULH-GOEBONIOSA-N 2 0 371.388 4.251 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c2sccc21 ZINC000453122988 1108189918 /nfs/dbraw/zinc/18/99/18/1108189918.db2.gz FLOUBWVQRUGDRX-KKSFZXQISA-N 2 0 370.562 4.433 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@H](C)c2ncc(-c3ccccc3)n2C)C1 ZINC000453178831 1108222401 /nfs/dbraw/zinc/22/24/01/1108222401.db2.gz TWKVYAPCONHUGX-MOPGFXCFSA-N 2 0 354.542 4.106 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@@H](C)c2ncc(-c3ccccc3)n2C)C1 ZINC000453178833 1108222523 /nfs/dbraw/zinc/22/25/23/1108222523.db2.gz TWKVYAPCONHUGX-RBUKOAKNSA-N 2 0 354.542 4.106 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CCOC4(CCC4)C3)[C@H]3CCC[C@@H]32)cc1 ZINC000453155337 1108223595 /nfs/dbraw/zinc/22/35/95/1108223595.db2.gz BASAEAOBKMMIDY-CZYKHXBRSA-N 2 0 354.538 4.121 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453197596 1108267200 /nfs/dbraw/zinc/26/72/00/1108267200.db2.gz NLIHLQDPXQGPOW-HBFSDRIKSA-N 2 0 366.553 4.391 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)c1nccs1 ZINC000453204120 1108273552 /nfs/dbraw/zinc/27/35/52/1108273552.db2.gz VTZSLLVIJNCCBA-GSEOLPGOSA-N 2 0 355.551 4.279 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2=CCOCC2)c2ccc(F)cc2)CC1 ZINC000453283054 1108358228 /nfs/dbraw/zinc/35/82/28/1108358228.db2.gz HUSAILAGOYUBHE-QFIPXVFZSA-N 2 0 360.517 4.315 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531941962 1108383712 /nfs/dbraw/zinc/38/37/12/1108383712.db2.gz ALBCRHFLPJMWRT-QGZVFWFLSA-N 2 0 363.505 4.018 20 0 FIADRP Cc1ncsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453310465 1108396803 /nfs/dbraw/zinc/39/68/03/1108396803.db2.gz QTUGEHDIVYSSFK-AQNXPRMDSA-N 2 0 355.551 4.027 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Br)cc2)CCC1 ZINC000531956396 1108445028 /nfs/dbraw/zinc/44/50/28/1108445028.db2.gz GVHXFIUSJUPEFV-VKJFTORMSA-N 2 0 365.359 4.189 20 0 FIADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(F)cc(Br)c1 ZINC000453355039 1108458780 /nfs/dbraw/zinc/45/87/80/1108458780.db2.gz OMFHVRRDOIQAFV-HMQMGEFJSA-N 2 0 355.295 4.254 20 0 FIADRP COc1ccc(C2(C[NH2+]C3CC[NH+](C(C)C)CC3)CCCCC2)cc1OC ZINC000531966958 1108462895 /nfs/dbraw/zinc/46/28/95/1108462895.db2.gz DXJGMENWSSUQCA-UHFFFAOYSA-N 2 0 374.569 4.368 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000532120501 1108668198 /nfs/dbraw/zinc/66/81/98/1108668198.db2.gz HHJMVWHPFRUJQG-UHFFFAOYSA-N 2 0 358.526 4.100 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)CCCCC2)cc1OC ZINC000532223339 1108722360 /nfs/dbraw/zinc/72/23/60/1108722360.db2.gz KCCIVBBCVYPITK-QWFCFKBJSA-N 2 0 374.569 4.224 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(Cc2ccccc2)c1 ZINC000532228551 1108725100 /nfs/dbraw/zinc/72/51/00/1108725100.db2.gz CYYJDXGVJJXIJF-HXUWFJFHSA-N 2 0 354.542 4.238 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000524876258 1109188120 /nfs/dbraw/zinc/18/81/20/1109188120.db2.gz QUDXRJRBHHAWQT-NRFANRHFSA-N 2 0 373.585 4.012 20 0 FIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000524968678 1109223871 /nfs/dbraw/zinc/22/38/71/1109223871.db2.gz PUAUIWUPDXMWSO-CALCHBBNSA-N 2 0 374.500 4.373 20 0 FIADRP C[NH+](C)CC1CCN(Cc2c(F)ccc(Br)c2Cl)CC1 ZINC001142088289 1109224442 /nfs/dbraw/zinc/22/44/42/1109224442.db2.gz BNWJWWZJPIVLEL-UHFFFAOYSA-N 2 0 363.702 4.015 20 0 FIADRP C[N@H+](CCCCOc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000525002626 1109227965 /nfs/dbraw/zinc/22/79/65/1109227965.db2.gz YXQUVEMAPJXHMI-INIZCTEOSA-N 2 0 358.448 4.138 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc(C)c1OCc1ccccn1 ZINC000508567497 1109247256 /nfs/dbraw/zinc/24/72/56/1109247256.db2.gz YQLLYHFHGCSDNK-HXUWFJFHSA-N 2 0 367.537 4.051 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000525307373 1109334019 /nfs/dbraw/zinc/33/40/19/1109334019.db2.gz BYXJPNFTSPFNNN-LJQANCHMSA-N 2 0 352.522 4.478 20 0 FIADRP CCCOc1ccc(OCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000544419281 1109545689 /nfs/dbraw/zinc/54/56/89/1109545689.db2.gz AZBBBDAYOMQXBN-OALUTQOASA-N 2 0 360.542 4.097 20 0 FIADRP CN(C)[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccsc1 ZINC000447546301 1109575365 /nfs/dbraw/zinc/57/53/65/1109575365.db2.gz USWDOJDHIOLLCA-CIAFKFPVSA-N 2 0 369.578 4.136 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000447565586 1109584212 /nfs/dbraw/zinc/58/42/12/1109584212.db2.gz MGYUOHNKGOATKF-UGSOOPFHSA-N 2 0 363.343 4.461 20 0 FIADRP Fc1ccc2c(c1)[C@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000447596568 1109591064 /nfs/dbraw/zinc/59/10/64/1109591064.db2.gz CSEOOJHMAMUUJE-WERVVEIQSA-N 2 0 352.453 4.044 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](C/C=C\c2ccc(Cl)cc2)CC1 ZINC000527048367 1109680138 /nfs/dbraw/zinc/68/01/38/1109680138.db2.gz TXOYPYMYQWOXCQ-WAYWQWQTSA-N 2 0 350.934 4.176 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccnn2-c2ccccc2)C1 ZINC000447935510 1109682845 /nfs/dbraw/zinc/68/28/45/1109682845.db2.gz HQGHVKKJBHCXST-FQEVSTJZSA-N 2 0 374.532 4.394 20 0 FIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000527844926 1109832776 /nfs/dbraw/zinc/83/27/76/1109832776.db2.gz BGYKXBCHHSQKPN-OALUTQOASA-N 2 0 366.553 4.198 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(F)c(Br)cc1F ZINC000527900184 1109857016 /nfs/dbraw/zinc/85/70/16/1109857016.db2.gz XNQBQGIITGQQDB-LLVKDONJSA-N 2 0 373.285 4.252 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000527948468 1109866844 /nfs/dbraw/zinc/86/68/44/1109866844.db2.gz LOSPRMZETFXKHA-IERDGZPVSA-N 2 0 370.541 4.028 20 0 FIADRP Cn1cc2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cc2n1 ZINC000527965954 1109877390 /nfs/dbraw/zinc/87/73/90/1109877390.db2.gz YVMYRKCMIQQRDI-UHFFFAOYSA-N 2 0 362.521 4.106 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC(Nc2ccc(C[NH+](C)C)cc2)CC1 ZINC000449042737 1109966385 /nfs/dbraw/zinc/96/63/85/1109966385.db2.gz UIVWYVZROCLEAB-LJQANCHMSA-N 2 0 351.538 4.256 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCC34CCCCC4)cc2)CC1 ZINC000449058388 1109970349 /nfs/dbraw/zinc/97/03/49/1109970349.db2.gz ISJRDHIIKLAVDE-JOCHJYFZSA-N 2 0 356.554 4.236 20 0 FIADRP COc1cc2ccccc2cc1C[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000449093814 1109979152 /nfs/dbraw/zinc/97/91/52/1109979152.db2.gz YSKGVVRTXIXYNO-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP Cc1csc(CCCC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)n1 ZINC000449116279 1109979187 /nfs/dbraw/zinc/97/91/87/1109979187.db2.gz KSCIUMNMWKNLNR-LJQANCHMSA-N 2 0 371.594 4.459 20 0 FIADRP CC(C)c1noc(CCC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)n1 ZINC000449121546 1109980220 /nfs/dbraw/zinc/98/02/20/1109980220.db2.gz IEZNNYZPUDZYKF-UHFFFAOYSA-N 2 0 364.578 4.394 20 0 FIADRP C[C@@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449127209 1109981181 /nfs/dbraw/zinc/98/11/81/1109981181.db2.gz OKDRYGSAMVMFSB-PMACEKPBSA-N 2 0 366.549 4.399 20 0 FIADRP COc1cc(F)cc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000449161323 1109989994 /nfs/dbraw/zinc/98/99/94/1109989994.db2.gz OLJATRGTXIBMIG-UHFFFAOYSA-N 2 0 368.452 4.349 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@H]2COc3ccccc32)CC1 ZINC000449204386 1109994803 /nfs/dbraw/zinc/99/48/03/1109994803.db2.gz JACAFEWVUXJAFG-SFYKDHMMSA-N 2 0 364.533 4.236 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2n2cccn2)CC1 ZINC000449188604 1109994915 /nfs/dbraw/zinc/99/49/15/1109994915.db2.gz SMYCPGZMJPIHBH-UEVCKROQSA-N 2 0 366.553 4.052 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)OCCCCO2 ZINC000449221109 1110000752 /nfs/dbraw/zinc/00/07/52/1110000752.db2.gz SEMVHRVIZLGHIE-UHFFFAOYSA-N 2 0 368.521 4.368 20 0 FIADRP Cc1csc([C@H](C)C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)n1 ZINC000449239610 1110009331 /nfs/dbraw/zinc/00/93/31/1110009331.db2.gz WGAQVWMJMMSPBK-SJLPKXTDSA-N 2 0 357.567 4.240 20 0 FIADRP CO[C@@H](CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C(F)(F)F ZINC000449270382 1110012017 /nfs/dbraw/zinc/01/20/17/1110012017.db2.gz QLYGSNKQMIVBJS-HNNXBMFYSA-N 2 0 352.485 4.223 20 0 FIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000449267084 1110012543 /nfs/dbraw/zinc/01/25/43/1110012543.db2.gz YGVBCUAKCBNXEI-UHFFFAOYSA-N 2 0 363.477 4.149 20 0 FIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449490112 1110091560 /nfs/dbraw/zinc/09/15/60/1110091560.db2.gz BNPAOOJFBOTPNI-WPYKKVEZSA-N 2 0 358.570 4.123 20 0 FIADRP COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000449619482 1110127397 /nfs/dbraw/zinc/12/73/97/1110127397.db2.gz PGVLMAIIYGCTMK-YJSIEXFISA-N 2 0 364.533 4.441 20 0 FIADRP COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000449619381 1110127456 /nfs/dbraw/zinc/12/74/56/1110127456.db2.gz PGVLMAIIYGCTMK-RLLPEYFOSA-N 2 0 364.533 4.441 20 0 FIADRP CC[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000450633219 1110322898 /nfs/dbraw/zinc/32/28/98/1110322898.db2.gz XVMHAXOKNSQFMW-SFHVURJKSA-N 2 0 358.357 4.014 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OC)cc2Br)CC1 ZINC000538396706 1111122916 /nfs/dbraw/zinc/12/29/16/1111122916.db2.gz VJZCAQMPUMTEMD-AWEZNQCLSA-N 2 0 369.347 4.230 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccccc2)CC1 ZINC000538409036 1111129588 /nfs/dbraw/zinc/12/95/88/1111129588.db2.gz AUTFZFKDQKJTMX-YTFSRNRJSA-N 2 0 356.554 4.275 20 0 FIADRP FC(F)(F)Oc1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168359506 1111205339 /nfs/dbraw/zinc/20/53/39/1111205339.db2.gz AVQBWVAYTCDBTF-QGZVFWFLSA-N 2 0 354.416 4.037 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000461794486 1111358573 /nfs/dbraw/zinc/35/85/73/1111358573.db2.gz GXSCATROTUREIH-CEXWTWQISA-N 2 0 365.359 4.377 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCCO2 ZINC000539046290 1111411695 /nfs/dbraw/zinc/41/16/95/1111411695.db2.gz HYFIAMJKWQWAKA-KKXNLOMOSA-N 2 0 358.526 4.152 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccoc1 ZINC000552033603 1111451153 /nfs/dbraw/zinc/45/11/53/1111451153.db2.gz KKUFDBJWUUESBM-HSZRJFAPSA-N 2 0 369.553 4.294 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCN(CC)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000539296729 1111506432 /nfs/dbraw/zinc/50/64/32/1111506432.db2.gz KGSLQOLNNHKDBE-WOJBJXKFSA-N 2 0 367.940 4.078 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1O2 ZINC000539368387 1111532771 /nfs/dbraw/zinc/53/27/71/1111532771.db2.gz QBZQDNYTBOAVAJ-HXUWFJFHSA-N 2 0 370.924 4.460 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)CC1 ZINC000552048406 1111557469 /nfs/dbraw/zinc/55/74/69/1111557469.db2.gz RITVLYBRTKEXFN-ARDNKUOLSA-N 2 0 356.554 4.223 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000477930990 1111605639 /nfs/dbraw/zinc/60/56/39/1111605639.db2.gz BWUPZKQLKROGHO-GDKQOWJMSA-N 2 0 364.533 4.264 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1 ZINC000552224173 1111624207 /nfs/dbraw/zinc/62/42/07/1111624207.db2.gz LVYRVQNTIGRCPE-XXBNENTESA-N 2 0 367.537 4.086 20 0 FIADRP CC[C@@H]1C[C@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCO1 ZINC000552273260 1111654526 /nfs/dbraw/zinc/65/45/26/1111654526.db2.gz AUWLPDMXIMZCIB-FGZHOGPDSA-N 2 0 356.554 4.180 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000552325636 1111670404 /nfs/dbraw/zinc/67/04/04/1111670404.db2.gz XVSMJLLTFXMPCQ-IXIUHKBRSA-N 2 0 352.950 4.169 20 0 FIADRP COc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1F ZINC000432663794 1111719646 /nfs/dbraw/zinc/71/96/46/1111719646.db2.gz KQQOKSQOIQJKDZ-LJQANCHMSA-N 2 0 360.498 4.040 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2ccccc2)cc1 ZINC000643537105 1111774648 /nfs/dbraw/zinc/77/46/48/1111774648.db2.gz ZJGILODWSDEYRU-RBUKOAKNSA-N 2 0 371.322 4.270 20 0 FIADRP C[NH+](C)CCc1ccc(C(=O)Nc2cccc(C[NH+]3CCCCC3)c2)cc1 ZINC000552973025 1111872289 /nfs/dbraw/zinc/87/22/89/1111872289.db2.gz DADXSUYWQHVMSQ-UHFFFAOYSA-N 2 0 365.521 4.029 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(F)ccc1F ZINC000479065583 1111939841 /nfs/dbraw/zinc/93/98/41/1111939841.db2.gz ROEDTYCXZKPILC-OAQYLSRUSA-N 2 0 362.464 4.392 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479332415 1111994190 /nfs/dbraw/zinc/99/41/90/1111994190.db2.gz SZJXLXUQIMQNIN-SIKLNZKXSA-N 2 0 366.553 4.351 20 0 FIADRP CCC[N@H+](CCC1CC[NH2+]CC1)CC(=O)Nc1cc(Cl)ccc1Cl ZINC000479671538 1112103137 /nfs/dbraw/zinc/10/31/37/1112103137.db2.gz ADISOUFLBWFFSN-UHFFFAOYSA-N 2 0 372.340 4.034 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCO[C@@H](C(F)(F)F)C3)cc2)C1 ZINC000554050137 1112177006 /nfs/dbraw/zinc/17/70/06/1112177006.db2.gz FYJNFFHIDYNRFX-ATZDWAIDSA-N 2 0 370.459 4.118 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000479899909 1112181515 /nfs/dbraw/zinc/18/15/15/1112181515.db2.gz HFJXRRPMMDWMGV-NRFANRHFSA-N 2 0 358.913 4.413 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000480160202 1112308063 /nfs/dbraw/zinc/30/80/63/1112308063.db2.gz NTSAAAFMZWLLQV-DYVFJYSZSA-N 2 0 351.332 4.461 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480159929 1112308358 /nfs/dbraw/zinc/30/83/58/1112308358.db2.gz FKYVCWDOFGQWOK-LJQANCHMSA-N 2 0 360.505 4.319 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000554369451 1112320561 /nfs/dbraw/zinc/32/05/61/1112320561.db2.gz GYHBPDIQENWHAC-JENIJYKNSA-N 2 0 371.500 4.181 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)CCCC(F)(F)F)CC1 ZINC000480235434 1112344057 /nfs/dbraw/zinc/34/40/57/1112344057.db2.gz XMPSEAXBNLQHDJ-QGZVFWFLSA-N 2 0 371.491 4.035 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2nccn2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000480306444 1112379432 /nfs/dbraw/zinc/37/94/32/1112379432.db2.gz HYIYWLDHEZHDID-UNMCSNQZSA-N 2 0 374.532 4.263 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC000554742519 1112467425 /nfs/dbraw/zinc/46/74/25/1112467425.db2.gz XUBKGVOWGCOGSW-FCHUYYIVSA-N 2 0 367.537 4.228 20 0 FIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480552629 1112472441 /nfs/dbraw/zinc/47/24/41/1112472441.db2.gz JREOWLBGSGVITR-FQEVSTJZSA-N 2 0 369.553 4.266 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000480560544 1112478403 /nfs/dbraw/zinc/47/84/03/1112478403.db2.gz XACGXIQFARSWOG-LJQANCHMSA-N 2 0 351.538 4.030 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)nnn1-c1ccc(C)cc1 ZINC000480615901 1112502980 /nfs/dbraw/zinc/50/29/80/1112502980.db2.gz VTHIATNWBXTJCR-RTBURBONSA-N 2 0 369.557 4.047 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000480617504 1112511143 /nfs/dbraw/zinc/51/11/43/1112511143.db2.gz RJILBOWXMQLJBG-OALUTQOASA-N 2 0 374.573 4.379 20 0 FIADRP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCCCC1 ZINC000480757682 1112589699 /nfs/dbraw/zinc/58/96/99/1112589699.db2.gz LTMRCFMMPGWCGT-UNMCSNQZSA-N 2 0 358.570 4.474 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000481333329 1112903735 /nfs/dbraw/zinc/90/37/35/1112903735.db2.gz SKHUQKFBBCQUAQ-IEBWSBKVSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000481538879 1112972462 /nfs/dbraw/zinc/97/24/62/1112972462.db2.gz CTISHCSNEXWZRM-FQEVSTJZSA-N 2 0 374.532 4.435 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](CNc2cc[nH+]c3cc(OC(F)(F)F)ccc23)C1 ZINC000899874661 1113037514 /nfs/dbraw/zinc/03/75/14/1113037514.db2.gz HWLRIYZEKHLZMM-ZDUSSCGKSA-N 2 0 353.388 4.276 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](CNc2cc[nH+]c3cc(OC(F)(F)F)ccc23)C1 ZINC000899874660 1113037914 /nfs/dbraw/zinc/03/79/14/1113037914.db2.gz HWLRIYZEKHLZMM-CYBMUJFWSA-N 2 0 353.388 4.276 20 0 FIADRP Clc1cc(C[NH2+]CCCCC[NH+]2CCCCC2)cc2c1OCCCO2 ZINC000600619941 1113110604 /nfs/dbraw/zinc/11/06/04/1113110604.db2.gz OWTXDYTYCICHRU-UHFFFAOYSA-N 2 0 366.933 4.247 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1 ZINC000481941122 1113135113 /nfs/dbraw/zinc/13/51/13/1113135113.db2.gz AEBVUGYUURKJRA-QGZVFWFLSA-N 2 0 360.546 4.132 20 0 FIADRP c1cncc([C@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C2CCC2)c1 ZINC000481929951 1113138016 /nfs/dbraw/zinc/13/80/16/1113138016.db2.gz YCGDJJSHFPGZSB-HSZRJFAPSA-N 2 0 365.521 4.187 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)c(Br)c2)C1 ZINC000482340826 1113230005 /nfs/dbraw/zinc/23/00/05/1113230005.db2.gz BWKLDFTVEVIRCZ-KGLIPLIRSA-N 2 0 357.311 4.359 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000482454238 1113265838 /nfs/dbraw/zinc/26/58/38/1113265838.db2.gz WZHJONFODZVXLX-PZJWPPBQSA-N 2 0 352.547 4.378 20 0 FIADRP OCC[NH+]1CCC(C[NH2+][C@@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000482539760 1113290502 /nfs/dbraw/zinc/29/05/02/1113290502.db2.gz SPMWLDMCZFXUKB-DEOSSOPVSA-N 2 0 366.549 4.045 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482537109 1113290515 /nfs/dbraw/zinc/29/05/15/1113290515.db2.gz RRFVDYWISAYJPS-HSZRJFAPSA-N 2 0 368.521 4.224 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccccc1 ZINC000482560449 1113295863 /nfs/dbraw/zinc/29/58/63/1113295863.db2.gz AHZXJLLYXVJDMP-UWJYYQICSA-N 2 0 355.501 4.379 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc2cc(OC)ccc2c1 ZINC000482867870 1113382156 /nfs/dbraw/zinc/38/21/56/1113382156.db2.gz PBFAQYQXUBVXSR-JTHBVZDNSA-N 2 0 370.537 4.126 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000482882248 1113391296 /nfs/dbraw/zinc/39/12/96/1113391296.db2.gz AUNZAVKXLNXNRG-YJBOKZPZSA-N 2 0 359.341 4.271 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)ccc1OC(F)F ZINC000483185969 1113463068 /nfs/dbraw/zinc/46/30/68/1113463068.db2.gz OGTGHPFEAMPIJY-GUYCJALGSA-N 2 0 358.473 4.314 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CCN(Cc2nccn2-c2ccccc2)CC1 ZINC000483272529 1113472927 /nfs/dbraw/zinc/47/29/27/1113472927.db2.gz VDSBMPGCEJHAFX-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP C[C@@H]1[C@H](N[C@@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000569244746 1113485595 /nfs/dbraw/zinc/48/55/95/1113485595.db2.gz MKTKQFCSTCLZGO-OTUUDDROSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)CC1 ZINC000486404280 1113560465 /nfs/dbraw/zinc/56/04/65/1113560465.db2.gz YLGWZTLKVIWUEB-HMNCIZAVSA-N 2 0 356.554 4.397 20 0 FIADRP CCC[C@H](NC(=O)[C@@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1)c1ccccc1 ZINC000488329248 1113909317 /nfs/dbraw/zinc/90/93/17/1113909317.db2.gz WLQRJODWOCVJRK-KNQAVFIVSA-N 2 0 373.585 4.086 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)cc1 ZINC000488422971 1113925747 /nfs/dbraw/zinc/92/57/47/1113925747.db2.gz AMALYJZDOHFKID-MJGOQNOKSA-N 2 0 350.572 4.027 20 0 FIADRP [NH3+]CCC[N@H+](CCC(=O)Nc1c(Cl)cccc1Cl)CC1CCCC1 ZINC000489879791 1114181593 /nfs/dbraw/zinc/18/15/93/1114181593.db2.gz COGWZUGXPHBEJB-UHFFFAOYSA-N 2 0 372.340 4.163 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccccc1F ZINC000490131003 1114221883 /nfs/dbraw/zinc/22/18/83/1114221883.db2.gz RNRYONGSUQFMHE-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490167620 1114228247 /nfs/dbraw/zinc/22/82/47/1114228247.db2.gz LKKJWONOYZQLAN-ZJSXRUAMSA-N 2 0 365.565 4.008 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)[C@H](C)C2 ZINC000491062914 1114368735 /nfs/dbraw/zinc/36/87/35/1114368735.db2.gz BRKYQESZRGAQBW-JPYJTQIMSA-N 2 0 352.522 4.349 20 0 FIADRP CC(C)[NH2+]CCCC[C@H](N)c1nc(-c2cc3ccoc3c(Cl)c2)no1 ZINC001212145023 1114417108 /nfs/dbraw/zinc/41/71/08/1114417108.db2.gz JPPCPGSLUBNEFQ-HNNXBMFYSA-N 2 0 362.861 4.304 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000571312868 1114455509 /nfs/dbraw/zinc/45/55/09/1114455509.db2.gz JJTNLLHKFRPQAY-SNVBAGLBSA-N 2 0 365.237 4.118 20 0 FIADRP c1ccc(N2CC[C@H](C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)C2)cc1 ZINC000589640860 1114818929 /nfs/dbraw/zinc/81/89/29/1114818929.db2.gz CMHGFUKBZLZAMI-OAQYLSRUSA-N 2 0 363.549 4.289 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cccc(Br)c2)C1 ZINC000589837388 1114847154 /nfs/dbraw/zinc/84/71/54/1114847154.db2.gz SPVJRGCBGUEEFD-HZPDHXFCSA-N 2 0 353.348 4.297 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OCc2ccncc2)C1 ZINC000589836045 1114847455 /nfs/dbraw/zinc/84/74/55/1114847455.db2.gz FJKRKWFRKHJQJK-FQEVSTJZSA-N 2 0 367.537 4.262 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccc(F)c(F)c3)n2)CC1 ZINC000590819027 1114982997 /nfs/dbraw/zinc/98/29/97/1114982997.db2.gz ULJRRRKTFIFWLV-UHFFFAOYSA-N 2 0 363.452 4.172 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000591708022 1115125770 /nfs/dbraw/zinc/12/57/70/1115125770.db2.gz GEYQODRTLYFEQJ-UHFFFAOYSA-N 2 0 369.336 4.481 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2cccc(OCc3ccccc3F)c2)CC1 ZINC000591708934 1115125930 /nfs/dbraw/zinc/12/59/30/1115125930.db2.gz BGHHDBUUCJCNPU-UHFFFAOYSA-N 2 0 356.485 4.226 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)cc1 ZINC000593972880 1115364638 /nfs/dbraw/zinc/36/46/38/1115364638.db2.gz NZKZJVLSHZQBOY-JOCHJYFZSA-N 2 0 371.569 4.009 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000574592283 1115420303 /nfs/dbraw/zinc/42/03/03/1115420303.db2.gz MWYRVSJCKHHCRT-UHFFFAOYSA-N 2 0 368.521 4.096 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(Br)cn1 ZINC000574811642 1115496832 /nfs/dbraw/zinc/49/68/32/1115496832.db2.gz LSQUIZZYCPZDLZ-HUUCEWRRSA-N 2 0 354.336 4.007 20 0 FIADRP CC(C)C[C@H](CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000575178039 1115546685 /nfs/dbraw/zinc/54/66/85/1115546685.db2.gz HJGCJRGEQVAAKV-JBYIUTFZSA-N 2 0 367.537 4.202 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1F ZINC000669679744 1115774354 /nfs/dbraw/zinc/77/43/54/1115774354.db2.gz VREAUEZJUMILFJ-QGZVFWFLSA-N 2 0 356.485 4.499 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)[C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416101 1115841463 /nfs/dbraw/zinc/84/14/63/1115841463.db2.gz GEZQFFOPNKVQOT-DNVJHFABSA-N 2 0 352.497 4.455 20 0 FIADRP Cc1ccc(C[C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)s1 ZINC000606471142 1115948398 /nfs/dbraw/zinc/94/83/98/1115948398.db2.gz AJGWUUJVSHVSQK-KRWDZBQOSA-N 2 0 358.551 4.252 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](CCCc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000607151513 1116003670 /nfs/dbraw/zinc/00/36/70/1116003670.db2.gz RFXLSMKKRVYXPV-HDICACEKSA-N 2 0 364.961 4.094 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]CC1=Cc2ccccc2OC1 ZINC000608058520 1116082446 /nfs/dbraw/zinc/08/24/46/1116082446.db2.gz BKBFTQBKHQEXSL-UHFFFAOYSA-N 2 0 374.484 4.477 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cnn(-c3ccc(Cl)cc3)c2)CC1 ZINC000534346991 1116187249 /nfs/dbraw/zinc/18/72/49/1116187249.db2.gz NSLVKLIUXGZXCU-UHFFFAOYSA-N 2 0 360.933 4.078 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000534793794 1116237423 /nfs/dbraw/zinc/23/74/23/1116237423.db2.gz PRHPDXBFRUDQNU-ZBEGNZNMSA-N 2 0 357.723 4.021 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509122 1116313972 /nfs/dbraw/zinc/31/39/72/1116313972.db2.gz YPCXXDFXVZXQCU-BDJLRTHQSA-N 2 0 357.723 4.021 20 0 FIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)CC1 ZINC000539555248 1116344978 /nfs/dbraw/zinc/34/49/78/1116344978.db2.gz RCQGPBATMREYNP-JOCHJYFZSA-N 2 0 357.542 4.137 20 0 FIADRP Cc1ccccc1-c1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)c1 ZINC000539895235 1117738991 /nfs/dbraw/zinc/73/89/91/1117738991.db2.gz AJLGOOCYDNTMRS-QPTUXGOLSA-N 2 0 364.533 4.346 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1C ZINC000462784367 1117762358 /nfs/dbraw/zinc/76/23/58/1117762358.db2.gz DZHZBQHUJSJJMX-HZPDHXFCSA-N 2 0 374.326 4.075 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1C ZINC000462784368 1117762746 /nfs/dbraw/zinc/76/27/46/1117762746.db2.gz DZHZBQHUJSJJMX-JKSUJKDBSA-N 2 0 374.326 4.075 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000462812282 1117782094 /nfs/dbraw/zinc/78/20/94/1117782094.db2.gz HBQWAFBJZYRRAQ-SBHAEUEKSA-N 2 0 373.560 4.285 20 0 FIADRP CCn1cc(C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)cn1 ZINC000462808130 1117789373 /nfs/dbraw/zinc/78/93/73/1117789373.db2.gz GXFSUVSAJNWYHJ-JOCHJYFZSA-N 2 0 372.532 4.385 20 0 FIADRP Cc1cc(NC[C@H](C(C)C)[NH+]2CCN(C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462918128 1117860050 /nfs/dbraw/zinc/86/00/50/1117860050.db2.gz GAULWMYFMNYTHV-HXUWFJFHSA-N 2 0 374.960 4.189 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)[C@@H](C)C1 ZINC000540141166 1117893889 /nfs/dbraw/zinc/89/38/89/1117893889.db2.gz FIABDWFHQDPNLS-JTSKRJEESA-N 2 0 356.485 4.225 20 0 FIADRP CCC1(C[NH2+][C@H](C)c2cnc(C)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000540142237 1117894742 /nfs/dbraw/zinc/89/47/42/1117894742.db2.gz UVEJIRSTFYAABU-GOSISDBHSA-N 2 0 366.553 4.436 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2-c2cnn(C)c2)CC1 ZINC000540148663 1117899741 /nfs/dbraw/zinc/89/97/41/1117899741.db2.gz YDJFOBHQQLVSEE-JPYJTQIMSA-N 2 0 366.553 4.220 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000463078573 1117960592 /nfs/dbraw/zinc/96/05/92/1117960592.db2.gz RAVUQMDDHDTIBE-UHFFFAOYSA-N 2 0 356.558 4.179 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000540258266 1117961606 /nfs/dbraw/zinc/96/16/06/1117961606.db2.gz FVAUDQYNXJYROR-UZLBHIALSA-N 2 0 359.514 4.475 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000540262176 1117962360 /nfs/dbraw/zinc/96/23/60/1117962360.db2.gz GMXYUXYROXNBLD-KSSFIOAISA-N 2 0 351.332 4.222 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)C[C@@H]1C ZINC000463105730 1117966528 /nfs/dbraw/zinc/96/65/28/1117966528.db2.gz HCRAKCGXIWYQQO-AZUAARDMSA-N 2 0 356.558 4.320 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)[C@@H](C)C1 ZINC000463108977 1117968475 /nfs/dbraw/zinc/96/84/75/1117968475.db2.gz IIXRUQSWZLMBDT-RXVVDRJESA-N 2 0 356.558 4.177 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(C(F)(F)F)cc1 ZINC000540301465 1117976771 /nfs/dbraw/zinc/97/67/71/1117976771.db2.gz ZRUQXZBZZNPQEN-RBUKOAKNSA-N 2 0 372.475 4.229 20 0 FIADRP C[C@@H]1C[C@@H](NCCC[NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463130733 1117978219 /nfs/dbraw/zinc/97/82/19/1117978219.db2.gz IHTPYYSHVZIRBT-QPPBQGQZSA-N 2 0 365.565 4.151 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)CCN1Cc1ccccc1 ZINC000463132613 1117983385 /nfs/dbraw/zinc/98/33/85/1117983385.db2.gz SLZFKAAHHDAHAM-GMAHTHKFSA-N 2 0 357.586 4.285 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]CCCSc3ccccc3)CC2)cc1 ZINC000463136421 1117985255 /nfs/dbraw/zinc/98/52/55/1117985255.db2.gz DTBBPIPVHAAPNO-UHFFFAOYSA-N 2 0 354.563 4.466 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CCCC4CCOCC4)[C@@H]3C2)cc1 ZINC000463238336 1118046384 /nfs/dbraw/zinc/04/63/84/1118046384.db2.gz UJWRSKTVNQJGSC-ZRBLBEILSA-N 2 0 356.554 4.084 20 0 FIADRP CCC1(CC)[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@H]1OC ZINC000540494193 1118091219 /nfs/dbraw/zinc/09/12/19/1118091219.db2.gz XJIGVLLMYXPFDA-HMXCVIKNSA-N 2 0 372.553 4.158 20 0 FIADRP CCN1CCC([NH2+][C@@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540778305 1118240790 /nfs/dbraw/zinc/24/07/90/1118240790.db2.gz HWGASQFLBXCVKT-WOJBJXKFSA-N 2 0 367.940 4.077 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2nc3ccccc3nc2C)CC1 ZINC000541087581 1118377977 /nfs/dbraw/zinc/37/79/77/1118377977.db2.gz VAQZSRBFIJJUAJ-UHFFFAOYSA-N 2 0 354.542 4.272 20 0 FIADRP CCc1cnccc1[C@@H](C)[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccncc1CC ZINC000541193409 1118414775 /nfs/dbraw/zinc/41/47/75/1118414775.db2.gz QCEOUGFJAZGQRA-FGTMMUONSA-N 2 0 354.542 4.381 20 0 FIADRP CCc1cnccc1[C@H](C)[NH2+]CC[C@@H](C)[NH2+][C@@H](C)c1ccncc1CC ZINC000541193413 1118414818 /nfs/dbraw/zinc/41/48/18/1118414818.db2.gz QCEOUGFJAZGQRA-SQNIBIBYSA-N 2 0 354.542 4.381 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)C1 ZINC000541546616 1118551070 /nfs/dbraw/zinc/55/10/70/1118551070.db2.gz FZFGZLBISVOCJG-AVRDEDQJSA-N 2 0 355.501 4.412 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000541534450 1118552664 /nfs/dbraw/zinc/55/26/64/1118552664.db2.gz QGPDSSHRIFDJQD-QAPCUYQASA-N 2 0 350.441 4.093 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000541555571 1118561291 /nfs/dbraw/zinc/56/12/91/1118561291.db2.gz GTZQRONKCKNOCR-GOSISDBHSA-N 2 0 364.468 4.485 20 0 FIADRP C[C@H]([NH2+]CCOc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541602840 1118583474 /nfs/dbraw/zinc/58/34/74/1118583474.db2.gz BKNIUIWLKDUNRG-LSDHHAIUSA-N 2 0 354.897 4.101 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(CN3CCOCC3)c2)C2CCC2)o1 ZINC000541745293 1118630104 /nfs/dbraw/zinc/63/01/04/1118630104.db2.gz YQEDAHDASAMRIC-JOCHJYFZSA-N 2 0 354.494 4.051 20 0 FIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000464779035 1118691572 /nfs/dbraw/zinc/69/15/72/1118691572.db2.gz OTZJLZVPVSRWDT-INIZCTEOSA-N 2 0 358.448 4.138 20 0 FIADRP CC(C)[C@@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000541916098 1118707258 /nfs/dbraw/zinc/70/72/58/1118707258.db2.gz AKVPBNAXBWKNDX-BJKOFHAPSA-N 2 0 366.549 4.000 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1OC ZINC000173365642 1119035837 /nfs/dbraw/zinc/03/58/37/1119035837.db2.gz AUQWDVUSQNBXQX-INIZCTEOSA-N 2 0 374.550 4.328 20 0 FIADRP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492404597 1119087687 /nfs/dbraw/zinc/08/76/87/1119087687.db2.gz ZNKKENJBTDWIKQ-IFMALSPDSA-N 2 0 352.522 4.346 20 0 FIADRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000177200112 1119316233 /nfs/dbraw/zinc/31/62/33/1119316233.db2.gz SRBNBPRDFAMYGZ-QRVBRYPASA-N 2 0 368.521 4.155 20 0 FIADRP Cc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000177751628 1119349477 /nfs/dbraw/zinc/34/94/77/1119349477.db2.gz TVZQKTXFRJWNLF-OWCLPIDISA-N 2 0 373.566 4.220 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000311072872 1119356865 /nfs/dbraw/zinc/35/68/65/1119356865.db2.gz KLIAHLOXIYVSHG-QFBILLFUSA-N 2 0 358.913 4.349 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000311771337 1119389012 /nfs/dbraw/zinc/38/90/12/1119389012.db2.gz GOFACDYYTCHQQF-HCLVMJGWSA-N 2 0 350.506 4.183 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311807396 1119390007 /nfs/dbraw/zinc/39/00/07/1119390007.db2.gz LHQQEMSQCKHTJH-ILWGZMRPSA-N 2 0 356.554 4.369 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000178439860 1119390380 /nfs/dbraw/zinc/39/03/80/1119390380.db2.gz ANSFIOFGRPHYPO-KRWDZBQOSA-N 2 0 354.542 4.344 20 0 FIADRP FC(F)(F)Oc1cccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311858860 1119393049 /nfs/dbraw/zinc/39/30/49/1119393049.db2.gz XFPPEIXYHHSJSV-SFHVURJKSA-N 2 0 364.411 4.197 20 0 FIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311890648 1119393895 /nfs/dbraw/zinc/39/38/95/1119393895.db2.gz DEAUDQNNPMULBG-XXBNENTESA-N 2 0 350.506 4.184 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccsc2)CC1 ZINC000178770709 1119408055 /nfs/dbraw/zinc/40/80/55/1119408055.db2.gz KYNAIGVDSYYJBT-JKSUJKDBSA-N 2 0 361.530 4.441 20 0 FIADRP CC1(C)C[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000178794971 1119409082 /nfs/dbraw/zinc/40/90/82/1119409082.db2.gz BKDCDRLQFGXIFS-QHCPKHFHSA-N 2 0 364.533 4.156 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000493884486 1119503221 /nfs/dbraw/zinc/50/32/21/1119503221.db2.gz YEJCEYWWTCUQKI-KVJIRVJXSA-N 2 0 354.538 4.108 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000493969527 1119518216 /nfs/dbraw/zinc/51/82/16/1119518216.db2.gz NXUZTIPENWWKRO-CVDCTZTESA-N 2 0 352.522 4.264 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)C1 ZINC000542477010 1119623078 /nfs/dbraw/zinc/62/30/78/1119623078.db2.gz AVUMZDCPNXEHDQ-PGRDOPGGSA-N 2 0 355.501 4.412 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000189368984 1119889376 /nfs/dbraw/zinc/88/93/76/1119889376.db2.gz QYUDNMNETFBLRS-LAUBAEHRSA-N 2 0 354.494 4.110 20 0 FIADRP COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)c1 ZINC000542484504 1119905611 /nfs/dbraw/zinc/90/56/11/1119905611.db2.gz HIPXXFPBPOTRDC-OPAMFIHVSA-N 2 0 362.477 4.167 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cnn1C(C)(C)C ZINC000191133279 1119962349 /nfs/dbraw/zinc/96/23/49/1119962349.db2.gz LNPHGSNSRQRQBB-QGZVFWFLSA-N 2 0 354.542 4.393 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cnn1C(C)C ZINC000191211036 1119965311 /nfs/dbraw/zinc/96/53/11/1119965311.db2.gz QAVSHPUTSMZWSX-GOSISDBHSA-N 2 0 354.542 4.335 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000191607328 1119986746 /nfs/dbraw/zinc/98/67/46/1119986746.db2.gz PKSZMTUFDMEZAK-HNNXBMFYSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC000191851788 1119998695 /nfs/dbraw/zinc/99/86/95/1119998695.db2.gz BIMMNVMREMGHJA-MHADKKCISA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000191855935 1119999106 /nfs/dbraw/zinc/99/91/06/1119999106.db2.gz JTXGRAWPEAMSFD-JZWVFAODSA-N 2 0 368.521 4.055 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(Br)c(Cl)c2)cc1 ZINC000192165358 1120034357 /nfs/dbraw/zinc/03/43/57/1120034357.db2.gz MZLVNKMQKKHVQS-UHFFFAOYSA-N 2 0 367.718 4.454 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000192466837 1120063131 /nfs/dbraw/zinc/06/31/31/1120063131.db2.gz HWEPLVXNWGXFMH-DVECYGJZSA-N 2 0 364.533 4.464 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)CC2 ZINC000494745543 1120114861 /nfs/dbraw/zinc/11/48/61/1120114861.db2.gz MAYKWTKRDLKRID-MRXNPFEDSA-N 2 0 351.332 4.066 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000195133621 1120120210 /nfs/dbraw/zinc/12/02/10/1120120210.db2.gz ZYHVIROFDURBMO-GHTZIAJQSA-N 2 0 368.546 4.344 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000195139656 1120120460 /nfs/dbraw/zinc/12/04/60/1120120460.db2.gz IXRMNANMJYPRGC-ROUUACIJSA-N 2 0 355.551 4.195 20 0 FIADRP COC[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000670160980 1120763416 /nfs/dbraw/zinc/76/34/16/1120763416.db2.gz ITWZZECWBUEZBN-VUQUMOFBSA-N 2 0 362.945 4.269 20 0 FIADRP COC[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000670160979 1120763701 /nfs/dbraw/zinc/76/37/01/1120763701.db2.gz ITWZZECWBUEZBN-QQFYDIPVSA-N 2 0 362.945 4.269 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1N(C)C ZINC000495415298 1120793426 /nfs/dbraw/zinc/79/34/26/1120793426.db2.gz OURXFFLZHVTRKJ-IRFCIJBXSA-N 2 0 351.538 4.314 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000495438868 1120823856 /nfs/dbraw/zinc/82/38/56/1120823856.db2.gz JDVARZFWOKBHOZ-AYOQOUSVSA-N 2 0 355.551 4.329 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cc1F ZINC000495543883 1120876217 /nfs/dbraw/zinc/87/62/17/1120876217.db2.gz BKEWPDIDDQOFEH-BRWVUGGUSA-N 2 0 374.475 4.425 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]CCC2CC[NH+](C)CC2)cc1OCC ZINC000237019316 1120972744 /nfs/dbraw/zinc/97/27/44/1120972744.db2.gz OOFAQKFVRMAFCJ-UHFFFAOYSA-N 2 0 368.949 4.349 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000237161529 1120973930 /nfs/dbraw/zinc/97/39/30/1120973930.db2.gz CHTVKGSUDCSZRV-UHFFFAOYSA-N 2 0 363.299 4.141 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001168496327 1120997768 /nfs/dbraw/zinc/99/77/68/1120997768.db2.gz IQDKSVPVQVIASM-IBGZPJMESA-N 2 0 352.497 4.355 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC000542666282 1121024935 /nfs/dbraw/zinc/02/49/35/1121024935.db2.gz WZBMGDCOGVFYBU-GCJKJVERSA-N 2 0 370.924 4.074 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000542666284 1121025406 /nfs/dbraw/zinc/02/54/06/1121025406.db2.gz WZBMGDCOGVFYBU-PGRDOPGGSA-N 2 0 370.924 4.074 20 0 FIADRP Brc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000397510449 1121198691 /nfs/dbraw/zinc/19/86/91/1121198691.db2.gz LLBDUOOCHVBULS-UHFFFAOYSA-N 2 0 363.299 4.044 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000397628480 1121252122 /nfs/dbraw/zinc/25/21/22/1121252122.db2.gz MCGNVPPBPQUQHS-HNNXBMFYSA-N 2 0 364.942 4.079 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c(-c2ccccc2)cc1OC ZINC000067507185 1121780658 /nfs/dbraw/zinc/78/06/58/1121780658.db2.gz HMCALRVYYGOICY-GOSISDBHSA-N 2 0 368.521 4.191 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CC2 ZINC000125464303 1121781897 /nfs/dbraw/zinc/78/18/97/1121781897.db2.gz ZYPIGTPBPCNMLM-OAQYLSRUSA-N 2 0 356.535 4.246 20 0 FIADRP COc1cc2c(cc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C)O[C@H](C)C2 ZINC000067668236 1121788126 /nfs/dbraw/zinc/78/81/26/1121788126.db2.gz LXBBCEDRPPVRJG-QGZVFWFLSA-N 2 0 368.521 4.149 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2COc3ccc(F)cc32)CC1 ZINC000671761000 1121793328 /nfs/dbraw/zinc/79/33/28/1121793328.db2.gz XYWLULCRBNWRBP-GRERDSQWSA-N 2 0 354.469 4.292 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)C1 ZINC000125802360 1121841545 /nfs/dbraw/zinc/84/15/45/1121841545.db2.gz HHPSNINGHSDYAY-SFHVURJKSA-N 2 0 363.977 4.014 20 0 FIADRP C[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc2c(c1)CCC(=O)N2 ZINC000765776445 1121902768 /nfs/dbraw/zinc/90/27/68/1121902768.db2.gz QGAIATYNIPFWEB-SFHVURJKSA-N 2 0 357.542 4.268 20 0 FIADRP C[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc2c(c1)CCC(=O)N2 ZINC000765776442 1121904014 /nfs/dbraw/zinc/90/40/14/1121904014.db2.gz QGAIATYNIPFWEB-GOSISDBHSA-N 2 0 357.542 4.268 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)s1 ZINC000126662788 1121973516 /nfs/dbraw/zinc/97/35/16/1121973516.db2.gz NJQASEZGNJWDAH-HZPDHXFCSA-N 2 0 361.530 4.359 20 0 FIADRP Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126725542 1121980691 /nfs/dbraw/zinc/98/06/91/1121980691.db2.gz OJPJVKVBXNXVGM-QZTJIDSGSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc2ccccc2o1 ZINC000126746452 1121982638 /nfs/dbraw/zinc/98/26/38/1121982638.db2.gz XKSWOJKACAACLU-SFHVURJKSA-N 2 0 363.505 4.031 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)c(F)c3)cc2)CC1 ZINC000916999256 1121995957 /nfs/dbraw/zinc/99/59/57/1121995957.db2.gz ISDNLAADNBTGLM-QFIPXVFZSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc(F)c3)cc2)C1 ZINC000917006231 1121999591 /nfs/dbraw/zinc/99/95/91/1121999591.db2.gz MLCUDSVNYZZXHS-PNCHPQGNSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc(F)cc2F)cc1 ZINC000917008224 1122000081 /nfs/dbraw/zinc/00/00/81/1122000081.db2.gz HKXZEZNXUSBREA-AOMKIAJQSA-N 2 0 374.475 4.162 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168613679 1122020059 /nfs/dbraw/zinc/02/00/59/1122020059.db2.gz JYCIXDXMBLTLHU-TZIWHRDSSA-N 2 0 360.542 4.015 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215396 1122062181 /nfs/dbraw/zinc/06/21/81/1122062181.db2.gz XVQFCXSAFQJFKT-SFHVURJKSA-N 2 0 353.510 4.436 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000128148657 1122197350 /nfs/dbraw/zinc/19/73/50/1122197350.db2.gz MMROEJMQVDPKEK-WMZOPIPTSA-N 2 0 374.916 4.054 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630607 1122217789 /nfs/dbraw/zinc/21/77/89/1122217789.db2.gz QODCVAMIOVCXGE-XWSHUIEDSA-N 2 0 360.542 4.158 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000542689729 1122284529 /nfs/dbraw/zinc/28/45/29/1122284529.db2.gz RIITYVYPPZXKBZ-IBGZPJMESA-N 2 0 351.538 4.110 20 0 FIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542693569 1122289317 /nfs/dbraw/zinc/28/93/17/1122289317.db2.gz JVPIFISCNOFNHN-FFJFPXHCSA-N 2 0 356.460 4.478 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(F)c2ccccc21 ZINC000556119356 1122670809 /nfs/dbraw/zinc/67/08/09/1122670809.db2.gz WIQLWPSMTDZINN-UZQPLGKSSA-N 2 0 356.485 4.007 20 0 FIADRP Cc1cc(F)ccc1[C@@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000763430823 1122744960 /nfs/dbraw/zinc/74/49/60/1122744960.db2.gz FMMUPHAUSXCQPG-AVRDEDQJSA-N 2 0 362.533 4.144 20 0 FIADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230587 1122757245 /nfs/dbraw/zinc/75/72/45/1122757245.db2.gz OUFMFCHCHOHKOT-VXKWHMMOSA-N 2 0 370.581 4.474 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC[C@@H]2CCCC[C@H]2O)CC1 ZINC000556263528 1122773140 /nfs/dbraw/zinc/77/31/40/1122773140.db2.gz ZMPNRNZFPOYXLP-SCZRWQTQSA-N 2 0 358.570 4.351 20 0 FIADRP CC[C@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000556408950 1122874938 /nfs/dbraw/zinc/87/49/38/1122874938.db2.gz LFHGAFRUINIVTF-HXUWFJFHSA-N 2 0 352.522 4.443 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccc(OC)c1 ZINC000556606014 1122996387 /nfs/dbraw/zinc/99/63/87/1122996387.db2.gz PTICHSGJNWLPML-HSZRJFAPSA-N 2 0 368.521 4.409 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCN(Cc2ccccc2Cl)CC1 ZINC000131275256 1123021499 /nfs/dbraw/zinc/02/14/99/1123021499.db2.gz SMQZABSIAINJKX-GOSISDBHSA-N 2 0 365.993 4.405 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@H]2CCC[C@H]21 ZINC000556869707 1123150755 /nfs/dbraw/zinc/15/07/55/1123150755.db2.gz ANBHXMBKESMCKQ-FUPPJEDESA-N 2 0 374.532 4.047 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)[C@H]2CCC[C@H]21 ZINC000556869902 1123153110 /nfs/dbraw/zinc/15/31/10/1123153110.db2.gz DAOWEFUOAKGFJA-AKHDSKFASA-N 2 0 350.453 4.128 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556890732 1123176411 /nfs/dbraw/zinc/17/64/11/1123176411.db2.gz VMCZYFFMKBSXIF-FGTMMUONSA-N 2 0 360.542 4.316 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)CC1 ZINC000132001949 1123208585 /nfs/dbraw/zinc/20/85/85/1123208585.db2.gz GCQCNQRISKZQLG-REWPJTCUSA-N 2 0 364.533 4.069 20 0 FIADRP COCCC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(Br)cc1 ZINC000132129981 1123221487 /nfs/dbraw/zinc/22/14/87/1123221487.db2.gz RUFOFEPBKPZLDR-QGZVFWFLSA-N 2 0 371.363 4.094 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CCc1nccn1Cc1ccccc1 ZINC000132146567 1123222852 /nfs/dbraw/zinc/22/28/52/1123222852.db2.gz GDTFFCJVGWNXMT-NRFANRHFSA-N 2 0 361.489 4.286 20 0 FIADRP COc1cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1C ZINC000499144489 1123285693 /nfs/dbraw/zinc/28/56/93/1123285693.db2.gz DINVWEVKFXWUFR-KOUNCHBCSA-N 2 0 350.506 4.289 20 0 FIADRP C[C@@H]1CCCC[C@H]1OCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499158121 1123297903 /nfs/dbraw/zinc/29/79/03/1123297903.db2.gz RSQKKRXQADZBKE-FUBOCBINSA-N 2 0 356.554 4.367 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499196133 1123315341 /nfs/dbraw/zinc/31/53/41/1123315341.db2.gz RGVQFYGICYSSBU-SRYPRDQNSA-N 2 0 362.517 4.468 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc2c(s1)CCC2 ZINC000132705120 1123343601 /nfs/dbraw/zinc/34/36/01/1123343601.db2.gz AOYPBTJHIQAIDO-MRXNPFEDSA-N 2 0 370.562 4.044 20 0 FIADRP Fc1ccc(F)c(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499237893 1123349599 /nfs/dbraw/zinc/34/95/99/1123349599.db2.gz PIMTWJLRYXSLFT-WKCHPHFGSA-N 2 0 356.460 4.293 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCOC1 ZINC000133428562 1123485913 /nfs/dbraw/zinc/48/59/13/1123485913.db2.gz STIZAVCPOXSMJG-CVDCTZTESA-N 2 0 364.533 4.464 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCCSc1ccccc1Br ZINC000133458352 1123489372 /nfs/dbraw/zinc/48/93/72/1123489372.db2.gz VBLVQKOUDJUULH-ZBFHGGJFSA-N 2 0 371.388 4.251 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000134013715 1123583986 /nfs/dbraw/zinc/58/39/86/1123583986.db2.gz YCPHFKMMOTUISK-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@H](C)C1 ZINC000081094937 1123983839 /nfs/dbraw/zinc/98/38/39/1123983839.db2.gz ZDSXSJDVIZYNHR-XMSQKQJNSA-N 2 0 365.521 4.101 20 0 FIADRP C[C@@H](CC[N@@H+]1CCSC2(CCC2)CC1)[NH+]1CCSC2(CCC2)CC1 ZINC000411868471 1124042034 /nfs/dbraw/zinc/04/20/34/1124042034.db2.gz KQSLEGISMRJBGC-SFHVURJKSA-N 2 0 368.656 4.488 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(CO)c1 ZINC000245612351 1124141227 /nfs/dbraw/zinc/14/12/27/1124141227.db2.gz JWXOKLWDAQWERD-RBUKOAKNSA-N 2 0 352.522 4.262 20 0 FIADRP CCc1cnc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000245642227 1124159293 /nfs/dbraw/zinc/15/92/93/1124159293.db2.gz AYAZYWJMWITUIC-LDLYASANSA-N 2 0 355.551 4.033 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000245677427 1124186426 /nfs/dbraw/zinc/18/64/26/1124186426.db2.gz IGNLUJIJNRJWKI-ADHNFCLRSA-N 2 0 355.570 4.036 20 0 FIADRP COCCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000245680379 1124193056 /nfs/dbraw/zinc/19/30/56/1124193056.db2.gz IRZHZBPTCOZEOS-DKUWSORSSA-N 2 0 356.554 4.369 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)C1CCC(C(F)(F)F)CC1 ZINC000474601436 1124217702 /nfs/dbraw/zinc/21/77/02/1124217702.db2.gz QLJCFOIEMXSMIL-KLHKWILBSA-N 2 0 372.475 4.474 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccs1 ZINC000245754501 1124241479 /nfs/dbraw/zinc/24/14/79/1124241479.db2.gz UPDBWZHKOGZTQE-WOZUAGRISA-N 2 0 369.578 4.136 20 0 FIADRP C[NH+](C)[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245765557 1124244683 /nfs/dbraw/zinc/24/46/83/1124244683.db2.gz WHPKHKIYVVWLNO-JLLPCOHGSA-N 2 0 363.549 4.075 20 0 FIADRP c1cnn(-c2ccccc2C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245777309 1124247417 /nfs/dbraw/zinc/24/74/17/1124247417.db2.gz YJZCHDJWLHXEFN-NUNAXRQHSA-N 2 0 372.516 4.158 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)CCO2)cc1 ZINC001168654442 1124415237 /nfs/dbraw/zinc/41/52/37/1124415237.db2.gz UBGFNLDBCLUUHI-FUDKSRODSA-N 2 0 372.553 4.256 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc2ccccc2c1 ZINC000246306711 1124440034 /nfs/dbraw/zinc/44/00/34/1124440034.db2.gz DLYQYYRCBZXBOD-PDIWNELESA-N 2 0 352.522 4.258 20 0 FIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000542846870 1124446887 /nfs/dbraw/zinc/44/68/87/1124446887.db2.gz OBFFACOVUNWAMK-DVECYGJZSA-N 2 0 366.549 4.303 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cnn(Cc2ccccc2)c1 ZINC000246809935 1124562487 /nfs/dbraw/zinc/56/24/87/1124562487.db2.gz AOFTYYZYLNDLAT-WOJBJXKFSA-N 2 0 354.542 4.237 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(OC(F)F)c2)[C@@H](C)C1 ZINC000246844018 1124566735 /nfs/dbraw/zinc/56/67/35/1124566735.db2.gz CGWVNQMMIFGUCT-BXWFABGCSA-N 2 0 370.484 4.076 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)nnn1-c1ccc(F)cc1 ZINC000246923350 1124574563 /nfs/dbraw/zinc/57/45/63/1124574563.db2.gz GUXGGSVBTACXTD-SJORKVTESA-N 2 0 373.520 4.020 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4c3cnn4C)cc2)C1 ZINC000246928802 1124574822 /nfs/dbraw/zinc/57/48/22/1124574822.db2.gz HAZPLRHPIQNKLR-SVMVAKDDSA-N 2 0 366.553 4.065 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)C1 ZINC000246984776 1124578434 /nfs/dbraw/zinc/57/84/34/1124578434.db2.gz JXIKQMGEMJEYMW-ZBFHGGJFSA-N 2 0 359.539 4.120 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1nc(-c2ccccc2)cs1 ZINC000247051068 1124586186 /nfs/dbraw/zinc/58/61/86/1124586186.db2.gz OUTUAUHMLNJRGU-KZNAEPCWSA-N 2 0 373.566 4.350 20 0 FIADRP c1ccc(COc2ccc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000247064218 1124587055 /nfs/dbraw/zinc/58/70/55/1124587055.db2.gz VOEXDOOKSFIQEU-VXKWHMMOSA-N 2 0 350.506 4.025 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1ccc(Cl)s1 ZINC000247103714 1124589926 /nfs/dbraw/zinc/58/99/26/1124589926.db2.gz QCJWAKZEUMPQDT-LSDHHAIUSA-N 2 0 364.942 4.473 20 0 FIADRP CC(C)n1ncc2cc(CN3CCC[C@H](C[N@@H+]4CCCC[C@@H]4C)C3)cnc21 ZINC000247115783 1124592807 /nfs/dbraw/zinc/59/28/07/1124592807.db2.gz YNPGLJAHBBXFRH-OALUTQOASA-N 2 0 369.557 4.099 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2COCc2ccccc2)[C@@H](C)C1 ZINC000247210225 1124599272 /nfs/dbraw/zinc/59/92/72/1124599272.db2.gz WWLOOGLMVXMHPQ-WMZHIEFXSA-N 2 0 352.522 4.223 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCSc2ccc(Cl)cc21 ZINC000247957054 1124734012 /nfs/dbraw/zinc/73/40/12/1124734012.db2.gz FRBRNFXSXMRKSB-WMZOPIPTSA-N 2 0 368.974 4.094 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CCN(C)[C@@H](C)C3)s2)cc1 ZINC000247971799 1124735278 /nfs/dbraw/zinc/73/52/78/1124735278.db2.gz HKIYKLDEBJUXKO-GRDNDAEWSA-N 2 0 359.539 4.260 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1 ZINC000248001221 1124737203 /nfs/dbraw/zinc/73/72/03/1124737203.db2.gz KKMHAEVLYACEAZ-MJGOQNOKSA-N 2 0 350.572 4.075 20 0 FIADRP COCC[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412044 1124765213 /nfs/dbraw/zinc/76/52/13/1124765213.db2.gz ZYRFVYKYAJVYOM-HFSMHLIXSA-N 2 0 362.533 4.016 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc2ccccc21 ZINC000248437163 1124768453 /nfs/dbraw/zinc/76/84/53/1124768453.db2.gz GWTAOGLTLTXCNI-XMSQKQJNSA-N 2 0 360.501 4.257 20 0 FIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168678344 1124768975 /nfs/dbraw/zinc/76/89/75/1124768975.db2.gz VOIGMRFGKOYVKD-RBBKRZOGSA-N 2 0 360.542 4.112 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000248444576 1124769005 /nfs/dbraw/zinc/76/90/05/1124769005.db2.gz MCUJVEFVEGGJNU-JPYJTQIMSA-N 2 0 352.522 4.057 20 0 FIADRP CN1CCC[C@H](C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)[C@H]1c1cccs1 ZINC000248739046 1124808615 /nfs/dbraw/zinc/80/86/15/1124808615.db2.gz PQUFWWGVJLYTOD-SCQOQHIRSA-N 2 0 360.567 4.068 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCCc4occc43)cc2)C[C@@H](C)O1 ZINC000249044968 1124839037 /nfs/dbraw/zinc/83/90/37/1124839037.db2.gz VSHGXZQVUSGJPW-LZJOCLMNSA-N 2 0 354.494 4.056 20 0 FIADRP Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000249171832 1124847711 /nfs/dbraw/zinc/84/77/11/1124847711.db2.gz BYXUPDNCQYCIDD-LMMKCTJWSA-N 2 0 352.526 4.114 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000089695978 1124928462 /nfs/dbraw/zinc/92/84/62/1124928462.db2.gz MRZYOKLTNGDNGM-PIGZYNQJSA-N 2 0 369.734 4.164 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000090468910 1124998137 /nfs/dbraw/zinc/99/81/37/1124998137.db2.gz CQEHBIRJOBDSQQ-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)cc1 ZINC000090523990 1125001458 /nfs/dbraw/zinc/00/14/58/1125001458.db2.gz DEHAHHOCHRNDHX-UFYCRDLUSA-N 2 0 350.934 4.149 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1OC ZINC000090775245 1125020536 /nfs/dbraw/zinc/02/05/36/1125020536.db2.gz WNCFESGCAQPSJK-KKXNLOMOSA-N 2 0 360.542 4.398 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000091285174 1125062021 /nfs/dbraw/zinc/06/20/21/1125062021.db2.gz GKWLQOKOPVHIAJ-QFIPXVFZSA-N 2 0 361.549 4.064 20 0 FIADRP COCCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000092739416 1125240183 /nfs/dbraw/zinc/24/01/83/1125240183.db2.gz YCHFQNXGYDPEEW-IXDOHACOSA-N 2 0 367.603 4.049 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(C)ccc1OC ZINC000093403370 1125320492 /nfs/dbraw/zinc/32/04/92/1125320492.db2.gz ODYAKVDWUDOLKW-HXUWFJFHSA-N 2 0 356.510 4.185 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N(CC)C2CCCCC2)CC1 ZINC000521431713 568047718 /nfs/dbraw/zinc/04/77/18/568047718.db2.gz MSWXIJIEHAMRBR-IBGZPJMESA-N 2 0 365.606 4.000 20 0 FIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCCC[N@@H+]3Cc3cnccn3)CC2)cc1 ZINC000563117494 568220530 /nfs/dbraw/zinc/22/05/30/568220530.db2.gz YQSREXDQUOIXJO-QHCPKHFHSA-N 2 0 364.537 4.133 20 0 FIADRP CCOc1cc2[nH+]ccc(NC[C@@H](c3ccco3)[NH+](C)C)c2cc1OCC ZINC000303250749 568262917 /nfs/dbraw/zinc/26/29/17/568262917.db2.gz FOUCSHZYJYJQAR-SFHVURJKSA-N 2 0 369.465 4.340 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000563131365 568263389 /nfs/dbraw/zinc/26/33/89/568263389.db2.gz IBFXHDSBTBRGFE-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP CC[C@H](C[N@H+](Cc1nccn1CC)[C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000563136706 568270129 /nfs/dbraw/zinc/27/01/29/568270129.db2.gz NHZVWTYOCFQUEL-CTNGQTDRSA-N 2 0 366.553 4.041 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(O)c2)cc1C[NH+]1CCCCC1 ZINC000182746951 1125613382 /nfs/dbraw/zinc/61/33/82/1125613382.db2.gz CWMAMPZWHDNGMG-QGZVFWFLSA-N 2 0 354.494 4.238 20 0 FIADRP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC001648785838 1079569388 /nfs/dbraw/zinc/56/93/88/1079569388.db2.gz HSNLNFXWOWAOLG-YKSBVNFPSA-N 2 0 363.549 4.287 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000579744267 1079607536 /nfs/dbraw/zinc/60/75/36/1079607536.db2.gz YGCGUXVJAZVIFV-MCIONIFRSA-N 2 0 371.388 4.251 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC000683159348 1079747487 /nfs/dbraw/zinc/74/74/87/1079747487.db2.gz MQFHOZHGQVSVGN-IRLDBZIGSA-N 2 0 364.533 4.054 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC000683159354 1079747659 /nfs/dbraw/zinc/74/76/59/1079747659.db2.gz MQFHOZHGQVSVGN-UNMCSNQZSA-N 2 0 364.533 4.054 20 0 FIADRP CC[N@H+](C[C@H](C[NH+](C)Cc1ccccc1)c1ccccc1)C[C@@H]1CCOC1 ZINC001167063837 1079893916 /nfs/dbraw/zinc/89/39/16/1079893916.db2.gz VBPGXGIKWPGCJQ-UPVQGACJSA-N 2 0 366.549 4.261 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CC1CCC(c2ccccc2)CC1 ZINC000547743961 1080374044 /nfs/dbraw/zinc/37/40/44/1080374044.db2.gz DBHUTXHPHSIVKV-BPQOJPLISA-N 2 0 356.554 4.144 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000180110420 1080449044 /nfs/dbraw/zinc/44/90/44/1080449044.db2.gz JQMILCOEVPWARA-DEOSSOPVSA-N 2 0 365.565 4.092 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180119323 1080450425 /nfs/dbraw/zinc/45/04/25/1080450425.db2.gz JWTKLXRRLNNOTM-PGRDOPGGSA-N 2 0 371.956 4.045 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1 ZINC000120709746 1080478237 /nfs/dbraw/zinc/47/82/37/1080478237.db2.gz CSYDTTLOZCAKOL-UHFFFAOYSA-N 2 0 350.462 4.177 20 0 FIADRP COc1ccccc1[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1Cl ZINC000180460158 1080502108 /nfs/dbraw/zinc/50/21/08/1080502108.db2.gz KALRWPVLELFHFG-OAQYLSRUSA-N 2 0 358.913 4.369 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180712184 1080541569 /nfs/dbraw/zinc/54/15/69/1080541569.db2.gz HXHKVLPGGPXWKA-QFIPXVFZSA-N 2 0 371.956 4.045 20 0 FIADRP Cc1ncncc1[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000655686759 1081114329 /nfs/dbraw/zinc/11/43/29/1081114329.db2.gz CFMJUXAEBVRHJW-QGZVFWFLSA-N 2 0 360.505 4.364 20 0 FIADRP Fc1ccc([C@H](CC(F)(F)F)NC2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000655735343 1081156599 /nfs/dbraw/zinc/15/65/99/1081156599.db2.gz HLRVLQJYXZCWGZ-ROUUACIJSA-N 2 0 374.422 4.052 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805431 1081210685 /nfs/dbraw/zinc/21/06/85/1081210685.db2.gz OBMUSRPJYFNUDD-ALYFQZSWSA-N 2 0 369.372 4.162 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc(Oc3ccccn3)c2)C1 ZINC001648816584 1081237282 /nfs/dbraw/zinc/23/72/82/1081237282.db2.gz APADOGLXEPPCHM-LJQANCHMSA-N 2 0 353.510 4.476 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(C(=O)OC(C)(C)C)c2)CC1 ZINC001167321932 1081381904 /nfs/dbraw/zinc/38/19/04/1081381904.db2.gz LXNXEASYMKFIDG-UHFFFAOYSA-N 2 0 360.542 4.194 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(OC)cc3c2C1 ZINC000122998922 1081419871 /nfs/dbraw/zinc/41/98/71/1081419871.db2.gz FWELKIOZHBFWNZ-IRXDYDNUSA-N 2 0 357.542 4.134 20 0 FIADRP COc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)CC3 ZINC000123347711 1081473878 /nfs/dbraw/zinc/47/38/78/1081473878.db2.gz FGWRWBWUJMDOPI-QGZVFWFLSA-N 2 0 367.537 4.030 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)Cc1ccn(C(C)C)n1)N1CCc2ccccc2C1 ZINC000543995266 1081501800 /nfs/dbraw/zinc/50/18/00/1081501800.db2.gz AFOLZSDKLUHROT-XXBNENTESA-N 2 0 368.569 4.068 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]C23CCC(C(F)(F)F)(CC2)CC3)cc1 ZINC000683844768 1081773312 /nfs/dbraw/zinc/77/33/12/1081773312.db2.gz XLXYJEWQPNMBPR-UHFFFAOYSA-N 2 0 370.459 4.372 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000580315328 1081834971 /nfs/dbraw/zinc/83/49/71/1081834971.db2.gz COQPSPCVPFXZLE-QFBILLFUSA-N 2 0 367.518 4.184 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312782662 1081841479 /nfs/dbraw/zinc/84/14/79/1081841479.db2.gz ASJLKICJBLSYOD-GHTZIAJQSA-N 2 0 368.521 4.094 20 0 FIADRP Cc1ccc(C[C@@H]2CCC[N@@H+]2Cc2cccc(CN3CCOCC3)c2)cc1 ZINC001167386991 1081909881 /nfs/dbraw/zinc/90/98/81/1081909881.db2.gz MTTZASCAFRANJI-DEOSSOPVSA-N 2 0 364.533 4.034 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1 ZINC000683927218 1081929125 /nfs/dbraw/zinc/92/91/25/1081929125.db2.gz GLSUEHSDYKYXCH-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000471585484 1081984733 /nfs/dbraw/zinc/98/47/33/1081984733.db2.gz MKILJLNUKXBVDB-FUKQBSRTSA-N 2 0 357.586 4.311 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccc5ccccc5n4)C[C@H]3C2)cc1 ZINC000312889946 1081993632 /nfs/dbraw/zinc/99/36/32/1081993632.db2.gz HZIJYRRZICEWCR-FCHUYYIVSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1 ZINC000471599096 1082037089 /nfs/dbraw/zinc/03/70/89/1082037089.db2.gz NYSROAMDLZDGDR-PMACEKPBSA-N 2 0 357.586 4.411 20 0 FIADRP C[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Br)cn1 ZINC000580749362 1082120539 /nfs/dbraw/zinc/12/05/39/1082120539.db2.gz YKAMISSRJBZNIV-OAHLLOKOSA-N 2 0 374.326 4.291 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCCc3c4cc(C)ccc4[nH]c32)CC[NH+](C)CC1 ZINC000580862751 1082196702 /nfs/dbraw/zinc/19/67/02/1082196702.db2.gz JHPLDZMROBQIEA-LJQANCHMSA-N 2 0 357.567 4.271 20 0 FIADRP CCC[N@H+](Cc1ccc(OCc2cccs2)c(OC)c1)C1CC[NH2+]CC1 ZINC000580952473 1082246375 /nfs/dbraw/zinc/24/63/75/1082246375.db2.gz GGJHROBZMADINA-UHFFFAOYSA-N 2 0 374.550 4.300 20 0 FIADRP FC(F)(F)CCCN1CCC[C@@]2(CCC[N@H+](C[C@H]3CCCCO3)C2)C1 ZINC001279475220 1082254801 /nfs/dbraw/zinc/25/48/01/1082254801.db2.gz XUVPNVGURDMGSA-QZTJIDSGSA-N 2 0 362.480 4.076 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)CC[NH+](C)CC1 ZINC000581041608 1082287665 /nfs/dbraw/zinc/28/76/65/1082287665.db2.gz BOSUMGBFFZIQIY-ZDUSSCGKSA-N 2 0 362.461 4.063 20 0 FIADRP C[C@H]([NH2+]CC(C)(C)Oc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155452 1082390864 /nfs/dbraw/zinc/39/08/64/1082390864.db2.gz GJXIFIJBSRRMAA-FPOVZHCZSA-N 2 0 352.522 4.344 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccncc2OCC[NH+](C)C)C[C@@H](c2ccccc2)C1 ZINC000581570563 1082669787 /nfs/dbraw/zinc/66/97/87/1082669787.db2.gz BCWBRBAGQHQLHQ-YUXAGFNASA-N 2 0 367.537 4.084 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)Oc1ccccc1C(F)(F)F ZINC000090230982 1082690522 /nfs/dbraw/zinc/69/05/22/1082690522.db2.gz VXFXMAJQRIKRGT-BZUAXINKSA-N 2 0 356.432 4.079 20 0 FIADRP Clc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000656684989 1082715804 /nfs/dbraw/zinc/71/58/04/1082715804.db2.gz ZODXHIZKABPNKZ-OAQYLSRUSA-N 2 0 355.913 4.224 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)c(Cl)c1 ZINC000656683964 1082717815 /nfs/dbraw/zinc/71/78/15/1082717815.db2.gz QUZCTRLDRFIZOP-OAHLLOKOSA-N 2 0 361.892 4.437 20 0 FIADRP Cn1ncc2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cc21 ZINC000581641356 1082740626 /nfs/dbraw/zinc/74/06/26/1082740626.db2.gz YROVJUKETQSBTR-UHFFFAOYSA-N 2 0 362.521 4.106 20 0 FIADRP Fc1ccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)cc1 ZINC000656786975 1082771782 /nfs/dbraw/zinc/77/17/82/1082771782.db2.gz YTNKYLGPPNNLNK-KRWDZBQOSA-N 2 0 359.514 4.161 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cncc(Br)c1 ZINC000581678616 1082794670 /nfs/dbraw/zinc/79/46/70/1082794670.db2.gz VCEHMDLUNXBOEM-CABCVRRESA-N 2 0 354.336 4.007 20 0 FIADRP CCCOc1ccc(C[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)cn1 ZINC000156682330 1082952448 /nfs/dbraw/zinc/95/24/48/1082952448.db2.gz USHUTLPZBRYRQD-MRXNPFEDSA-N 2 0 350.466 4.215 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000090971328 1083096602 /nfs/dbraw/zinc/09/66/02/1083096602.db2.gz JWBGVALWHDJGPU-GOSISDBHSA-N 2 0 369.578 4.439 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)[C@H](C)C1 ZINC000430758017 1083146661 /nfs/dbraw/zinc/14/66/61/1083146661.db2.gz YHQTVEOAHDYVQP-SCFUHWHPSA-N 2 0 369.322 4.154 20 0 FIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000510683518 1083236998 /nfs/dbraw/zinc/23/69/98/1083236998.db2.gz GPHOIBASIVVDAW-OAHLLOKOSA-N 2 0 354.460 4.491 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)[C@@H]3CCCc4ccccc43)CC2)CC1 ZINC000430950838 1083250863 /nfs/dbraw/zinc/25/08/63/1083250863.db2.gz JDQKSCBCRUAIJX-XMMPIXPASA-N 2 0 369.597 4.192 20 0 FIADRP CO[C@@]1(C)C[C@@H]([N@H+](C)CCC[NH+]2CCC(Cc3ccccc3)CC2)C1(C)C ZINC001167493450 1083270104 /nfs/dbraw/zinc/27/01/04/1083270104.db2.gz YUYHXTVSDICIIE-VWNXMTODSA-N 2 0 372.597 4.467 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CCc2c(F)cccc2F)[C@H](C)C1 ZINC000510755988 1083294158 /nfs/dbraw/zinc/29/41/58/1083294158.db2.gz YBCJJTCTYQCYMR-WWMYMODYSA-N 2 0 368.512 4.013 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCCC[C@@H]2C)cc1)C1CC1 ZINC000510830988 1083334486 /nfs/dbraw/zinc/33/44/86/1083334486.db2.gz BYNQOGQXJYCBFJ-IBGZPJMESA-N 2 0 371.569 4.055 20 0 FIADRP COc1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c(-c2ccccc2)cc1OC ZINC000092253551 1083366491 /nfs/dbraw/zinc/36/64/91/1083366491.db2.gz FZBFSQDMFIJSQN-GOSISDBHSA-N 2 0 368.521 4.144 20 0 FIADRP C[C@H](NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cn2ccccc2n1 ZINC000658317932 1083404522 /nfs/dbraw/zinc/40/45/22/1083404522.db2.gz NZKLWAFMQJTBKB-FPOVZHCZSA-N 2 0 374.532 4.287 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658318666 1083406907 /nfs/dbraw/zinc/40/69/07/1083406907.db2.gz RTAAYXDWVARCHR-FKBYEOEOSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3CCCc4cccnc43)C3(CCC3)C2)cc1 ZINC000658318723 1083406974 /nfs/dbraw/zinc/40/69/74/1083406974.db2.gz SJLVZDQOFSVSEW-YADHBBJMSA-N 2 0 361.533 4.351 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCc3cccnc3CC2)C[N@@H+]1Cc1ccccc1 ZINC000421836282 1083432646 /nfs/dbraw/zinc/43/26/46/1083432646.db2.gz ODSQKONXIQMAAG-LSWJPFSZSA-N 2 0 363.549 4.219 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)c1ccccc1 ZINC000548483540 1083468044 /nfs/dbraw/zinc/46/80/44/1083468044.db2.gz GOBWWXLAMJMSNF-ONTIZHBOSA-N 2 0 351.538 4.012 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)CCO1 ZINC000181269473 1083849329 /nfs/dbraw/zinc/84/93/29/1083849329.db2.gz QOPCBIMFAYLBFT-WEYGHZABSA-N 2 0 362.558 4.261 20 0 FIADRP COc1ccc(C[C@@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000544081870 1083883267 /nfs/dbraw/zinc/88/32/67/1083883267.db2.gz MRRJPURXWUSIMS-QGZVFWFLSA-N 2 0 362.533 4.400 20 0 FIADRP C[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1cccc(C[NH+](C)C)c1 ZINC000926336362 1084099002 /nfs/dbraw/zinc/09/90/02/1084099002.db2.gz FKIIEQJZBDTHFL-ZIAGYGMSSA-N 2 0 362.315 4.318 20 0 FIADRP C[C@H](NC(C)(C)C[NH2+]Cc1ccccc1-c1ccnn1C)c1ccccc1 ZINC000511023628 1084228895 /nfs/dbraw/zinc/22/88/95/1084228895.db2.gz AWCDBEBWSMJORN-SFHVURJKSA-N 2 0 362.521 4.306 20 0 FIADRP CCCn1nccc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000657314068 1084454857 /nfs/dbraw/zinc/45/48/57/1084454857.db2.gz RANORTNQXIRPEN-KDURUIRLSA-N 2 0 354.542 4.061 20 0 FIADRP CCC1(C[NH2+][C@H](C)c2cc3n(n2)CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000414090835 1084518837 /nfs/dbraw/zinc/51/88/37/1084518837.db2.gz CUMDQNPCYJUDDJ-LJQANCHMSA-N 2 0 366.553 4.172 20 0 FIADRP Clc1cccc([C@@H]2CC[C@@H]([NH2+]CC3(N4CCCC4)CCOCC3)C2)c1 ZINC000414124198 1084628314 /nfs/dbraw/zinc/62/83/14/1084628314.db2.gz PFJNXIAUQOBHIJ-UYAOXDASSA-N 2 0 362.945 4.211 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cnn1-c1cc(C)ccc1C ZINC000414180138 1084756004 /nfs/dbraw/zinc/75/60/04/1084756004.db2.gz KYZJFOSZZODMQV-KRWDZBQOSA-N 2 0 359.477 4.296 20 0 FIADRP Brc1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414189128 1084774365 /nfs/dbraw/zinc/77/43/65/1084774365.db2.gz RAUYVRPLQPWLHB-QGZVFWFLSA-N 2 0 372.266 4.100 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(-c3ccc(F)cc3)no2)CC1 ZINC000613491088 1084819898 /nfs/dbraw/zinc/81/98/98/1084819898.db2.gz FKZKVTMTDHGZCI-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(Cl)c3c(c2)OCCO3)CC1 ZINC000613492768 1084826645 /nfs/dbraw/zinc/82/66/45/1084826645.db2.gz OQJAZYWSCHGGIR-UHFFFAOYSA-N 2 0 366.933 4.055 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000414296368 1084988427 /nfs/dbraw/zinc/98/84/27/1084988427.db2.gz FGLHNAXSFLKZCH-PXNSSMCTSA-N 2 0 370.562 4.303 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4cnc5ccccc5n4)C3)CC2)cc1 ZINC000660621826 1085175228 /nfs/dbraw/zinc/17/52/28/1085175228.db2.gz BXVJALOHRFJWNY-UHFFFAOYSA-N 2 0 372.516 4.118 20 0 FIADRP c1c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)onc1C1CC1 ZINC000660622570 1085183471 /nfs/dbraw/zinc/18/34/71/1085183471.db2.gz GNYNLUUJPQCAOW-UHFFFAOYSA-N 2 0 351.494 4.040 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(-c3cccc(C)c3)nc2C)c1 ZINC000651706012 1085391511 /nfs/dbraw/zinc/39/15/11/1085391511.db2.gz PACZUEPLDHKDCU-UHFFFAOYSA-N 2 0 362.521 4.231 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1cc2cc(Br)ccc2o1)C1CC1 ZINC000563438328 1085402232 /nfs/dbraw/zinc/40/22/32/1085402232.db2.gz AGESNEYDMXQIOO-UHFFFAOYSA-N 2 0 351.288 4.159 20 0 FIADRP CC(C)(C)[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657534722 1085449203 /nfs/dbraw/zinc/44/92/03/1085449203.db2.gz CTUAXVUYEPWCRE-WOJBJXKFSA-N 2 0 350.591 4.462 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)O1 ZINC000432229680 1085691347 /nfs/dbraw/zinc/69/13/47/1085691347.db2.gz TXCRPMJIDSNDOH-BETUJISGSA-N 2 0 363.304 4.112 20 0 FIADRP Clc1ccc(Cl)c(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000657613842 1085699941 /nfs/dbraw/zinc/69/99/41/1085699941.db2.gz STWRJSAKZOFYKI-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)cc1 ZINC000564989682 1085812768 /nfs/dbraw/zinc/81/27/68/1085812768.db2.gz WYDCOXSZUZPVET-QGZVFWFLSA-N 2 0 365.702 4.338 20 0 FIADRP Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000663097535 1085990390 /nfs/dbraw/zinc/99/03/90/1085990390.db2.gz YRSQGVWJRRFIFW-QFIPXVFZSA-N 2 0 352.526 4.052 20 0 FIADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000583063420 1086130377 /nfs/dbraw/zinc/13/03/77/1086130377.db2.gz SQKIQLDLPRJDCW-KNQAVFIVSA-N 2 0 350.506 4.184 20 0 FIADRP c1ccc(C(OCCN2CC[C@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000150762539 1086246042 /nfs/dbraw/zinc/24/60/42/1086246042.db2.gz ZCNZBOCWEMNTRM-OAQYLSRUSA-N 2 0 364.533 4.210 20 0 FIADRP c1ccc(-c2noc(C3CC[NH+](C4CC4)CC3)n2)c(C[NH+]2CCCCC2)c1 ZINC000583169423 1086335073 /nfs/dbraw/zinc/33/50/73/1086335073.db2.gz VIGIFTJWCFWIIH-UHFFFAOYSA-N 2 0 366.509 4.064 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2oc3ccccc3c2Br)CC1 ZINC000662245256 1086374082 /nfs/dbraw/zinc/37/40/82/1086374082.db2.gz MCAQSICKSFWIDX-UHFFFAOYSA-N 2 0 351.288 4.017 20 0 FIADRP Brc1ccc(C2([NH2+]Cc3cccc4c3CC[NH2+]C4)CCC2)cc1 ZINC000662259595 1086382828 /nfs/dbraw/zinc/38/28/28/1086382828.db2.gz ZAVUXYABQACYRQ-UHFFFAOYSA-N 2 0 371.322 4.264 20 0 FIADRP Clc1cccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)co2)c1 ZINC000662291195 1086397295 /nfs/dbraw/zinc/39/72/95/1086397295.db2.gz DFEDIOVOBVHVSZ-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290894 1086397819 /nfs/dbraw/zinc/39/78/19/1086397819.db2.gz MPTLDNBMQDCZEE-AZUAARDMSA-N 2 0 371.569 4.157 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCC[NH+](CC3CC3)C2)CC1 ZINC000663466637 1086567426 /nfs/dbraw/zinc/56/74/26/1086567426.db2.gz WFWWBYSUXQDZDL-ZKMFCFPVSA-N 3 0 369.597 4.141 20 0 FIADRP C[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1sccc1Br ZINC000663468937 1086570176 /nfs/dbraw/zinc/57/01/76/1086570176.db2.gz NOIAPLAPBRNZQX-JSGCOSHPSA-N 2 0 357.361 4.283 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469977 1086575788 /nfs/dbraw/zinc/57/57/88/1086575788.db2.gz SHCQPUDPUWJRFY-AZUAARDMSA-N 2 0 371.569 4.239 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C2 ZINC001167826833 1086618555 /nfs/dbraw/zinc/61/85/55/1086618555.db2.gz RLMSYPYWVLNXCZ-AKHDSKFASA-N 2 0 367.578 4.017 20 0 FIADRP CCN(C(=O)OC(C)(C)C)C1CC[NH+]([C@@H](C)CCC[NH+](CC)CC)CC1 ZINC001167827902 1086632298 /nfs/dbraw/zinc/63/22/98/1086632298.db2.gz ZGJWCGHGTMXVQL-SFHVURJKSA-N 2 0 369.594 4.218 20 0 FIADRP CC(C)[NH+](CCCNCc1cc(Cl)c2c(c1)OCCCO2)C(C)C ZINC000467767775 1086661939 /nfs/dbraw/zinc/66/19/39/1086661939.db2.gz FLKCWKOSNGJPTI-UHFFFAOYSA-N 2 0 354.922 4.100 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCOCC(F)(F)F)CC1 ZINC000583421744 1086669675 /nfs/dbraw/zinc/66/96/75/1086669675.db2.gz WTFRRUXOKRIAEI-UHFFFAOYSA-N 2 0 352.485 4.224 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCCC2(CN(Cc3ccccc3)C2)C1 ZINC001167834820 1086690299 /nfs/dbraw/zinc/69/02/99/1086690299.db2.gz NAUKWMRHAVEVRJ-OAQYLSRUSA-N 2 0 357.586 4.095 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](N2Cc3ccccc3NC2=O)C1 ZINC001167835208 1086700384 /nfs/dbraw/zinc/70/03/84/1086700384.db2.gz OTKUTWXGEVYGGK-ICSRJNTNSA-N 2 0 372.557 4.009 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@](C)(CNC(=O)OC(C)(C)C)C1 ZINC001167835216 1086700551 /nfs/dbraw/zinc/70/05/51/1086700551.db2.gz OWFSGGDLDGBVCV-RXVVDRJESA-N 2 0 369.594 4.124 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001167835590 1086705671 /nfs/dbraw/zinc/70/56/71/1086705671.db2.gz RRRKYDVKVODTSI-XWGVYQGASA-N 3 0 371.613 4.341 20 0 FIADRP CCOC(=O)[C@H]1CC[N@@H+]([C@@H](C)CCC[NH+](CC)CC)C[C@H]1c1ccccc1 ZINC001167838962 1086713810 /nfs/dbraw/zinc/71/38/10/1086713810.db2.gz XGHVPSOOFHPCPE-BVSLBCMMSA-N 2 0 374.569 4.166 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 ZINC001167841616 1086738069 /nfs/dbraw/zinc/73/80/69/1086738069.db2.gz NDJQVMKAMNNORW-RXVVDRJESA-N 2 0 369.594 4.218 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CCCO1 ZINC000432416898 1086741887 /nfs/dbraw/zinc/74/18/87/1086741887.db2.gz JJMHIDIIPOLLET-MAUKXSAKSA-N 2 0 368.974 4.358 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N(C)Cc2ccc(F)cc2)CC1 ZINC001167842600 1086755439 /nfs/dbraw/zinc/75/54/39/1086755439.db2.gz YNKPRZXWUCLHLT-IBGZPJMESA-N 2 0 363.565 4.232 20 0 FIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000432428240 1086756494 /nfs/dbraw/zinc/75/64/94/1086756494.db2.gz JEVBUPPNNJDJQT-FTWXPCQCSA-N 2 0 358.570 4.470 20 0 FIADRP Clc1ccc2c(ccn2CCN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000583528305 1086771295 /nfs/dbraw/zinc/77/12/95/1086771295.db2.gz NVVLAHKOHABPDL-UTKZUKDTSA-N 2 0 357.929 4.243 20 0 FIADRP C[C@H](C[NH2+]Cc1ncc(CN(C)C)s1)c1c(Cl)cccc1Cl ZINC000512128208 1086795602 /nfs/dbraw/zinc/79/56/02/1086795602.db2.gz DQNMVMXIWFTYHS-LLVKDONJSA-N 2 0 358.338 4.405 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3occc3c2)C[C@H](C)O1 ZINC000512128920 1086795637 /nfs/dbraw/zinc/79/56/37/1086795637.db2.gz ISHYBSPTSSFYSA-HDICACEKSA-N 2 0 364.489 4.332 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc3occc3c2)C[C@@H](C)O1 ZINC000512128922 1086796557 /nfs/dbraw/zinc/79/65/57/1086796557.db2.gz ISHYBSPTSSFYSA-QZTJIDSGSA-N 2 0 364.489 4.332 20 0 FIADRP c1c2cnccc2oc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657772136 1086813723 /nfs/dbraw/zinc/81/37/23/1086813723.db2.gz KBXGAALNMIRDLT-HXUWFJFHSA-N 2 0 361.489 4.220 20 0 FIADRP c1c2cccnc2oc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657774401 1086849243 /nfs/dbraw/zinc/84/92/43/1086849243.db2.gz YPWFMWURUSJDSO-FQEVSTJZSA-N 2 0 361.489 4.220 20 0 FIADRP c1cc2c(cc[nH+]c2NCCCOC2CC[NH+](Cc3ccccc3)CC2)[nH]1 ZINC000663690791 1086879397 /nfs/dbraw/zinc/87/93/97/1086879397.db2.gz VKVAZFIPKAHNBG-UHFFFAOYSA-N 2 0 364.493 4.046 20 0 FIADRP Cn1cncc1CCC[NH2+][C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000583639116 1086886760 /nfs/dbraw/zinc/88/67/60/1086886760.db2.gz WKUNAQOEPLMCHZ-QGZVFWFLSA-N 2 0 362.315 4.028 20 0 FIADRP CCO[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000583660777 1086903137 /nfs/dbraw/zinc/90/31/37/1086903137.db2.gz MDMYYOSXXNQVBZ-AJSBUHFISA-N 2 0 352.522 4.264 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccccc2)c2cccc(Br)c2)CC1 ZINC000650747716 1086936720 /nfs/dbraw/zinc/93/67/20/1086936720.db2.gz GIOGVSAVENMBGF-GOSISDBHSA-N 2 0 359.311 4.257 20 0 FIADRP Cc1c([C@H](C)NCc2ccc(C[NH3+])cc2F)cnn1-c1cccc(Cl)c1 ZINC000650753283 1086954899 /nfs/dbraw/zinc/95/48/99/1086954899.db2.gz KNTLWAPJLQURQF-ZDUSSCGKSA-N 2 0 372.875 4.283 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCCn3ccnc3)s2)cc1 ZINC000151146672 1086966621 /nfs/dbraw/zinc/96/66/21/1086966621.db2.gz OXMPONITPMXHMA-AWEZNQCLSA-N 2 0 356.495 4.065 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCc2c(Br)cccc21 ZINC000650757392 1086970842 /nfs/dbraw/zinc/97/08/42/1086970842.db2.gz WEPBWLKEVYNTSG-LJQANCHMSA-N 2 0 359.311 4.336 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000650758307 1086973086 /nfs/dbraw/zinc/97/30/86/1086973086.db2.gz MZOXXPBAOFQIBY-AWEZNQCLSA-N 2 0 352.400 4.198 20 0 FIADRP CCCn1nc(C)c(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)c1C ZINC000536140145 1086987984 /nfs/dbraw/zinc/98/79/84/1086987984.db2.gz KLFSBDSUSYKNSH-UHFFFAOYSA-N 2 0 360.590 4.244 20 0 FIADRP COc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000584020965 1087113155 /nfs/dbraw/zinc/11/31/55/1087113155.db2.gz AKDZNJBTJXXWQS-AWEZNQCLSA-N 2 0 357.325 4.166 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000584378423 1087313795 /nfs/dbraw/zinc/31/37/95/1087313795.db2.gz JKEMZOMKHQTEEX-IRLDBZIGSA-N 2 0 350.506 4.278 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000584378424 1087313839 /nfs/dbraw/zinc/31/38/39/1087313839.db2.gz JKEMZOMKHQTEEX-RBBKRZOGSA-N 2 0 350.506 4.278 20 0 FIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC)c(OC)c1 ZINC000089215094 1087380474 /nfs/dbraw/zinc/38/04/74/1087380474.db2.gz UDYHPZXMPGDUHT-HXUWFJFHSA-N 2 0 369.509 4.056 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(Cl)cc(Cl)c1 ZINC000090937143 1087411355 /nfs/dbraw/zinc/41/13/55/1087411355.db2.gz CVEQBLWIBOTSOI-CYBMUJFWSA-N 2 0 368.308 4.180 20 0 FIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000926566991 1087425956 /nfs/dbraw/zinc/42/59/56/1087425956.db2.gz IYWUVUWVRFSKHS-UHFFFAOYSA-N 2 0 353.310 4.478 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091285159 1087426977 /nfs/dbraw/zinc/42/69/77/1087426977.db2.gz BVIAZZKWCAVVCL-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(F)cn1 ZINC000092747345 1087447638 /nfs/dbraw/zinc/44/76/38/1087447638.db2.gz VLOSBOYNJGHMCO-HNNXBMFYSA-N 2 0 361.892 4.437 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3ccncc3s2)[C@H](C)C1 ZINC000657884437 1087528827 /nfs/dbraw/zinc/52/88/27/1087528827.db2.gz UHSJMKHDBXGXON-RYRKJORJSA-N 2 0 361.555 4.084 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4cccc5cnccc54)C3)C2)cc1 ZINC000685443013 1087569283 /nfs/dbraw/zinc/56/92/83/1087569283.db2.gz HZSWUVHBIJCNCU-XMMPIXPASA-N 2 0 357.501 4.333 20 0 FIADRP C[NH+](C)CCOc1ccc(C[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc1 ZINC000685476848 1087580307 /nfs/dbraw/zinc/58/03/07/1087580307.db2.gz LQGZAIYQEYHJGG-CALCHBBNSA-N 2 0 358.448 4.180 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccc(Cl)c1 ZINC000685644045 1087654921 /nfs/dbraw/zinc/65/49/21/1087654921.db2.gz HHUJHVRUDBZRAG-OAQYLSRUSA-N 2 0 358.913 4.413 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685661495 1087666036 /nfs/dbraw/zinc/66/60/36/1087666036.db2.gz UOPUZMXIEIOQDU-CDIGIKMISA-N 2 0 364.533 4.407 20 0 FIADRP C[C@H]([NH2+]C[C@@]1(C)OCCc2sccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685662044 1087666946 /nfs/dbraw/zinc/66/69/46/1087666946.db2.gz YZFGSYGQLKQZHW-LQBOVUBWSA-N 2 0 370.562 4.036 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)cc2cc1OC ZINC000658034161 1087703721 /nfs/dbraw/zinc/70/37/21/1087703721.db2.gz COIBQOQUXITMLV-IRXDYDNUSA-N 2 0 356.510 4.240 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000658067632 1087709698 /nfs/dbraw/zinc/70/96/98/1087709698.db2.gz ONXIETDYBAHKOS-CQSZACIVSA-N 2 0 354.897 4.021 20 0 FIADRP Cc1cc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CC2)ccc1F ZINC000658066604 1087709861 /nfs/dbraw/zinc/70/98/61/1087709861.db2.gz CLBQMOIEKOOQMS-QFIPXVFZSA-N 2 0 360.517 4.066 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccnc3ccccc23)CC1 ZINC000658128194 1087733857 /nfs/dbraw/zinc/73/38/57/1087733857.db2.gz TYBZJLJGFULGBQ-FDDCHVKYSA-N 2 0 351.538 4.410 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccccc1 ZINC000658143555 1087735063 /nfs/dbraw/zinc/73/50/63/1087735063.db2.gz ZHUYNVREMRVGRZ-GOTSBHOMSA-N 2 0 352.522 4.130 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc2ccccc2s1 ZINC000658139963 1087745447 /nfs/dbraw/zinc/74/54/47/1087745447.db2.gz RLAYZEHHEBWTTM-OXQOHEQNSA-N 2 0 366.530 4.319 20 0 FIADRP C[C@@H](CCc1ccc(F)cc1F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165103 1087760388 /nfs/dbraw/zinc/76/03/88/1087760388.db2.gz PNVJPAQLFVEDPD-KRWDZBQOSA-N 2 0 373.491 4.183 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(C)ccc1OC ZINC000658165390 1087761868 /nfs/dbraw/zinc/76/18/68/1087761868.db2.gz JHDMVNNGXIRTAM-JOCHJYFZSA-N 2 0 367.537 4.352 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424280369 1087909583 /nfs/dbraw/zinc/90/95/83/1087909583.db2.gz HEWBRGRPJNWZME-PMACEKPBSA-N 2 0 357.567 4.385 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc(CC[C@H]([NH3+])CC3CCCCC3)n2)cc1 ZINC000424333835 1087927050 /nfs/dbraw/zinc/92/70/50/1087927050.db2.gz DYPKWKKAYNJCDL-IBGZPJMESA-N 2 0 356.514 4.029 20 0 FIADRP C[C@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000186614313 1087948708 /nfs/dbraw/zinc/94/87/08/1087948708.db2.gz LCVYUVCHCMMGTP-HNNXBMFYSA-N 2 0 374.912 4.066 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000414791800 1088015694 /nfs/dbraw/zinc/01/56/94/1088015694.db2.gz RBTXQTMNUJCCPV-INIZCTEOSA-N 2 0 370.497 4.071 20 0 FIADRP COc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cs2)cc1 ZINC000647543578 1088030591 /nfs/dbraw/zinc/03/05/91/1088030591.db2.gz PTJBAYJIPNWBHL-QZTJIDSGSA-N 2 0 371.550 4.030 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423366020 1088167831 /nfs/dbraw/zinc/16/78/31/1088167831.db2.gz BKYNCMGWLMZCGK-LJQANCHMSA-N 2 0 357.295 4.220 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414813107 1088229122 /nfs/dbraw/zinc/22/91/22/1088229122.db2.gz LXMVRYZLUXVNNY-CABCVRRESA-N 2 0 359.901 4.175 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Br)ccc2Cl)cc1 ZINC000414815414 1088242090 /nfs/dbraw/zinc/24/20/90/1088242090.db2.gz XMEVZXMOVXEEBW-NSHDSACASA-N 2 0 353.691 4.412 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)ccc1OCc1ccc(Cl)cc1 ZINC000414826502 1088323054 /nfs/dbraw/zinc/32/30/54/1088323054.db2.gz IYGZLYRGHFGTCQ-GOSISDBHSA-N 2 0 374.912 4.017 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1)c1ccc(Cl)cc1 ZINC000414842029 1088458580 /nfs/dbraw/zinc/45/85/80/1088458580.db2.gz ORBOTUPETQJMMY-MRXNPFEDSA-N 2 0 371.912 4.072 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CNC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000414846650 1088687299 /nfs/dbraw/zinc/68/72/99/1088687299.db2.gz NSZJDZOIQSOTAC-XMMPIXPASA-N 2 0 365.565 4.107 20 0 FIADRP Clc1cccc(CC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1Cl ZINC000434542943 1088768111 /nfs/dbraw/zinc/76/81/11/1088768111.db2.gz DEXNWKSLBNPPHW-UHFFFAOYSA-N 2 0 371.352 4.113 20 0 FIADRP CCCC[N@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)[C@H](CC)c1ccccc1 ZINC000514175274 1088859802 /nfs/dbraw/zinc/85/98/02/1088859802.db2.gz XFGXLQICXLDQRK-JOCHJYFZSA-N 2 0 373.585 4.229 20 0 FIADRP CC(C)c1ccc([C@H](N)C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cc1 ZINC000414851732 1088988734 /nfs/dbraw/zinc/98/87/34/1088988734.db2.gz UUMXYMPTIAQQCH-LJQANCHMSA-N 2 0 354.523 4.062 20 0 FIADRP COc1ccc(C[N@@H+]2CCCN(c3cc(C)[nH+]c4ccccc43)CC2)cc1 ZINC000514352538 1089027299 /nfs/dbraw/zinc/02/72/99/1089027299.db2.gz HNUWTGRPJCYASO-UHFFFAOYSA-N 2 0 361.489 4.264 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)o1 ZINC000415014069 1089049031 /nfs/dbraw/zinc/04/90/31/1089049031.db2.gz ZGFIYVSQRNJVOW-MJGOQNOKSA-N 2 0 364.493 4.048 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000312390448 1089060652 /nfs/dbraw/zinc/06/06/52/1089060652.db2.gz CTQUTUVUNQEUCI-QUCCMNQESA-N 2 0 366.505 4.021 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415041038 1089079121 /nfs/dbraw/zinc/07/91/21/1089079121.db2.gz PMJBCAFLQVPYAU-WIYYLYMNSA-N 2 0 360.505 4.065 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)cc1)c1ccccc1 ZINC000415050000 1089087468 /nfs/dbraw/zinc/08/74/68/1089087468.db2.gz IASZTMLJBNKFCK-GOSISDBHSA-N 2 0 352.400 4.198 20 0 FIADRP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415055309 1089099469 /nfs/dbraw/zinc/09/94/69/1089099469.db2.gz OGXAQEUJYPAFDK-DYESRHJHSA-N 2 0 353.510 4.036 20 0 FIADRP [NH3+]C1(C[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)CCCCCC1 ZINC000414858112 1089118943 /nfs/dbraw/zinc/11/89/43/1089118943.db2.gz HWQJQVZNSPSPBL-UHFFFAOYSA-N 2 0 367.940 4.085 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)ccc1OC1CCCC1 ZINC000415084798 1089135628 /nfs/dbraw/zinc/13/56/28/1089135628.db2.gz PXHQLQPNDGEASD-HSALFYBXSA-N 2 0 358.526 4.027 20 0 FIADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000415083144 1089140635 /nfs/dbraw/zinc/14/06/35/1089140635.db2.gz MZCTZVFJFWZNLJ-FUHWJXTLSA-N 2 0 358.555 4.038 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)C1 ZINC000415126564 1089178925 /nfs/dbraw/zinc/17/89/25/1089178925.db2.gz POZIGNBCEGXZDG-QUCCMNQESA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(Oc4ccccc4)c3)CC2)C1 ZINC000415127752 1089191836 /nfs/dbraw/zinc/19/18/36/1089191836.db2.gz REGKODGULOETFB-NZQKXSOJSA-N 2 0 366.505 4.197 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccnn1C ZINC000549235819 1089315317 /nfs/dbraw/zinc/31/53/17/1089315317.db2.gz OSSBBAZTZNPMJD-QIOKEVSGSA-N 2 0 372.944 4.338 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2ccc(OCc3cccs3)c(OC)c2)CC1 ZINC000514790534 1089472430 /nfs/dbraw/zinc/47/24/30/1089472430.db2.gz ZCCQDAABENUXBL-UHFFFAOYSA-N 2 0 374.550 4.157 20 0 FIADRP COCc1cccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000435420496 1089634538 /nfs/dbraw/zinc/63/45/38/1089634538.db2.gz DGEZRDWOKKFGSO-HXUWFJFHSA-N 2 0 356.535 4.039 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000435730864 1089901780 /nfs/dbraw/zinc/90/17/80/1089901780.db2.gz IOFZAQRJDVOHKU-RUCARUNLSA-N 2 0 352.869 4.265 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(F)cc(Br)c1 ZINC000181481102 1090282515 /nfs/dbraw/zinc/28/25/15/1090282515.db2.gz VDWCLONCNVHZIT-YVEFUNNKSA-N 2 0 355.295 4.113 20 0 FIADRP COCC[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549421569 1090317992 /nfs/dbraw/zinc/31/79/92/1090317992.db2.gz ROBDRBHKHNGFOY-SIOWJKJVSA-N 2 0 350.934 4.269 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cn(C)nc2C)cc1C[NH+]1CCCCC1 ZINC000182827861 1090376008 /nfs/dbraw/zinc/37/60/08/1090376008.db2.gz GTMMSQDOKUQJJI-IRXDYDNUSA-N 2 0 370.541 4.135 20 0 FIADRP COc1ccc([C@H](C)NC2CC[NH+](C(C)C)CC2)cc1C[NH+]1CCCCC1 ZINC000183165809 1090395613 /nfs/dbraw/zinc/39/56/13/1090395613.db2.gz NSUPYOJCSWHGFB-IBGZPJMESA-N 2 0 373.585 4.205 20 0 FIADRP C[C@H](NC[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1nc2ccccc2n1C ZINC000312268561 1090467014 /nfs/dbraw/zinc/46/70/14/1090467014.db2.gz IDNKCCWJQVEJEQ-FDDCHVKYSA-N 2 0 362.521 4.136 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310968 1090804482 /nfs/dbraw/zinc/80/44/82/1090804482.db2.gz LELUWSLBEXWJAN-BVOGOJNSSA-N 2 0 354.563 4.394 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2COCc3ccccc32)CC1 ZINC000417365644 1090847009 /nfs/dbraw/zinc/84/70/09/1090847009.db2.gz OBYODQQDSMDMAX-YDPRHXJPSA-N 2 0 350.506 4.291 20 0 FIADRP CC1(C)Cc2cccc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)c2O1 ZINC000397508350 1090990798 /nfs/dbraw/zinc/99/07/98/1090990798.db2.gz KWXAOYOTWAKJGK-UHFFFAOYSA-N 2 0 364.533 4.402 20 0 FIADRP Cc1ccc([C@H]([NH2+]CCCN2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000500102733 1091040077 /nfs/dbraw/zinc/04/00/77/1091040077.db2.gz FQCANPBTELDJTQ-XMMPIXPASA-N 2 0 365.565 4.090 20 0 FIADRP C[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1cccc(F)c1 ZINC000759811429 1091158055 /nfs/dbraw/zinc/15/80/55/1091158055.db2.gz REWBPJJCOKPEHV-GOSISDBHSA-N 2 0 369.528 4.249 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc2c(c1)ncn2[C@H]1CCC[NH2+]CC1 ZINC001167752155 1091159743 /nfs/dbraw/zinc/15/97/43/1091159743.db2.gz QKDVRLZJWULBAV-ICSRJNTNSA-N 2 0 369.557 4.027 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc(CO[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC001167753355 1091171120 /nfs/dbraw/zinc/17/11/20/1091171120.db2.gz HKKGACOCGWDMRG-STZQEDGTSA-N 2 0 359.558 4.150 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1)C(F)(F)F ZINC000660474369 1091592507 /nfs/dbraw/zinc/59/25/07/1091592507.db2.gz IDDUSTUFLFTNHK-VQIMIIECSA-N 2 0 370.459 4.039 20 0 FIADRP CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000187279931 1091864373 /nfs/dbraw/zinc/86/43/73/1091864373.db2.gz AIQAGTBLVLDNPK-DEOSSOPVSA-N 2 0 366.549 4.000 20 0 FIADRP CC(C)(C)OC(=O)CCCC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512258512 1091973256 /nfs/dbraw/zinc/97/32/56/1091973256.db2.gz FUHBFKJNHMMQJM-QHCPKHFHSA-N 2 0 372.553 4.096 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C/c3ccc(F)c(F)c3)cc2)CC1 ZINC000512374621 1092181654 /nfs/dbraw/zinc/18/16/54/1092181654.db2.gz HSHHUDAJOKXHNI-NSCUHMNNSA-N 2 0 372.459 4.241 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccccc2N(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168011901 1092302366 /nfs/dbraw/zinc/30/23/66/1092302366.db2.gz UFVBHDQYMSMFSU-OALUTQOASA-N 2 0 351.538 4.284 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C1CCN(c2cccc(C)n2)CC1 ZINC000474028193 1092318541 /nfs/dbraw/zinc/31/85/41/1092318541.db2.gz AMMWVVUWAKAVMJ-NRFANRHFSA-N 2 0 365.521 4.380 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2ccc(C[NH+](C)C)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012185 1092346581 /nfs/dbraw/zinc/34/65/81/1092346581.db2.gz XOPDXFYFDRLVNU-WOJBJXKFSA-N 3 0 365.565 4.279 20 0 FIADRP Cc1cc(Br)ccc1C[NH+]1CCC2(CCC[N@@H+](C)C2)CC1 ZINC001279322881 1092352788 /nfs/dbraw/zinc/35/27/88/1092352788.db2.gz UBPOOYCFEKYCPU-UHFFFAOYSA-N 2 0 351.332 4.065 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2Br)C1 ZINC000520949772 1092375583 /nfs/dbraw/zinc/37/55/83/1092375583.db2.gz PZVLOTNAJKYSPM-HZPDHXFCSA-N 2 0 353.348 4.297 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC000544348288 1092684760 /nfs/dbraw/zinc/68/47/60/1092684760.db2.gz FXHYJBSZLYGEKY-UHFFFAOYSA-N 2 0 364.468 4.170 20 0 FIADRP COC(=O)CCC[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000549726896 1092722974 /nfs/dbraw/zinc/72/29/74/1092722974.db2.gz OOVTUCSVMSVAJG-NQIIRXRSSA-N 2 0 364.574 4.133 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000442801699 1092775061 /nfs/dbraw/zinc/77/50/61/1092775061.db2.gz PYVCLVAGNDEYAX-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC(C)(C)c3cc(OC)ccc32)[C@@H](C)C1 ZINC000474039328 1092841154 /nfs/dbraw/zinc/84/11/54/1092841154.db2.gz SUHTWKDLPUXYCF-BULFRSBZSA-N 2 0 374.569 4.144 20 0 FIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000442896170 1092848482 /nfs/dbraw/zinc/84/84/82/1092848482.db2.gz BMPZFQGIBXLIJC-INIZCTEOSA-N 2 0 371.912 4.153 20 0 FIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000442987227 1092906867 /nfs/dbraw/zinc/90/68/67/1092906867.db2.gz DXBROEPZTAEBNC-UHFFFAOYSA-N 2 0 366.427 4.244 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](O)c1ccc(F)cc1 ZINC000245689277 1092948238 /nfs/dbraw/zinc/94/82/38/1092948238.db2.gz KAZHVCUSKIFONH-MJZWAZDZSA-N 2 0 368.496 4.033 20 0 FIADRP COc1ccc([C@H](C)NC2CC[NH+](Cc3ccccc3C)CC2)cc1O ZINC000521944564 1092991593 /nfs/dbraw/zinc/99/15/93/1092991593.db2.gz DZEWJMYUAISTMC-KRWDZBQOSA-N 2 0 354.494 4.024 20 0 FIADRP CC1(C)C[C@@H]([NH2+]Cc2cc(-n3ccnc3)cs2)c2ccc(F)cc2O1 ZINC000544179075 1092997137 /nfs/dbraw/zinc/99/71/37/1092997137.db2.gz WMCCBBGZFGDLFF-QGZVFWFLSA-N 2 0 357.454 4.465 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cs1 ZINC000512636271 1093052145 /nfs/dbraw/zinc/05/21/45/1093052145.db2.gz KWGPJIKUDMDHPD-CEWLAPEOSA-N 2 0 369.578 4.138 20 0 FIADRP COC1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512648505 1093069035 /nfs/dbraw/zinc/06/90/35/1093069035.db2.gz NQPZAFHXJZZFDZ-SOBISTDDSA-N 2 0 356.554 4.082 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000512653421 1093079747 /nfs/dbraw/zinc/07/97/47/1093079747.db2.gz FDPWQVLRHVWNDA-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]1CC([NH2+]Cc2cccc3cn(C)nc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168016312 1093083017 /nfs/dbraw/zinc/08/30/17/1093083017.db2.gz UTRDNHCSBFNCQR-ROUUACIJSA-N 2 0 362.521 4.105 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2cccc3cn(C)nc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168016311 1093083288 /nfs/dbraw/zinc/08/32/88/1093083288.db2.gz UTRDNHCSBFNCQR-QZTJIDSGSA-N 2 0 362.521 4.105 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000474057470 1093163355 /nfs/dbraw/zinc/16/33/55/1093163355.db2.gz MWVZESWLOBHPDZ-BHDDXSALSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]1CC([NH2+]CCOc2cccc(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020863 1093224642 /nfs/dbraw/zinc/22/46/42/1093224642.db2.gz OATYXMAMMGDFNN-QZTJIDSGSA-N 2 0 356.485 4.236 20 0 FIADRP C[C@H]1CC([NH2+][C@H](CO)CC2CCCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168021543 1093242517 /nfs/dbraw/zinc/24/25/17/1093242517.db2.gz PWZKNZHCIZDPNG-YDHSSHFGSA-N 2 0 358.570 4.349 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000469787214 1093295455 /nfs/dbraw/zinc/29/54/55/1093295455.db2.gz NXVTZHCUEIOBTF-GHTZIAJQSA-N 2 0 364.599 4.414 20 0 FIADRP CO[C@H](C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccccc1 ZINC000433128124 1093311655 /nfs/dbraw/zinc/31/16/55/1093311655.db2.gz KTYZPPAWKGELJD-HSZRJFAPSA-N 2 0 364.533 4.362 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000469789834 1093344944 /nfs/dbraw/zinc/34/49/44/1093344944.db2.gz ZXBVJITWILYULD-QFBILLFUSA-N 2 0 370.990 4.159 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC000469789835 1093345292 /nfs/dbraw/zinc/34/52/92/1093345292.db2.gz ZXBVJITWILYULD-VQIMIIECSA-N 2 0 370.990 4.159 20 0 FIADRP COCc1cccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168024303 1093385208 /nfs/dbraw/zinc/38/52/08/1093385208.db2.gz DVKJGZHBWMEXPV-OALUTQOASA-N 2 0 352.522 4.364 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C1 ZINC000512826732 1093402272 /nfs/dbraw/zinc/40/22/72/1093402272.db2.gz ITZYPXUISLYVPG-QZTJIDSGSA-N 2 0 374.960 4.373 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C1 ZINC000512826730 1093402613 /nfs/dbraw/zinc/40/26/13/1093402613.db2.gz ITZYPXUISLYVPG-HDICACEKSA-N 2 0 374.960 4.373 20 0 FIADRP CC(C)C[C@@H](C[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1)c1ccccc1 ZINC000474149746 1093465813 /nfs/dbraw/zinc/46/58/13/1093465813.db2.gz JREQVDQYHCEHOT-ZDXQCDESSA-N 2 0 371.613 4.307 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CCCCC4CCOCC4)C[C@H]3C2)cc1 ZINC000389160269 1093479415 /nfs/dbraw/zinc/47/94/15/1093479415.db2.gz YNNLUGBLTUQPNA-PKTZIBPZSA-N 2 0 356.554 4.037 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(O)cc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168030227 1093576742 /nfs/dbraw/zinc/57/67/42/1093576742.db2.gz UXVMJCWOHMCJGA-WKZKVMAPSA-N 2 0 364.533 4.281 20 0 FIADRP CCOP(=O)(CCC[NH+]1CCC(CC)([NH+]2CCCCC2)CC1)OCC ZINC000895554361 1093599591 /nfs/dbraw/zinc/59/95/91/1093599591.db2.gz XMOAZHVLOAPOGE-UHFFFAOYSA-N 2 0 374.506 4.373 20 0 FIADRP COc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)ccc1OCc1ccccc1 ZINC000513063331 1093716837 /nfs/dbraw/zinc/71/68/37/1093716837.db2.gz YBAHTKOOBOMYRD-LJQANCHMSA-N 2 0 368.521 4.096 20 0 FIADRP Cc1cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc(C)c1OCc1ccccn1 ZINC000237050654 1093765372 /nfs/dbraw/zinc/76/53/72/1093765372.db2.gz DVYQCSDJTPJQBM-IRLDBZIGSA-N 2 0 367.537 4.240 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)c1ccco1 ZINC000513078779 1093780872 /nfs/dbraw/zinc/78/08/72/1093780872.db2.gz WBWGZPLONVMURT-SESVDKBCSA-N 2 0 361.574 4.295 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)C1 ZINC000614387823 1093805024 /nfs/dbraw/zinc/80/50/24/1093805024.db2.gz OFZWMLFIDZHWGG-OALUTQOASA-N 2 0 374.532 4.398 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2cccc3nccnc23)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036236 1093847971 /nfs/dbraw/zinc/84/79/71/1093847971.db2.gz VGZCHOCJDFQIIM-QZTJIDSGSA-N 2 0 360.505 4.161 20 0 FIADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)Sc1ccc(Br)cc1 ZINC000246531395 1093940871 /nfs/dbraw/zinc/94/08/71/1093940871.db2.gz VILQQVNWSVQOFL-KBMXLJTQSA-N 2 0 369.372 4.146 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000513337690 1094063846 /nfs/dbraw/zinc/06/38/46/1094063846.db2.gz JMDUIDIDWBMCCU-PZHBDVNGSA-N 2 0 364.533 4.348 20 0 FIADRP c1nc2c(n1[C@@H]1CC[N@@H+](Cc3cccc(-c4ccncc4)c3)C1)CCCC2 ZINC000433758685 1094082120 /nfs/dbraw/zinc/08/21/20/1094082120.db2.gz NRHQZKMWMQKNHU-OAQYLSRUSA-N 2 0 358.489 4.271 20 0 FIADRP Cc1cccc2ncc(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)n21 ZINC000513493433 1094160913 /nfs/dbraw/zinc/16/09/13/1094160913.db2.gz ASEIVVIXIFAXBN-CTNGQTDRSA-N 2 0 362.521 4.033 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1F ZINC000513494101 1094162005 /nfs/dbraw/zinc/16/20/05/1094162005.db2.gz FWRQSVDBGWEFFI-XLIONFOSSA-N 2 0 356.485 4.225 20 0 FIADRP CCCn1nc(C)c(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1C ZINC000513495466 1094162305 /nfs/dbraw/zinc/16/23/05/1094162305.db2.gz QDVPEQAMTKNFJO-PGRDOPGGSA-N 2 0 368.569 4.300 20 0 FIADRP c1ccc(C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2cccnc2)nc1 ZINC000513495411 1094162313 /nfs/dbraw/zinc/16/23/13/1094162313.db2.gz PMZQHOAMHHOMMM-XMMPIXPASA-N 2 0 372.516 4.146 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(-n3ccnc3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000513488018 1094167090 /nfs/dbraw/zinc/16/70/90/1094167090.db2.gz NQCMKJQQMVBESW-OFNKIYASSA-N 2 0 374.532 4.263 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H](Cc2ccccn2)c2cccnc2)C1 ZINC000513524798 1094197506 /nfs/dbraw/zinc/19/75/06/1094197506.db2.gz ICGRAOSTCBLBHQ-VIZSFHNOSA-N 2 0 366.553 4.108 20 0 FIADRP Cc1ccc(C)c(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000513608514 1094243438 /nfs/dbraw/zinc/24/34/38/1094243438.db2.gz IUKYNSAOBBZLJB-BGYRXZFFSA-N 2 0 352.522 4.202 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CCO)C2CCCCC2)CC1 ZINC000513652664 1094255408 /nfs/dbraw/zinc/25/54/08/1094255408.db2.gz AZMJOLMIXBMMOG-VNXZQDSDSA-N 2 0 358.570 4.351 20 0 FIADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000513679423 1094263882 /nfs/dbraw/zinc/26/38/82/1094263882.db2.gz WZYLSPHOLSKMCZ-LFDQFFAPSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@H](CCc1ccc(F)cc1F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000513678753 1094278011 /nfs/dbraw/zinc/27/80/11/1094278011.db2.gz RXULPRJEGMHNSB-MRXNPFEDSA-N 2 0 359.464 4.187 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(C)o1 ZINC000513696858 1094362453 /nfs/dbraw/zinc/36/24/53/1094362453.db2.gz FIFPJRSCQCZEAF-QZNHQXDQSA-N 2 0 367.537 4.114 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474598666 1094394674 /nfs/dbraw/zinc/39/46/74/1094394674.db2.gz JMFPOSFWRJXFDQ-BQJWPVKWSA-N 2 0 370.990 4.373 20 0 FIADRP Cc1cc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c2ccccc2n1 ZINC000501061483 1094472492 /nfs/dbraw/zinc/47/24/92/1094472492.db2.gz FNESWFVWXREGMV-UHFFFAOYSA-N 2 0 360.505 4.287 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000501063680 1094475052 /nfs/dbraw/zinc/47/50/52/1094475052.db2.gz KLXLFZAEKUTMLE-XLIONFOSSA-N 2 0 372.553 4.385 20 0 FIADRP CSc1ccc(OCC[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501066418 1094478201 /nfs/dbraw/zinc/47/82/01/1094478201.db2.gz CFBUBAHAZHSRAD-UHFFFAOYSA-N 2 0 371.550 4.031 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](Cc2ccc3ccccc3c2)C2CC2)CC1 ZINC000501088136 1094488986 /nfs/dbraw/zinc/48/89/86/1094488986.db2.gz JAAXSFBOJQNCLK-UHFFFAOYSA-N 2 0 365.565 4.220 20 0 FIADRP COc1ccc(Cl)cc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501080928 1094496414 /nfs/dbraw/zinc/49/64/14/1094496414.db2.gz WEVNDJGFWKDYEH-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000474716552 1094537878 /nfs/dbraw/zinc/53/78/78/1094537878.db2.gz YCDRLXMZPNDWKV-QZTJIDSGSA-N 2 0 370.537 4.437 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]C[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000474811460 1094634735 /nfs/dbraw/zinc/63/47/35/1094634735.db2.gz ROVAOZNXIRUJQA-JZGRTCEGSA-N 2 0 370.459 4.103 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000474800493 1094636458 /nfs/dbraw/zinc/63/64/58/1094636458.db2.gz MPGGRWRHIFFPQT-LVNJIZSUSA-N 2 0 364.961 4.190 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)cn1 ZINC000474874331 1094835919 /nfs/dbraw/zinc/83/59/19/1094835919.db2.gz AEFGQKLHNKCTNQ-UHFFFAOYSA-N 2 0 351.538 4.344 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OC ZINC000474893879 1094863144 /nfs/dbraw/zinc/86/31/44/1094863144.db2.gz ZRSMVOSDPWVSCY-IRXDYDNUSA-N 2 0 356.510 4.047 20 0 FIADRP Clc1ccccc1-c1csc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)n1 ZINC000420325582 1094888922 /nfs/dbraw/zinc/88/89/22/1094888922.db2.gz IVQSLXDWZDTNJP-HUUCEWRRSA-N 2 0 361.942 4.285 20 0 FIADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000420370461 1094903731 /nfs/dbraw/zinc/90/37/31/1094903731.db2.gz VUKRQNQCOFCTSU-INIZCTEOSA-N 2 0 374.941 4.194 20 0 FIADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cc3cc(Br)ccc3s2)C1 ZINC001205009541 1095255418 /nfs/dbraw/zinc/25/54/18/1095255418.db2.gz WJGQBHQGBVSCGZ-LBPRGKRZSA-N 2 0 353.329 4.095 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000502277583 1095297469 /nfs/dbraw/zinc/29/74/69/1095297469.db2.gz BIPWEYMVFHKNQH-KNQAVFIVSA-N 2 0 356.554 4.500 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000502469992 1095497930 /nfs/dbraw/zinc/49/79/30/1095497930.db2.gz DMCSBZQJLXXDDZ-IPMKNSEASA-N 2 0 374.569 4.186 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000421377447 1095576703 /nfs/dbraw/zinc/57/67/03/1095576703.db2.gz RRWAHKQQBNXQSO-UHFFFAOYSA-N 2 0 351.466 4.051 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1ccc(Br)cc1 ZINC000443992708 1095581523 /nfs/dbraw/zinc/58/15/23/1095581523.db2.gz ZUWYREATNAPHDN-CYBMUJFWSA-N 2 0 371.282 4.189 20 0 FIADRP CO[C@@H]1CCC[C@@H]2C[N@@H+](C3C[C@@H](C)[NH+](Cc4ccccc4)[C@H](C)C3)C[C@@H]21 ZINC001168050491 1095722221 /nfs/dbraw/zinc/72/22/21/1095722221.db2.gz BGGBUPCVJYQBFQ-YPBQMLHOSA-N 2 0 356.554 4.175 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1cnn(C2CCCC2)c1 ZINC000502699756 1095725955 /nfs/dbraw/zinc/72/59/55/1095725955.db2.gz SNAAYPBIFBFPEV-HNNXBMFYSA-N 2 0 353.445 4.174 20 0 FIADRP CCCCC[NH+]1CCN(C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051347 1095805233 /nfs/dbraw/zinc/80/52/33/1095805233.db2.gz HPKXTKQDVCQABF-SFTDATJTSA-N 2 0 357.586 4.236 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000421819532 1095933630 /nfs/dbraw/zinc/93/36/30/1095933630.db2.gz HPFHBLQNLBHUBQ-OAHLLOKOSA-N 2 0 355.869 4.444 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccncc1Cl ZINC000421822763 1095936162 /nfs/dbraw/zinc/93/61/62/1095936162.db2.gz BHZVHKIHPZNHDT-BBWFWOEESA-N 2 0 373.928 4.195 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000421879909 1095972571 /nfs/dbraw/zinc/97/25/71/1095972571.db2.gz PMGHUOSEHBHHFU-DAWZGUTISA-N 2 0 351.332 4.363 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000421887367 1095976643 /nfs/dbraw/zinc/97/66/43/1095976643.db2.gz VVJHUOPUUPREFC-FAFZWHIHSA-N 2 0 365.359 4.233 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3=CC[N@H+](C)CC3)s2)cc1 ZINC000271817149 1096131242 /nfs/dbraw/zinc/13/12/42/1096131242.db2.gz BSGUNQHTZLXYGZ-CQSZACIVSA-N 2 0 357.523 4.040 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]C[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000272649077 1096198603 /nfs/dbraw/zinc/19/86/03/1096198603.db2.gz DTHQXIIFGANLSO-HKUYNNGSSA-N 2 0 370.459 4.161 20 0 FIADRP COc1ccccc1-c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000414647687 1096332650 /nfs/dbraw/zinc/33/26/50/1096332650.db2.gz AARIUIWFUPREDN-JOCHJYFZSA-N 2 0 350.506 4.326 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000414662433 1096371945 /nfs/dbraw/zinc/37/19/45/1096371945.db2.gz QFNRHQAIUWOBTI-UYAOXDASSA-N 2 0 360.505 4.017 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422726869 1096473804 /nfs/dbraw/zinc/47/38/04/1096473804.db2.gz GEEIILJOHPGFAJ-AWEZNQCLSA-N 2 0 358.357 4.065 20 0 FIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422759269 1096474770 /nfs/dbraw/zinc/47/47/70/1096474770.db2.gz KZCCUZVMXRNPRE-MJGOQNOKSA-N 2 0 362.395 4.051 20 0 FIADRP c1ccc(SCCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422754627 1096484354 /nfs/dbraw/zinc/48/43/54/1096484354.db2.gz JPYDMGGJFUDWGO-PZJWPPBQSA-N 2 0 354.519 4.014 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)c2ccccc21 ZINC000422768363 1096485484 /nfs/dbraw/zinc/48/54/84/1096485484.db2.gz SYAPFYCKQAVCJG-UXHICEINSA-N 2 0 356.897 4.123 20 0 FIADRP Clc1ccc(SCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422774446 1096487974 /nfs/dbraw/zinc/48/79/74/1096487974.db2.gz XAJDDXUBYBFJCP-QUCCMNQESA-N 2 0 374.937 4.278 20 0 FIADRP c1sc(-c2ccccc2)nc1CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422781368 1096490389 /nfs/dbraw/zinc/49/03/89/1096490389.db2.gz IQTQXJMKTIUZNT-HSALFYBXSA-N 2 0 355.551 4.253 20 0 FIADRP FC(F)(F)COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422805589 1096496135 /nfs/dbraw/zinc/49/61/35/1096496135.db2.gz MEPDOFCCRJQSTF-FGTMMUONSA-N 2 0 356.432 4.028 20 0 FIADRP Cc1cc(Br)cc(C)c1C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422823157 1096499115 /nfs/dbraw/zinc/49/91/15/1096499115.db2.gz LIDNIUISEDWJFS-ZDUSSCGKSA-N 2 0 362.315 4.079 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000422825149 1096500922 /nfs/dbraw/zinc/50/09/22/1096500922.db2.gz JDLWIRLDHUATJE-DJJJIMSYSA-N 2 0 361.436 4.178 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000422846604 1096504502 /nfs/dbraw/zinc/50/45/02/1096504502.db2.gz FSTRLAYYZLRWQO-MGTHKWJCSA-N 2 0 368.443 4.201 20 0 FIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422879456 1096511057 /nfs/dbraw/zinc/51/10/57/1096511057.db2.gz KNIWLESRRUCGLG-HYVJGQCMSA-N 2 0 366.505 4.380 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000422880930 1096511141 /nfs/dbraw/zinc/51/11/41/1096511141.db2.gz XVDNKVNBKKXYNA-MLGOLLRUSA-N 2 0 367.946 4.176 20 0 FIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422883959 1096511869 /nfs/dbraw/zinc/51/18/69/1096511869.db2.gz WAROEBAMKBQWKN-MZKRTTBSSA-N 2 0 366.505 4.382 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422882708 1096512437 /nfs/dbraw/zinc/51/24/37/1096512437.db2.gz STHPWMSPYHNCKJ-AWEZNQCLSA-N 2 0 359.341 4.149 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)CCCCC2)cc1 ZINC000422898772 1096519289 /nfs/dbraw/zinc/51/92/89/1096519289.db2.gz FWSYOSASCZUOSI-KRWDZBQOSA-N 2 0 367.537 4.410 20 0 FIADRP c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)CCCCCC2)cc1 ZINC000422909595 1096521351 /nfs/dbraw/zinc/52/13/51/1096521351.db2.gz OJHUMEDVXJRCOL-FDFHNCONSA-N 2 0 356.554 4.025 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000422927662 1096527287 /nfs/dbraw/zinc/52/72/87/1096527287.db2.gz ZMVFZAWVVZCADL-QFBILLFUSA-N 2 0 367.320 4.426 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000422932107 1096528070 /nfs/dbraw/zinc/52/80/70/1096528070.db2.gz DNXUZIYXPLZLCY-KRWDZBQOSA-N 2 0 361.489 4.279 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000422932108 1096528380 /nfs/dbraw/zinc/52/83/80/1096528380.db2.gz DNXUZIYXPLZLCY-QGZVFWFLSA-N 2 0 361.489 4.279 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1cccs1)c1ccc2c(c1)CCCC2 ZINC000422963409 1096533376 /nfs/dbraw/zinc/53/33/76/1096533376.db2.gz IMIFUKQMDMXHIC-TZIWHRDSSA-N 2 0 358.551 4.060 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954627 1096538871 /nfs/dbraw/zinc/53/88/71/1096538871.db2.gz JKKFPFJPNGILLM-GTNSWQLSSA-N 2 0 350.293 4.494 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422976108 1096544057 /nfs/dbraw/zinc/54/40/57/1096544057.db2.gz UQUDTAKQQKOGKP-NFBKMPQASA-N 2 0 360.457 4.292 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000423037184 1096556073 /nfs/dbraw/zinc/55/60/73/1096556073.db2.gz VQAQDCQFIBICNQ-UHIXZJCNSA-N 2 0 355.929 4.108 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NCCC[C@H]1CCC[NH2+]1)C1CCCCC1 ZINC000414713306 1096557156 /nfs/dbraw/zinc/55/71/56/1096557156.db2.gz OPMXZGRNOSECBE-LJQANCHMSA-N 2 0 372.557 4.105 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC000423040781 1096557368 /nfs/dbraw/zinc/55/73/68/1096557368.db2.gz HXTLVNRMPHKMRG-OLZOCXBDSA-N 2 0 351.416 4.149 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N1CCC[C@H](CC[NH3+])C1)C1CCCCC1 ZINC000414713360 1096557406 /nfs/dbraw/zinc/55/74/06/1096557406.db2.gz OYUWPWHAAZFUJQ-GOSISDBHSA-N 2 0 372.557 4.044 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423058678 1096560518 /nfs/dbraw/zinc/56/05/18/1096560518.db2.gz KCIOTGAQECNSAQ-QWHCGFSZSA-N 2 0 351.416 4.322 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000423066297 1096562453 /nfs/dbraw/zinc/56/24/53/1096562453.db2.gz DKISOPDDMPOEMF-FYYLOGMGSA-N 2 0 366.505 4.129 20 0 FIADRP CC(C)N1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000423051214 1096564881 /nfs/dbraw/zinc/56/48/81/1096564881.db2.gz ZZNJJSLRMWPAPO-FDDYUBGGSA-N 2 0 367.940 4.110 20 0 FIADRP CC(C)N1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000423051216 1096565613 /nfs/dbraw/zinc/56/56/13/1096565613.db2.gz ZZNJJSLRMWPAPO-VAZMBZEVSA-N 2 0 367.940 4.110 20 0 FIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423100688 1096575335 /nfs/dbraw/zinc/57/53/35/1096575335.db2.gz VLVNKWTVBHWDBX-UZSDIVCKSA-N 2 0 368.908 4.432 20 0 FIADRP CCc1nc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)ccc2n1C1CC1 ZINC000423116905 1096577668 /nfs/dbraw/zinc/57/76/68/1096577668.db2.gz RZTQGTVLSKMCAV-XUVXKRRUSA-N 2 0 366.553 4.334 20 0 FIADRP Clc1cc(Br)ccc1C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000423130939 1096581180 /nfs/dbraw/zinc/58/11/80/1096581180.db2.gz HFEVGLHTAOOYQW-PBWFPOADSA-N 2 0 369.734 4.007 20 0 FIADRP Clc1cccc([C@H]2C[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423105276 1096582123 /nfs/dbraw/zinc/58/21/23/1096582123.db2.gz YWELLODYQVRUMF-ZLLBNUPZSA-N 2 0 368.908 4.432 20 0 FIADRP Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000423108388 1096583093 /nfs/dbraw/zinc/58/30/93/1096583093.db2.gz RDGJOTSLDQRHDW-OKZBNKHCSA-N 2 0 361.942 4.474 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000423149190 1096588182 /nfs/dbraw/zinc/58/81/82/1096588182.db2.gz XLURGGXVBMJCRJ-CYBMUJFWSA-N 2 0 365.399 4.087 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000423133184 1096591164 /nfs/dbraw/zinc/59/11/64/1096591164.db2.gz VRTVWVDRTPFVSV-HXOBKFHXSA-N 2 0 368.569 4.001 20 0 FIADRP Fc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423144514 1096596045 /nfs/dbraw/zinc/59/60/45/1096596045.db2.gz HHKHVYQQFBOOJY-TUNNFDKTSA-N 2 0 352.453 4.049 20 0 FIADRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423186407 1096596866 /nfs/dbraw/zinc/59/68/66/1096596866.db2.gz NZGQCTIBBYSDPK-CQSZACIVSA-N 2 0 365.237 4.261 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH+]1CCC(Cc2c(F)cccc2F)CC1 ZINC000423169636 1096601056 /nfs/dbraw/zinc/60/10/56/1096601056.db2.gz ZSBIZTKWPNLKJL-HNNXBMFYSA-N 2 0 359.464 4.143 20 0 FIADRP COc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1C ZINC000414720328 1096601219 /nfs/dbraw/zinc/60/12/19/1096601219.db2.gz BRZHWOMHINJLFW-FQEVSTJZSA-N 2 0 356.535 4.209 20 0 FIADRP C[NH2+]CCC[NH2+][C@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000423197836 1096614538 /nfs/dbraw/zinc/61/45/38/1096614538.db2.gz BLIAIIKSYHLYHX-LLVKDONJSA-N 2 0 368.344 4.141 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423213737 1096616335 /nfs/dbraw/zinc/61/63/35/1096616335.db2.gz NXMBVXZJIDNWNO-QWRGUYRKSA-N 2 0 365.237 4.118 20 0 FIADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423253843 1096632003 /nfs/dbraw/zinc/63/20/03/1096632003.db2.gz WNDYBFCSRFFDCR-GHMZBOCLSA-N 2 0 365.237 4.118 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423292666 1096635821 /nfs/dbraw/zinc/63/58/21/1096635821.db2.gz NURYCSMUUFAIJF-SJORKVTESA-N 2 0 368.525 4.431 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@@]3(C)CCC[NH2+]C3)s2)cc1 ZINC000423315746 1096641322 /nfs/dbraw/zinc/64/13/22/1096641322.db2.gz AELSGHKQDWOJJH-VLIAUNLRSA-N 2 0 359.539 4.167 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423296625 1096644830 /nfs/dbraw/zinc/64/48/30/1096644830.db2.gz ZOXFTCOLFKJWPL-ZIAGYGMSSA-N 2 0 352.507 4.384 20 0 FIADRP Clc1cc(Br)ccc1[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CC1 ZINC000423360615 1096656118 /nfs/dbraw/zinc/65/61/18/1096656118.db2.gz WGBZNXQKLIWPGJ-INIZCTEOSA-N 2 0 355.707 4.063 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)(F)F)cc1 ZINC000423403047 1096672127 /nfs/dbraw/zinc/67/21/27/1096672127.db2.gz XAICQHFJIQLEMP-SFHVURJKSA-N 2 0 350.384 4.429 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccco1)c1ccc(Br)cc1 ZINC000423445579 1096678437 /nfs/dbraw/zinc/67/84/37/1096678437.db2.gz YDJUVNPRWVDOBZ-GUYCJALGSA-N 2 0 351.288 4.239 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)s2)cc1 ZINC000423432705 1096684652 /nfs/dbraw/zinc/68/46/52/1096684652.db2.gz JFPKEUNBXKMQLZ-FASAQXTFSA-N 2 0 371.550 4.166 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423436360 1096685646 /nfs/dbraw/zinc/68/56/46/1096685646.db2.gz LTOSRAYGVWGWMU-HBMCJLEFSA-N 2 0 372.459 4.355 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000423435569 1096685747 /nfs/dbraw/zinc/68/57/47/1096685747.db2.gz LEDGCLSHBLTNQB-WQTXXOFMSA-N 2 0 350.506 4.401 20 0 FIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000423463377 1096690708 /nfs/dbraw/zinc/69/07/08/1096690708.db2.gz PWFGHBLPRAGPLO-RWRNEIEHSA-N 2 0 355.345 4.067 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3CCC[C@@H]([NH3+])C3)s2)cc1 ZINC000423454772 1096698567 /nfs/dbraw/zinc/69/85/67/1096698567.db2.gz DJEPDTULXHQOOG-JLJPHGGASA-N 2 0 359.539 4.295 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423454003 1096699012 /nfs/dbraw/zinc/69/90/12/1096699012.db2.gz LFYSXRFTMWYMBA-SCLBCKFNSA-N 2 0 365.290 4.395 20 0 FIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1nc2ccc(Cl)cc2n1C ZINC000423507183 1096701756 /nfs/dbraw/zinc/70/17/56/1096701756.db2.gz PTNGTMKXFZIBOY-PBHICJAKSA-N 2 0 356.901 4.358 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423506991 1096702490 /nfs/dbraw/zinc/70/24/90/1096702490.db2.gz JFWPHBDSZAOXDD-YKSBVNFPSA-N 3 0 365.565 4.152 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCC[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000423487401 1096704051 /nfs/dbraw/zinc/70/40/51/1096704051.db2.gz UGQFXSQPIQXQLS-WMLDXEAASA-N 2 0 359.539 4.310 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)ccc1OC(F)F ZINC000423494504 1096706403 /nfs/dbraw/zinc/70/64/03/1096706403.db2.gz AQPSULWBBGORBA-WMLDXEAASA-N 2 0 364.436 4.427 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000423512697 1096710190 /nfs/dbraw/zinc/71/01/90/1096710190.db2.gz QXKNVZXHDCELGM-HICWGWBUSA-N 2 0 357.723 4.271 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000423525190 1096712916 /nfs/dbraw/zinc/71/29/16/1096712916.db2.gz KCPGPCLOIPKQNX-YLJYHZDGSA-N 2 0 369.578 4.270 20 0 FIADRP NC1(C[NH2+][C@H]2CCCC23CCCCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000423523837 1096713205 /nfs/dbraw/zinc/71/32/05/1096713205.db2.gz IUMXWOJPHJGGBD-NRFANRHFSA-N 2 0 355.570 4.073 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1OCc1ccccc1 ZINC000423538713 1096715684 /nfs/dbraw/zinc/71/56/84/1096715684.db2.gz GYZJDXMSOJPNQZ-FYZZASKESA-N 2 0 350.506 4.304 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423537770 1096715857 /nfs/dbraw/zinc/71/58/57/1096715857.db2.gz DNCWBNYHSOGSJF-UDTPNQRGSA-N 2 0 355.551 4.081 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423538786 1096715889 /nfs/dbraw/zinc/71/58/89/1096715889.db2.gz HDOYKSJLFXIEGK-ZNTQHIFFSA-N 2 0 368.496 4.096 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)s2)cc1 ZINC000423540291 1096716764 /nfs/dbraw/zinc/71/67/64/1096716764.db2.gz JPDJCDBSICYUHU-OKDNKWQNSA-N 2 0 371.550 4.166 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc2cc(Br)ccc2o1 ZINC000423541717 1096716891 /nfs/dbraw/zinc/71/68/91/1096716891.db2.gz LNOBYULSJLNJMJ-CAVOSLQRSA-N 2 0 363.299 4.234 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCC1=CC[NH2+]CC1 ZINC000423544229 1096717587 /nfs/dbraw/zinc/71/75/87/1096717587.db2.gz WGVABOPSEXXEEF-SFHVURJKSA-N 2 0 374.326 4.207 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423555613 1096720895 /nfs/dbraw/zinc/72/08/95/1096720895.db2.gz YDQILCJBNMFHOE-XMTFNYHQSA-N 2 0 353.535 4.165 20 0 FIADRP Cc1ccc([C@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)C2CCC2)o1 ZINC000423580197 1096724744 /nfs/dbraw/zinc/72/47/44/1096724744.db2.gz XIPWQGMQVBFQCP-JOCHJYFZSA-N 2 0 367.537 4.012 20 0 FIADRP C[NH+](C)CCC1CC[NH+]([C@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000532926906 1098597077 /nfs/dbraw/zinc/59/70/77/1098597077.db2.gz GGWAQRLTZODRRL-QFIPXVFZSA-N 2 0 365.521 4.030 20 0 FIADRP Cc1ncsc1CN(C[C@H]1CC[NH2+]C1)[C@H](C)c1ccc(F)c(Cl)c1 ZINC000436056239 1098681812 /nfs/dbraw/zinc/68/18/12/1098681812.db2.gz SHVRXDGYWQIURJ-KGLIPLIRSA-N 2 0 367.921 4.417 20 0 FIADRP Cc1ncsc1CN(C[C@H]1CC[NH2+]C1)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000436056238 1098682518 /nfs/dbraw/zinc/68/25/18/1098682518.db2.gz SHVRXDGYWQIURJ-KBPBESRZSA-N 2 0 367.921 4.417 20 0 FIADRP CN1CCC[C@H](C[NH2+]Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1cccs1 ZINC000436236205 1098859679 /nfs/dbraw/zinc/85/96/79/1098859679.db2.gz DSVLYZMKTLAZRX-AUUYWEPGSA-N 2 0 372.563 4.372 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000515846351 1098978534 /nfs/dbraw/zinc/97/85/34/1098978534.db2.gz VUSQXTJGJACWER-OXQOHEQNSA-N 2 0 372.484 4.083 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000436403976 1098992560 /nfs/dbraw/zinc/99/25/60/1098992560.db2.gz AUWJAMPAECOLIU-SJLPKXTDSA-N 2 0 351.469 4.307 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000436470384 1099045966 /nfs/dbraw/zinc/04/59/66/1099045966.db2.gz KIRXQXCXTUJVEY-FQEVSTJZSA-N 2 0 373.447 4.319 20 0 FIADRP CC[N@H+](Cc1c[nH]nc1-c1ccc(C)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000516118037 1099197300 /nfs/dbraw/zinc/19/73/00/1099197300.db2.gz RFWVBNSYCURFTR-UHFFFAOYSA-N 2 0 352.482 4.062 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cncc(Br)c1 ZINC000578084186 1099306220 /nfs/dbraw/zinc/30/62/20/1099306220.db2.gz RWAJOSHBODEEOV-LSDHHAIUSA-N 2 0 354.336 4.149 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cs2)cc1 ZINC000516297590 1099344306 /nfs/dbraw/zinc/34/43/06/1099344306.db2.gz GYOFNJIGAOPIDY-HXUWFJFHSA-N 2 0 371.550 4.173 20 0 FIADRP C[C@]1([NH3+])CCCC[C@H]1c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000261891741 1099674073 /nfs/dbraw/zinc/67/40/73/1099674073.db2.gz XNVZSNAXDMJZJD-RXVVDRJESA-N 2 0 354.498 4.098 20 0 FIADRP Cc1ccc([C@@H]([NH3+])C(=O)Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000262629016 1099726934 /nfs/dbraw/zinc/72/69/34/1099726934.db2.gz GPUSRTCGZZSDQK-LAUBAEHRSA-N 2 0 351.494 4.008 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CC[C@@](O)(C(F)(F)F)C2)CC1 ZINC000648592477 1099749710 /nfs/dbraw/zinc/74/97/10/1099749710.db2.gz GXKMFGQLEXZVBS-QAPCUYQASA-N 2 0 364.496 4.101 20 0 FIADRP Cc1ccc([C@H](CN[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000508709537 1099876370 /nfs/dbraw/zinc/87/63/70/1099876370.db2.gz HSMJTJIAJZXKGI-QDSKXPNFSA-N 2 0 365.565 4.098 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714335 1099882547 /nfs/dbraw/zinc/88/25/47/1099882547.db2.gz GZLDRXFFPUILJB-WSTZPKSXSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@H]([NH2+]CCCCN(C)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715621 1099885096 /nfs/dbraw/zinc/88/50/96/1099885096.db2.gz DRVUWMFURVRBBB-GMAHTHKFSA-N 2 0 365.565 4.403 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000508714822 1099885773 /nfs/dbraw/zinc/88/57/73/1099885773.db2.gz CAAKPCUOZVVPQH-PMOQBDJRSA-N 2 0 351.538 4.321 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713936 1099886197 /nfs/dbraw/zinc/88/61/97/1099886197.db2.gz AQHMRHPIGYHDDE-XLIONFOSSA-N 2 0 374.475 4.331 20 0 FIADRP COC(=O)CCC[C@H]1CCC[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000516870695 1099898382 /nfs/dbraw/zinc/89/83/82/1099898382.db2.gz KVDJIISYHVGUIV-QUCCMNQESA-N 2 0 364.574 4.275 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709976 1099898895 /nfs/dbraw/zinc/89/88/95/1099898895.db2.gz KNQCSAZHQMXPGQ-VXSCBNMQSA-N 2 0 358.570 4.328 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000162573458 1099903652 /nfs/dbraw/zinc/90/36/52/1099903652.db2.gz AGVSCODQQNXNET-OAQYLSRUSA-N 2 0 366.505 4.163 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000162573595 1099903999 /nfs/dbraw/zinc/90/39/99/1099903999.db2.gz AGVSCODQQNXNET-NRFANRHFSA-N 2 0 366.505 4.163 20 0 FIADRP COCCSc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459401214 1100109913 /nfs/dbraw/zinc/10/99/13/1100109913.db2.gz CYLQEZPDSAAVKD-KRWDZBQOSA-N 2 0 371.550 4.140 20 0 FIADRP Clc1ccc2[nH]cc(CC[NH2+]C3CCN(c4cc[nH+]cc4)CC3)c2c1 ZINC000459429523 1100166865 /nfs/dbraw/zinc/16/68/65/1100166865.db2.gz WUFSWFBALPIZMT-UHFFFAOYSA-N 2 0 354.885 4.017 20 0 FIADRP CCOc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1OC(F)F ZINC000536695643 1100196457 /nfs/dbraw/zinc/19/64/57/1100196457.db2.gz KWQHGCMWSAWGNG-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459466354 1100210497 /nfs/dbraw/zinc/21/04/97/1100210497.db2.gz PBYZZQOVALQYJN-OAHLLOKOSA-N 2 0 363.427 4.290 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Br)s1 ZINC000459503776 1100240699 /nfs/dbraw/zinc/24/06/99/1100240699.db2.gz FVTPUOXMCPZFOV-LBPRGKRZSA-N 2 0 366.328 4.225 20 0 FIADRP Cc1noc(C[N@@H+]2CCCCC[C@H]2C2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000459517729 1100256831 /nfs/dbraw/zinc/25/68/31/1100256831.db2.gz FWZPPSALFOUYMV-NRFANRHFSA-N 2 0 368.525 4.035 20 0 FIADRP c1cn(CC[N@@H+]2CCCCC[C@H]2C2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000459528960 1100276797 /nfs/dbraw/zinc/27/67/97/1100276797.db2.gz ROIRVIOMHWELIE-QHCPKHFHSA-N 2 0 366.553 4.040 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666856525 1100287183 /nfs/dbraw/zinc/28/71/83/1100287183.db2.gz NLXOSQOYQVKLNR-HNNXBMFYSA-N 2 0 357.361 4.181 20 0 FIADRP FC(F)(F)[C@H](CC[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459595053 1100334957 /nfs/dbraw/zinc/33/49/57/1100334957.db2.gz SRBFKBQOHCMGQQ-LJQANCHMSA-N 2 0 363.427 4.376 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000536824977 1100341655 /nfs/dbraw/zinc/34/16/55/1100341655.db2.gz DZUYQYPSVRWLJS-PKOBYXMFSA-N 2 0 354.494 4.102 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536834949 1100345911 /nfs/dbraw/zinc/34/59/11/1100345911.db2.gz YUAWAHMAUFSGAA-UYAOXDASSA-N 2 0 354.542 4.199 20 0 FIADRP C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000536852786 1100365949 /nfs/dbraw/zinc/36/59/49/1100365949.db2.gz PTQGAGZMGXCRAE-IFXJQAMLSA-N 2 0 360.885 4.065 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccccc1Br ZINC000536831252 1100370079 /nfs/dbraw/zinc/37/00/79/1100370079.db2.gz GVMBOJVPWFZMDZ-CKEIUWERSA-N 2 0 353.348 4.045 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](c2cccs2)C2CCCC2)C[C@H](C)O1 ZINC000536857272 1100372532 /nfs/dbraw/zinc/37/25/32/1100372532.db2.gz KRFVCJUJJSJAEA-QKLQHJQFSA-N 2 0 350.572 4.458 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](c2cccs2)C2CCCC2)C[C@@H](C)O1 ZINC000536857268 1100372878 /nfs/dbraw/zinc/37/28/78/1100372878.db2.gz KRFVCJUJJSJAEA-HLIPFELVSA-N 2 0 350.572 4.458 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000536882453 1100407631 /nfs/dbraw/zinc/40/76/31/1100407631.db2.gz NOVHRVMDJDDCNS-OAHLLOKOSA-N 2 0 365.359 4.377 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000517537223 1100475650 /nfs/dbraw/zinc/47/56/50/1100475650.db2.gz LXNXNELSYIBOBT-KDURUIRLSA-N 2 0 368.569 4.337 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2CC[NH+](C)C)cc1 ZINC000438574063 1100762763 /nfs/dbraw/zinc/76/27/63/1100762763.db2.gz RHRDMKZPNVHQFH-UHFFFAOYSA-N 2 0 367.537 4.275 20 0 FIADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414949305 1100905797 /nfs/dbraw/zinc/90/57/97/1100905797.db2.gz ZTNDRMIEXSMHKI-BLLLJJGKSA-N 2 0 365.340 4.265 20 0 FIADRP Cc1ccc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C[NH+](C)C)c1 ZINC000438846343 1100974781 /nfs/dbraw/zinc/97/47/81/1100974781.db2.gz ASAKFBQHTXUVCA-FPOVZHCZSA-N 2 0 351.538 4.379 20 0 FIADRP CC(C)[N@H+](Cc1ccco1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506414702 1100988014 /nfs/dbraw/zinc/98/80/14/1100988014.db2.gz DXAVXYQESHOCES-UHFFFAOYSA-N 2 0 355.526 4.221 20 0 FIADRP c1csc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000414965350 1100999175 /nfs/dbraw/zinc/99/91/75/1100999175.db2.gz FOMUKUAFXBDNAR-SFHVURJKSA-N 2 0 366.534 4.223 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1)c1ccccc1Cl ZINC000414970411 1101035601 /nfs/dbraw/zinc/03/56/01/1101035601.db2.gz KLYNAWLQRGLYGX-KRWDZBQOSA-N 2 0 371.912 4.214 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cccc(C)c2C)CC1 ZINC000518274377 1101056391 /nfs/dbraw/zinc/05/63/91/1101056391.db2.gz YVIHWFVEVIXKAA-IBGZPJMESA-N 2 0 369.528 4.435 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CC2(c3ccccc3Br)CCC2)CC1 ZINC000426316002 1101255912 /nfs/dbraw/zinc/25/59/12/1101255912.db2.gz ADFZPSJPIPPBKA-UHFFFAOYSA-N 2 0 365.359 4.333 20 0 FIADRP Cc1cc(NC2CC[NH+](CCc3ccccc3)CC2)ccc1C[NH+](C)C ZINC000459762728 1101363530 /nfs/dbraw/zinc/36/35/30/1101363530.db2.gz NNBKACNBYWXAOB-UHFFFAOYSA-N 2 0 351.538 4.176 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013764 1101393643 /nfs/dbraw/zinc/39/36/43/1101393643.db2.gz QODUNEOYGMFSCH-DNVJHFABSA-N 2 0 374.544 4.415 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000414999982 1101514468 /nfs/dbraw/zinc/51/44/68/1101514468.db2.gz JSUFNCAXPKMUJG-BEFAXECRSA-N 2 0 371.912 4.199 20 0 FIADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190010 1101542001 /nfs/dbraw/zinc/54/20/01/1101542001.db2.gz OBZABMVZXSLYRQ-CBQOVEMMSA-N 2 0 372.553 4.015 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000506610597 1101542306 /nfs/dbraw/zinc/54/23/06/1101542306.db2.gz JEBZPGKTFFEZGL-UHFFFAOYSA-N 2 0 372.340 4.127 20 0 FIADRP Cn1cnc2cc(CN3CC[C@H]4[C@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc21 ZINC000537202875 1101554464 /nfs/dbraw/zinc/55/44/64/1101554464.db2.gz CBPXYUQCRYLGNF-GGAORHGYSA-N 2 0 374.532 4.060 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1 ZINC000537295356 1101617575 /nfs/dbraw/zinc/61/75/75/1101617575.db2.gz XCMNMOMIUDKPDQ-UHFFFAOYSA-N 2 0 364.892 4.490 20 0 FIADRP COc1ccc(CC2([NH3+])CC[NH+]([C@@H](C)Cc3ccc(Cl)cc3)CC2)cc1 ZINC001168166085 1101768443 /nfs/dbraw/zinc/76/84/43/1101768443.db2.gz HFAGNTCGWZQECZ-KRWDZBQOSA-N 2 0 372.940 4.316 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000643462263 1101927474 /nfs/dbraw/zinc/92/74/74/1101927474.db2.gz SEZGQPXOFQXOSE-UYAOXDASSA-N 2 0 353.510 4.061 20 0 FIADRP Clc1cnc2oc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc2c1 ZINC000648495907 1102223953 /nfs/dbraw/zinc/22/39/53/1102223953.db2.gz NDTYQMRAPDBYKV-UHFFFAOYSA-N 2 0 355.869 4.367 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000120581258 1102235105 /nfs/dbraw/zinc/23/51/05/1102235105.db2.gz YYDSBKPIZCKXKO-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP c1ccc(C[N@H+]2CC[C@@]3(CCN(CC4=Cc5ccccc5OC4)C3)C2)cc1 ZINC000519476884 1102235260 /nfs/dbraw/zinc/23/52/60/1102235260.db2.gz FAMVMPNLSSAJLU-XMMPIXPASA-N 2 0 360.501 4.060 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1sccc1Br ZINC000532454277 1102346035 /nfs/dbraw/zinc/34/60/35/1102346035.db2.gz FJWFJDHRSANRBR-GFCCVEGCSA-N 2 0 353.329 4.423 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(CO)c1 ZINC000121238578 1102354212 /nfs/dbraw/zinc/35/42/12/1102354212.db2.gz JWXOKLWDAQWERD-MOPGFXCFSA-N 2 0 352.522 4.262 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000121274769 1102361190 /nfs/dbraw/zinc/36/11/90/1102361190.db2.gz JCHPKVKXGRVKNY-RBUKOAKNSA-N 2 0 363.615 4.111 20 0 FIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2c1 ZINC001167969873 1102415402 /nfs/dbraw/zinc/41/54/02/1102415402.db2.gz HGJADYKWFGHOMT-XVSDAANHSA-N 2 0 351.538 4.417 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000519555592 1102511674 /nfs/dbraw/zinc/51/16/74/1102511674.db2.gz GAXXNNLWEIVMST-HXUWFJFHSA-N 2 0 361.917 4.162 20 0 FIADRP [NH2+]=C(Cc1cccc(C(F)(F)F)c1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167973411 1102544206 /nfs/dbraw/zinc/54/42/06/1102544206.db2.gz JZOMJGNDWHYIAB-AYHJJNSGSA-N 2 0 365.443 4.220 20 0 FIADRP [NH3+][C@@H]1CCc2c3cc(F)ccc3n(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2C1 ZINC001167974337 1102545891 /nfs/dbraw/zinc/54/58/91/1102545891.db2.gz WQOUAUMHGAVTIU-KAKFPZCNSA-N 2 0 367.512 4.174 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000122271923 1102555277 /nfs/dbraw/zinc/55/52/77/1102555277.db2.gz KFORIZXMPLCQHJ-SFHVURJKSA-N 2 0 360.498 4.093 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000122282466 1102556802 /nfs/dbraw/zinc/55/68/02/1102556802.db2.gz QUROYXBFFVWAGB-IBGZPJMESA-N 2 0 374.912 4.284 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(OC(F)F)c1 ZINC000122327699 1102557694 /nfs/dbraw/zinc/55/76/94/1102557694.db2.gz JQMWHNPMUSHEBA-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP CC1(C)C[N@H+](CCc2cscn2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664835664 1102648269 /nfs/dbraw/zinc/64/82/69/1102648269.db2.gz FQLBUWPFTWCMLX-OAQYLSRUSA-N 2 0 369.578 4.308 20 0 FIADRP CC1(C)C[N@H+](CCc2cscn2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664835661 1102648669 /nfs/dbraw/zinc/64/86/69/1102648669.db2.gz FQLBUWPFTWCMLX-NRFANRHFSA-N 2 0 369.578 4.308 20 0 FIADRP C[C@@H]1C[C@H]([N@@H+]2CC(C)(C)[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000664835002 1102655425 /nfs/dbraw/zinc/65/54/25/1102655425.db2.gz BSRMMHKOZBMHCS-QIJUGHKUSA-N 2 0 356.554 4.177 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](CCc2ccc3ccccc3c2)CC1 ZINC001168252697 1102661897 /nfs/dbraw/zinc/66/18/97/1102661897.db2.gz QSCHCAKQHRZNSQ-UHFFFAOYSA-N 2 0 368.565 4.453 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21)C1CC[NH+](C)CC1 ZINC000537649684 1102684215 /nfs/dbraw/zinc/68/42/15/1102684215.db2.gz VOCWBGUMCAFOHV-FCHUYYIVSA-N 2 0 373.610 4.077 20 0 FIADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001167975878 1102685677 /nfs/dbraw/zinc/68/56/77/1102685677.db2.gz YSFLJWKJLVALRF-CWAQXLGLSA-N 3 0 373.629 4.274 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cn(C)nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000537652434 1102729197 /nfs/dbraw/zinc/72/91/97/1102729197.db2.gz UXRWEUPQOAIUMZ-ICSRJNTNSA-N 2 0 368.569 4.108 20 0 FIADRP C[C@@H](c1csnn1)N1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664839068 1102742262 /nfs/dbraw/zinc/74/22/62/1102742262.db2.gz XFJSPMSDOXIIFL-JXFKEZNVSA-N 2 0 370.566 4.222 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@H]2CC23CC[NH2+]CC3)c(-c2ccccc2Cl)n1 ZINC000666953867 1102747549 /nfs/dbraw/zinc/74/75/49/1102747549.db2.gz JRMBMAUFVYUMIR-SFHVURJKSA-N 2 0 372.944 4.190 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2OCc2ccccn2)CC1 ZINC000506858839 1102861018 /nfs/dbraw/zinc/86/10/18/1102861018.db2.gz CLPXZMQORCHQPT-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550271809 1102904191 /nfs/dbraw/zinc/90/41/91/1102904191.db2.gz XIMBYRNLJCAVDM-FCHUYYIVSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1)c1ccc(Cl)nc1 ZINC000179132421 1102949134 /nfs/dbraw/zinc/94/91/34/1102949134.db2.gz KSYRVPYVYSLONI-OAHLLOKOSA-N 2 0 358.917 4.121 20 0 FIADRP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)o1 ZINC000551221254 1102989915 /nfs/dbraw/zinc/98/99/15/1102989915.db2.gz MGVDBCXKGFWDEU-IIBYNOLFSA-N 2 0 354.494 4.166 20 0 FIADRP Cc1ccc2nc(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cn2c1 ZINC000551246036 1103001158 /nfs/dbraw/zinc/00/11/58/1103001158.db2.gz PUUSGNMGPZUZDC-FPOVZHCZSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@@H](C(=O)N(C)c1ccccc1)[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000476985652 1103004466 /nfs/dbraw/zinc/00/44/66/1103004466.db2.gz OJTFPMZTAADFNR-UXHICEINSA-N 2 0 371.569 4.014 20 0 FIADRP Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000729682792 1103050805 /nfs/dbraw/zinc/05/08/05/1103050805.db2.gz MCSVSHNXHTWHLX-UHFFFAOYSA-N 2 0 374.960 4.272 20 0 FIADRP CC1CC[NH+](Cc2cccc(CNCc3cnc(C(C)(C)C)nc3)c2)CC1 ZINC000551547504 1103344058 /nfs/dbraw/zinc/34/40/58/1103344058.db2.gz PJEWQUBGKKXCJA-UHFFFAOYSA-N 2 0 366.553 4.296 20 0 FIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551563904 1103365398 /nfs/dbraw/zinc/36/53/98/1103365398.db2.gz LWRDJBGPESEEEY-GOSISDBHSA-N 2 0 368.521 4.327 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000551575757 1103386654 /nfs/dbraw/zinc/38/66/54/1103386654.db2.gz NLLJTKCTAMXHBW-GOSISDBHSA-N 2 0 371.956 4.123 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(F)cc3Cl)cc2)CC1 ZINC000551617204 1103441382 /nfs/dbraw/zinc/44/13/82/1103441382.db2.gz NRBJKFDTAGPJTI-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+]CCc4ccc5ccccc5n4)[C@@H]3C2)cc1 ZINC000507519018 1103463961 /nfs/dbraw/zinc/46/39/61/1103463961.db2.gz GQZBXBDWPMVYMT-QQKQFIJSSA-N 2 0 371.528 4.278 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccncc1 ZINC000507633833 1103569487 /nfs/dbraw/zinc/56/94/87/1103569487.db2.gz FJVGYSAKCLZBFE-HXUWFJFHSA-N 2 0 351.538 4.467 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)CCS2 ZINC000427542100 1103637637 /nfs/dbraw/zinc/63/76/37/1103637637.db2.gz VBSVYMCDFFWFOV-CMKODMSKSA-N 2 0 362.583 4.319 20 0 FIADRP CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551813499 1103696070 /nfs/dbraw/zinc/69/60/70/1103696070.db2.gz UUZIZPRDZIKQJF-GOSISDBHSA-N 2 0 368.521 4.409 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)CC1 ZINC000187992365 1103733288 /nfs/dbraw/zinc/73/32/88/1103733288.db2.gz NDFVAMFXTDPWPW-UHFFFAOYSA-N 2 0 358.423 4.339 20 0 FIADRP Oc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000312010637 1103831032 /nfs/dbraw/zinc/83/10/32/1103831032.db2.gz RSYITHVEBYTHCC-CVDCTZTESA-N 2 0 350.506 4.271 20 0 FIADRP C[NH2+]C[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2C)C1 ZINC000519777708 1103864251 /nfs/dbraw/zinc/86/42/51/1103864251.db2.gz WSCKNQAVNCCTJZ-FQEVSTJZSA-N 2 0 374.532 4.197 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(-c3ccccc3)nc3ccccn32)[C@H](C)C1 ZINC000440688627 1103889380 /nfs/dbraw/zinc/88/93/80/1103889380.db2.gz GSRRJAVXKIBUAJ-UYAOXDASSA-N 2 0 362.521 4.163 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538262004 1104067309 /nfs/dbraw/zinc/06/73/09/1104067309.db2.gz DONXBMFKEWCTQI-DYESRHJHSA-N 2 0 368.496 4.335 20 0 FIADRP C[C@@H](Cc1ccccc1F)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538262007 1104067569 /nfs/dbraw/zinc/06/75/69/1104067569.db2.gz DONXBMFKEWCTQI-UWJYYQICSA-N 2 0 368.496 4.335 20 0 FIADRP Cc1cc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1F ZINC000538267448 1104089430 /nfs/dbraw/zinc/08/94/30/1104089430.db2.gz JAGFPYUPZWNQLH-HXUWFJFHSA-N 2 0 354.469 4.212 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000520205056 1104171205 /nfs/dbraw/zinc/17/12/05/1104171205.db2.gz QYSKMRGMVFLBLH-OAHLLOKOSA-N 2 0 369.347 4.202 20 0 FIADRP C[C@@H](C[NH2+]Cc1cccc(OCc2ccccc2F)c1)C[NH+]1CCCC1 ZINC000520211546 1104178557 /nfs/dbraw/zinc/17/85/57/1104178557.db2.gz XXOCKNJOHBPZOH-SFHVURJKSA-N 2 0 356.485 4.226 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000246885626 1104211239 /nfs/dbraw/zinc/21/12/39/1104211239.db2.gz FCVWDAWMIHZSOM-FUDKSRODSA-N 2 0 368.496 4.335 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cc1 ZINC000112524925 1104374655 /nfs/dbraw/zinc/37/46/55/1104374655.db2.gz XAEMHGDTPWASBH-KURKYZTESA-N 2 0 356.485 4.286 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cccc4ccccc43)cn2)CC1 ZINC000112529183 1104374981 /nfs/dbraw/zinc/37/49/81/1104374981.db2.gz YPPUMDWXARKFRG-IBGZPJMESA-N 2 0 374.532 4.228 20 0 FIADRP C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)[NH2+]CCC1CC[NH+](C)CC1 ZINC000623888103 1104587005 /nfs/dbraw/zinc/58/70/05/1104587005.db2.gz XNLMAKLAPQACHV-GFCCVEGCSA-N 2 0 363.855 4.006 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(Cl)c4ccccc34)C2)CC1 ZINC000520561121 1104997997 /nfs/dbraw/zinc/99/79/97/1104997997.db2.gz WYWGOTOZWMRXCG-LJQANCHMSA-N 2 0 371.956 4.094 20 0 FIADRP c1cc(Oc2ccccc2)oc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000507781743 1105007993 /nfs/dbraw/zinc/00/79/93/1105007993.db2.gz ZLPUEWPIVMPFAU-UHFFFAOYSA-N 2 0 370.493 4.006 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000391584449 1105013843 /nfs/dbraw/zinc/01/38/43/1105013843.db2.gz PYWCCRBRQZZXPX-RTBURBONSA-N 2 0 372.384 4.306 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCC(C)(C)[NH+]2CCC[C@@H](C)C2)cc1)C(C)C ZINC000228715068 1105035258 /nfs/dbraw/zinc/03/52/58/1105035258.db2.gz HZIIFEYBSCCXNO-LJQANCHMSA-N 2 0 373.585 4.157 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152394307 1105075635 /nfs/dbraw/zinc/07/56/35/1105075635.db2.gz QEVKVYHOLCHCOX-MAUKXSAKSA-N 2 0 353.535 4.261 20 0 FIADRP COc1ccccc1CC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008496 1105195533 /nfs/dbraw/zinc/19/55/33/1105195533.db2.gz XHGSAFGJQXQTJI-HATOLVCRSA-N 2 0 352.522 4.269 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H](CCO)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168009140 1105208400 /nfs/dbraw/zinc/20/84/00/1105208400.db2.gz HAKOLKNKABZTPB-IYRWYFENSA-N 2 0 352.522 4.141 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CCn4ccnc4C2)CCC3)cc1 ZINC000427899690 1105307630 /nfs/dbraw/zinc/30/76/30/1105307630.db2.gz XBRWIWSXOFZRPB-DLBZAZTESA-N 2 0 364.518 4.297 20 0 FIADRP FC(F)(F)C1CCN(C2CC([NH2+]C[C@H]3C[C@@H]3c3ccccc3)C2)CC1 ZINC000475351729 1106742071 /nfs/dbraw/zinc/74/20/71/1106742071.db2.gz AVTIMELVHMTOBU-JYPHPWERSA-N 2 0 352.444 4.185 20 0 FIADRP CC1(C)C[C@@H]([NH2+]CCCCn2ccnc2)c2cc(Br)ccc21 ZINC000530321685 1106964615 /nfs/dbraw/zinc/96/46/15/1106964615.db2.gz IERARYQHJJJEBW-QGZVFWFLSA-N 2 0 362.315 4.438 20 0 FIADRP CCCCOC(=O)[C@@H]1CC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168067982 1107522279 /nfs/dbraw/zinc/52/22/79/1107522279.db2.gz VZBLKZLPMWBVPP-NPDDRXJXSA-N 2 0 372.553 4.093 20 0 FIADRP C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475558028 1107731541 /nfs/dbraw/zinc/73/15/41/1107731541.db2.gz GQJUZKSCBNAAAC-FAEJEUNOSA-N 2 0 352.469 4.216 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1ccc2ccccc2n1)C1CC[NH+](C)CC1 ZINC000531597312 1108013435 /nfs/dbraw/zinc/01/34/35/1108013435.db2.gz AULYUYHBALVFLF-UHFFFAOYSA-N 2 0 374.532 4.055 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc2c(c1)CCC2 ZINC000531705203 1108083525 /nfs/dbraw/zinc/08/35/25/1108083525.db2.gz IBFJMTJNFUQVNZ-SFHVURJKSA-N 2 0 352.522 4.357 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3Cl)cc1 ZINC000531705608 1108083942 /nfs/dbraw/zinc/08/39/42/1108083942.db2.gz XCVGXNQFIXVWPM-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531709935 1108089872 /nfs/dbraw/zinc/08/98/72/1108089872.db2.gz BTBGVUHCNPJBJX-DNQXCXABSA-N 2 0 365.565 4.278 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3c2cccc3Cl)CC1 ZINC000531737520 1108107749 /nfs/dbraw/zinc/10/77/49/1108107749.db2.gz APMLVGSMVWJJAP-JOCHJYFZSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ncc(-c2ccccc2)n1C ZINC000453054945 1108130795 /nfs/dbraw/zinc/13/07/95/1108130795.db2.gz CYFVFIVZJYFFJE-RBUKOAKNSA-N 2 0 354.542 4.250 20 0 FIADRP COC1([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCOCC1 ZINC000453077262 1108149825 /nfs/dbraw/zinc/14/98/25/1108149825.db2.gz XXGBDIOSICNDLT-IBGZPJMESA-N 2 0 374.569 4.125 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2sccc21 ZINC000453102617 1108170987 /nfs/dbraw/zinc/17/09/87/1108170987.db2.gz QDUANONEQDTSSJ-IERDGZPVSA-N 2 0 370.562 4.433 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(Cl)cc2)CC1 ZINC000531785482 1108178009 /nfs/dbraw/zinc/17/80/09/1108178009.db2.gz OTTXCNHXBNMGPL-UHFFFAOYSA-N 2 0 357.929 4.162 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453194816 1108264685 /nfs/dbraw/zinc/26/46/85/1108264685.db2.gz IGLUSVHWENVHJE-VIZSFHNOSA-N 2 0 351.538 4.293 20 0 FIADRP FC(F)(F)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000453229985 1108303513 /nfs/dbraw/zinc/30/35/13/1108303513.db2.gz PLUJAIGXIQFFIN-DUBPFDJUSA-N 2 0 352.444 4.360 20 0 FIADRP CO[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000453289286 1108365360 /nfs/dbraw/zinc/36/53/60/1108365360.db2.gz LXRNINSGGLVCAE-JLLPCOHGSA-N 2 0 364.533 4.029 20 0 FIADRP CO[C@](C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000453319421 1108408300 /nfs/dbraw/zinc/40/83/00/1108408300.db2.gz KUDADVQDLHAFNJ-UEQSERJNSA-N 2 0 364.533 4.333 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H](CC3CC3)c3ccccc3)cc2)CC1 ZINC000531959326 1108450823 /nfs/dbraw/zinc/45/08/23/1108450823.db2.gz RCXNHWRAPRXOHS-DEOSSOPVSA-N 2 0 364.533 4.274 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453353297 1108454861 /nfs/dbraw/zinc/45/48/61/1108454861.db2.gz NQMPXXNSRVRYOF-VYTWWXLVSA-N 2 0 350.506 4.194 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1)C1CC1 ZINC000453386339 1108470862 /nfs/dbraw/zinc/47/08/62/1108470862.db2.gz AOWPLSMJDIAHEV-NRFANRHFSA-N 2 0 357.929 4.483 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000531979278 1108495784 /nfs/dbraw/zinc/49/57/84/1108495784.db2.gz MLFUCBSPSFUIKM-UEKVPHQBSA-N 2 0 365.732 4.344 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453445857 1108540941 /nfs/dbraw/zinc/54/09/41/1108540941.db2.gz ZVPOXAYAMHNDOD-CWJKEVGVSA-N 2 0 370.562 4.468 20 0 FIADRP c1nc(C[N@H+]2CCCCC[C@H]2C2CC[NH+](Cc3ccccc3)CC2)c[nH]1 ZINC000453594268 1108632233 /nfs/dbraw/zinc/63/22/33/1108632233.db2.gz FEPHIOVWTNVGAJ-QFIPXVFZSA-N 2 0 352.526 4.067 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CC1=Cc2ccccc2OC1 ZINC000532119771 1108679047 /nfs/dbraw/zinc/67/90/47/1108679047.db2.gz GMDFKBJPVSYSNJ-OALUTQOASA-N 2 0 362.517 4.209 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000532193183 1108701466 /nfs/dbraw/zinc/70/14/66/1108701466.db2.gz POZQRNXCZVCVGI-RBUKOAKNSA-N 3 0 354.542 4.343 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428451632 1109313205 /nfs/dbraw/zinc/31/32/05/1109313205.db2.gz DBPXCDOFHYGIPL-GMKZXUHWSA-N 2 0 369.597 4.140 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1cccc(F)c1 ZINC000446743353 1109326411 /nfs/dbraw/zinc/32/64/11/1109326411.db2.gz FFGMDYGHYNITDU-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP Fc1cccc(Cl)c1CCC[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000446808902 1109348181 /nfs/dbraw/zinc/34/81/81/1109348181.db2.gz NYEVWVFNAQRQAY-UHFFFAOYSA-N 2 0 361.892 4.313 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446882292 1109370979 /nfs/dbraw/zinc/37/09/79/1109370979.db2.gz BWTJWRXUYOTWPC-UHFFFAOYSA-N 2 0 372.944 4.107 20 0 FIADRP COc1ccccc1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446885787 1109382669 /nfs/dbraw/zinc/38/26/69/1109382669.db2.gz WQZPJZBEIBXSQI-UHFFFAOYSA-N 2 0 350.506 4.326 20 0 FIADRP Clc1ccc(Br)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000446914549 1109388630 /nfs/dbraw/zinc/38/86/30/1109388630.db2.gz NGHIWNZXKAXNJT-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)C2CCCC2)cc1 ZINC000446935833 1109394820 /nfs/dbraw/zinc/39/48/20/1109394820.db2.gz IDIFMYFMXKPRML-RJGXRXQPSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1CCOc2ccc(F)cc21 ZINC000525858454 1109540831 /nfs/dbraw/zinc/54/08/31/1109540831.db2.gz PMIUEFAWHVRUAM-CZAAIQMYSA-N 2 0 354.469 4.150 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1CCOc2ccc(F)cc21 ZINC000525858457 1109540925 /nfs/dbraw/zinc/54/09/25/1109540925.db2.gz PMIUEFAWHVRUAM-TYCQWZJGSA-N 2 0 354.469 4.150 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OC ZINC000447550145 1109567748 /nfs/dbraw/zinc/56/77/48/1109567748.db2.gz HAOLASZPTUSWHK-QGZVFWFLSA-N 2 0 360.542 4.399 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1F ZINC000447565606 1109584119 /nfs/dbraw/zinc/58/41/19/1109584119.db2.gz MIIWESJVOBWSBE-FPOVZHCZSA-N 2 0 360.517 4.325 20 0 FIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1F ZINC000447565608 1109584143 /nfs/dbraw/zinc/58/41/43/1109584143.db2.gz MIIWESJVOBWSBE-TZIWHRDSSA-N 2 0 360.517 4.325 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000447566422 1109584934 /nfs/dbraw/zinc/58/49/34/1109584934.db2.gz SVTVPGKCBMMODT-QFIPXVFZSA-N 2 0 369.940 4.483 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+]Cc3ccc(C(F)F)cc3)c2)CCO1 ZINC000526038174 1109597302 /nfs/dbraw/zinc/59/73/02/1109597302.db2.gz VGOIISFOSXVFAF-MRXNPFEDSA-N 2 0 360.448 4.135 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2c2ccccc2)CCO1 ZINC001168092323 1109642205 /nfs/dbraw/zinc/64/22/05/1109642205.db2.gz GZGKFFZYAZKXGG-OTUUDDROSA-N 2 0 364.533 4.202 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCC[C@@H](c4ccnn4C)C3)CC2)CC1 ZINC000448027300 1109697682 /nfs/dbraw/zinc/69/76/82/1109697682.db2.gz MKLNHNHDDYDNSN-OSIBBQKWSA-N 2 0 358.574 4.079 20 0 FIADRP FC(F)c1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000527520980 1109773312 /nfs/dbraw/zinc/77/33/12/1109773312.db2.gz WCQQYZXRGZVMRD-UHFFFAOYSA-N 2 0 373.491 4.316 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC[C@@H]2CCC[NH+](CC(C)C)C2)cc1 ZINC000448428389 1109789338 /nfs/dbraw/zinc/78/93/38/1109789338.db2.gz ZXMAOHDJLUQVSX-NRFANRHFSA-N 2 0 373.585 4.016 20 0 FIADRP CCOc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c(F)cc1OC ZINC000527646822 1109794650 /nfs/dbraw/zinc/79/46/50/1109794650.db2.gz OXVUDMJQSPAOQQ-UHFFFAOYSA-N 2 0 374.500 4.363 20 0 FIADRP c1ccc([C@@H]2CCC[C@@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)CC2)cc1 ZINC000527662120 1109797030 /nfs/dbraw/zinc/79/70/30/1109797030.db2.gz MVXXFNZMVJASSO-CEMLEFRQSA-N 2 0 356.554 4.193 20 0 FIADRP FC(F)(F)c1sccc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000527687101 1109811414 /nfs/dbraw/zinc/81/14/14/1109811414.db2.gz ZJRIZBFSGHXHCO-UHFFFAOYSA-N 2 0 355.429 4.168 20 0 FIADRP CC[C@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000527862382 1109842587 /nfs/dbraw/zinc/84/25/87/1109842587.db2.gz AYAOKWYYJMMKMX-HSZRJFAPSA-N 2 0 366.549 4.144 20 0 FIADRP CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000527849874 1109847301 /nfs/dbraw/zinc/84/73/01/1109847301.db2.gz MCHSDCNUPFETFS-MOPGFXCFSA-N 2 0 366.553 4.198 20 0 FIADRP CC(C)c1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000527883620 1109849208 /nfs/dbraw/zinc/84/92/08/1109849208.db2.gz DLUFUVQCYJGIPZ-FDDCHVKYSA-N 2 0 352.522 4.227 20 0 FIADRP Cc1cccc([C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)C(C)C)c1 ZINC000527898210 1109854012 /nfs/dbraw/zinc/85/40/12/1109854012.db2.gz HXVIAQMSSGMHAZ-QFIPXVFZSA-N 2 0 355.526 4.207 20 0 FIADRP Fc1cccc(F)c1-c1ncc(CN2CC[C@H](C[NH+]3CCCC3)C2)s1 ZINC000449028611 1109959364 /nfs/dbraw/zinc/95/93/64/1109959364.db2.gz LYCVGKLPUXBSLO-CQSZACIVSA-N 2 0 363.477 4.006 20 0 FIADRP Fc1cccc(F)c1-c1ncc(CN2CC[C@@H](C[NH+]3CCCC3)C2)s1 ZINC000449028610 1109959595 /nfs/dbraw/zinc/95/95/95/1109959595.db2.gz LYCVGKLPUXBSLO-AWEZNQCLSA-N 2 0 363.477 4.006 20 0 FIADRP CC(=O)Nc1ccc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1 ZINC000449123448 1109980926 /nfs/dbraw/zinc/98/09/26/1109980926.db2.gz CQEHNWYBNANSML-UHFFFAOYSA-N 2 0 373.585 4.456 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2csc(C)c2)CC1 ZINC000449131259 1109981650 /nfs/dbraw/zinc/98/16/50/1109981650.db2.gz LFTNHOASUSFHSH-INIZCTEOSA-N 2 0 361.530 4.188 20 0 FIADRP C[C@@H](CCc1cccn1C)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449149290 1109986004 /nfs/dbraw/zinc/98/60/04/1109986004.db2.gz NDFLDJMEGRPWJF-PMACEKPBSA-N 2 0 353.554 4.031 20 0 FIADRP CCC[N@H+](Cc1ncccc1Cl)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000528416953 1109986473 /nfs/dbraw/zinc/98/64/73/1109986473.db2.gz MWPGJKPLGJCDHX-UHFFFAOYSA-N 2 0 373.932 4.023 20 0 FIADRP CO[C@@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000449168259 1109990767 /nfs/dbraw/zinc/99/07/67/1109990767.db2.gz ARGDFKAZQUPJSQ-MBSDFSHPSA-N 2 0 370.512 4.198 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000449188272 1109990819 /nfs/dbraw/zinc/99/08/19/1109990819.db2.gz KAWBGHNNMACIHR-KNQAVFIVSA-N 2 0 356.554 4.163 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000449188271 1109990935 /nfs/dbraw/zinc/99/09/35/1109990935.db2.gz KAWBGHNNMACIHR-DENIHFKCSA-N 2 0 356.554 4.163 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449180215 1109993029 /nfs/dbraw/zinc/99/30/29/1109993029.db2.gz YWYCNBRAVGCLHS-CEYNDMKZSA-N 2 0 370.647 4.335 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000449184200 1109993986 /nfs/dbraw/zinc/99/39/86/1109993986.db2.gz DLBDBQIDDYIDGK-DNQXCXABSA-N 2 0 364.533 4.129 20 0 FIADRP COCC[C@H](NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccco1 ZINC000449229888 1110003046 /nfs/dbraw/zinc/00/30/46/1110003046.db2.gz FTXWZGUJXFTFOP-RXVVDRJESA-N 2 0 356.510 4.042 20 0 FIADRP CC(C)C[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449250062 1110005160 /nfs/dbraw/zinc/00/51/60/1110005160.db2.gz KVMWLUBCKQDSOM-AJSBUHFISA-N 2 0 358.570 4.265 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000449308489 1110022881 /nfs/dbraw/zinc/02/28/81/1110022881.db2.gz XPPOQNGNFRAMKM-NSISKUIASA-N 2 0 366.496 4.222 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2ccc3n[nH]cc3c2)CC1 ZINC000449316962 1110030945 /nfs/dbraw/zinc/03/09/45/1110030945.db2.gz APKUFBXLNGLNQG-MSOLQXFVSA-N 2 0 362.521 4.309 20 0 FIADRP C[C@H](CC(C)(C)C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000449343039 1110034506 /nfs/dbraw/zinc/03/45/06/1110034506.db2.gz HFXDGLUAUMKDHU-CTNGQTDRSA-N 2 0 358.570 4.330 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCCC2(F)F)CC1 ZINC000449373743 1110045492 /nfs/dbraw/zinc/04/54/92/1110045492.db2.gz CMWDPBONJXGDRH-PKOBYXMFSA-N 2 0 350.497 4.497 20 0 FIADRP CO[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000449393072 1110050395 /nfs/dbraw/zinc/05/03/95/1110050395.db2.gz LXRNINSGGLVCAE-NHYNNZIHSA-N 2 0 364.533 4.029 20 0 FIADRP CO[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000449393073 1110050576 /nfs/dbraw/zinc/05/05/76/1110050576.db2.gz LXRNINSGGLVCAE-UCBGAZFYSA-N 2 0 364.533 4.029 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCOC3(CCC3)C2)CC1 ZINC000449480506 1110085255 /nfs/dbraw/zinc/08/52/55/1110085255.db2.gz OQKFAQPRNGOVOK-PZJWPPBQSA-N 2 0 356.554 4.021 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CC/C=C/c3ccccc3)CC2)CC1 ZINC000450477339 1110302598 /nfs/dbraw/zinc/30/25/98/1110302598.db2.gz WAZGPCAJJKOHDH-UXBLZVDNSA-N 2 0 369.597 4.218 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(F)cc1 ZINC000538409331 1111129227 /nfs/dbraw/zinc/12/92/27/1111129227.db2.gz MDZCAVYPKGUXFS-PCCBWWKXSA-N 2 0 362.533 4.270 20 0 FIADRP CCOc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)ccc1OCc1ccccc1 ZINC000538447011 1111144849 /nfs/dbraw/zinc/14/48/49/1111144849.db2.gz STOBKONECSWCJN-UHFFFAOYSA-N 2 0 366.505 4.016 20 0 FIADRP C[N@@H+](Cc1ccc(OCC(F)F)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538730472 1111267364 /nfs/dbraw/zinc/26/73/64/1111267364.db2.gz NTZHGXOZZIMNMR-FQEVSTJZSA-N 2 0 374.475 4.284 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc3cc(OC)ccc3o2)CC1 ZINC000538753201 1111283021 /nfs/dbraw/zinc/28/30/21/1111283021.db2.gz VTUSMAJRVHQTLS-UHFFFAOYSA-N 2 0 374.525 4.012 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000539064232 1111406032 /nfs/dbraw/zinc/40/60/32/1111406032.db2.gz DRAVPKNTBDOGNV-NJDAHSKKSA-N 2 0 362.945 4.075 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)Oc1ccccc1C(F)(F)F ZINC000539124226 1111443403 /nfs/dbraw/zinc/44/34/03/1111443403.db2.gz LWINTTAVNHKGAJ-LJIGWXMPSA-N 2 0 358.448 4.181 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159286 1111455200 /nfs/dbraw/zinc/45/52/00/1111455200.db2.gz NQRIOTYOEHKUDX-UZLBHIALSA-N 2 0 359.514 4.332 20 0 FIADRP Cc1cc([C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C2CC2)ccc1F ZINC000539159012 1111461993 /nfs/dbraw/zinc/46/19/93/1111461993.db2.gz CYHMIBBLOJMFSX-JOCHJYFZSA-N 2 0 356.485 4.315 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000539202041 1111469579 /nfs/dbraw/zinc/46/95/79/1111469579.db2.gz JNJRQDKMMPVQBV-QFIPXVFZSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000643522338 1111543687 /nfs/dbraw/zinc/54/36/87/1111543687.db2.gz LUVPLDYMKTYSNW-JQWIXIFHSA-N 2 0 365.237 4.261 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccc(F)cc2)CC1 ZINC000643521889 1111547833 /nfs/dbraw/zinc/54/78/33/1111547833.db2.gz DXNOUGQYAWGACI-VXKWHMMOSA-N 3 0 361.549 4.111 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)CC1 ZINC000552048409 1111557766 /nfs/dbraw/zinc/55/77/66/1111557766.db2.gz RITVLYBRTKEXFN-ZHMMRPBMSA-N 2 0 356.554 4.223 20 0 FIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000478036670 1111649750 /nfs/dbraw/zinc/64/97/50/1111649750.db2.gz UNHAQZJZJSMMPG-INIZCTEOSA-N 2 0 358.448 4.138 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](CC4=Cc5ccccc5OC4)C3)CC2)cc1 ZINC000552273057 1111653631 /nfs/dbraw/zinc/65/36/31/1111653631.db2.gz PVUCFXRMHIHVHN-UHFFFAOYSA-N 2 0 374.528 4.451 20 0 FIADRP Cc1nn(C(C)C)cc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552273196 1111653717 /nfs/dbraw/zinc/65/37/17/1111653717.db2.gz XAGQEBZOVJOJJB-UHFFFAOYSA-N 2 0 366.553 4.261 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000552325639 1111670153 /nfs/dbraw/zinc/67/01/53/1111670153.db2.gz XVSMJLLTFXMPCQ-JSFADZTLSA-N 2 0 352.950 4.169 20 0 FIADRP c1ccc(-c2ccc(OCC[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC001168361046 1111860733 /nfs/dbraw/zinc/86/07/33/1111860733.db2.gz ZUXMNRVZGIMDEB-UHFFFAOYSA-N 2 0 350.506 4.196 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479332413 1111994376 /nfs/dbraw/zinc/99/43/76/1111994376.db2.gz SZJXLXUQIMQNIN-KNQAVFIVSA-N 2 0 366.553 4.351 20 0 FIADRP Brc1ccc2c(c1)CCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000479436743 1112022120 /nfs/dbraw/zinc/02/21/20/1112022120.db2.gz JEBDTZKLCPQWBQ-IBGZPJMESA-N 2 0 363.343 4.291 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479451137 1112027785 /nfs/dbraw/zinc/02/77/85/1112027785.db2.gz HJPXSBJIOHUQDU-QGZVFWFLSA-N 2 0 369.322 4.361 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000479465599 1112034631 /nfs/dbraw/zinc/03/46/31/1112034631.db2.gz KYAJUDQNPHRNPM-AOMKIAJQSA-N 2 0 356.485 4.494 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000479466314 1112041515 /nfs/dbraw/zinc/04/15/15/1112041515.db2.gz RLQLWBDPXIQRPN-PXNSSMCTSA-N 2 0 356.510 4.474 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(F)cc3)C2)[C@@H](C)C1 ZINC000479492964 1112045822 /nfs/dbraw/zinc/04/58/22/1112045822.db2.gz XVPMDDDAEUZGEF-GWWHBBDRSA-N 2 0 362.533 4.188 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(F)c3)C2)[C@@H](C)C1 ZINC000479526121 1112053070 /nfs/dbraw/zinc/05/30/70/1112053070.db2.gz LAAQEFCAVKYUJD-BZNRXQDOSA-N 2 0 362.533 4.188 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@@H](NC1CC([NH+]3CCCCC3)C1)CCC2 ZINC000479528646 1112053510 /nfs/dbraw/zinc/05/35/10/1112053510.db2.gz QCAWJALHVCMEAU-JMLCCBQJSA-N 2 0 353.432 4.084 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@H](C)C1 ZINC000479535721 1112060290 /nfs/dbraw/zinc/06/02/90/1112060290.db2.gz IUBNQSUBOMGGHZ-DWIQEWEKSA-N 2 0 364.961 4.313 20 0 FIADRP Clc1ccc(COC2CC[NH+](CCC3CC[NH2+]CC3)CC2)cc1Cl ZINC000479670847 1112102703 /nfs/dbraw/zinc/10/27/03/1112102703.db2.gz CTFFBZPJMIICDJ-UHFFFAOYSA-N 2 0 371.352 4.364 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000479681621 1112112135 /nfs/dbraw/zinc/11/21/35/1112112135.db2.gz BOGMBBIAZYDAGZ-LJQANCHMSA-N 2 0 354.542 4.186 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000479765603 1112135152 /nfs/dbraw/zinc/13/51/52/1112135152.db2.gz DIDHZRUVWPDPEY-BEFAXECRSA-N 2 0 373.368 4.263 20 0 FIADRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1ccc(OCc2ccncc2)cc1 ZINC000479765532 1112135161 /nfs/dbraw/zinc/13/51/61/1112135161.db2.gz ONGWQSJIVLPTNX-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000479889569 1112186739 /nfs/dbraw/zinc/18/67/39/1112186739.db2.gz VRHCHULXRYRVIA-UZUQRXQVSA-N 2 0 368.496 4.071 20 0 FIADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000554087125 1112198897 /nfs/dbraw/zinc/19/88/97/1112198897.db2.gz UJDROACQUPLQJW-YPAWHYETSA-N 2 0 358.570 4.330 20 0 FIADRP C[N@@H+](Cc1cc2ccncc2s1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000667621092 1112285371 /nfs/dbraw/zinc/28/53/71/1112285371.db2.gz ZYCRECMJEDEBFY-GOSISDBHSA-N 2 0 351.519 4.250 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1OC ZINC000480143778 1112300426 /nfs/dbraw/zinc/30/04/26/1112300426.db2.gz GUAMJHMSURZKQH-SFHVURJKSA-N 2 0 356.510 4.185 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCC[NH+](C)Cc1ccccc1 ZINC000480148053 1112302190 /nfs/dbraw/zinc/30/21/90/1112302190.db2.gz PQIWXWQFOQNZJG-XUZZJYLKSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCC[NH+](C)Cc1ccccc1 ZINC000480148055 1112302565 /nfs/dbraw/zinc/30/25/65/1112302565.db2.gz PQIWXWQFOQNZJG-ZJSXRUAMSA-N 2 0 365.565 4.009 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)c1)C1CCOCC1 ZINC000554362672 1112318062 /nfs/dbraw/zinc/31/80/62/1112318062.db2.gz XNAUFRVSKAQYJI-FGZHOGPDSA-N 2 0 374.569 4.091 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)c1)C1CCOCC1 ZINC000554362674 1112318315 /nfs/dbraw/zinc/31/83/15/1112318315.db2.gz XNAUFRVSKAQYJI-YADHBBJMSA-N 2 0 374.569 4.091 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cc1 ZINC000480227533 1112339374 /nfs/dbraw/zinc/33/93/74/1112339374.db2.gz PYPXMVDSOQKZJN-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000554552842 1112397534 /nfs/dbraw/zinc/39/75/34/1112397534.db2.gz NCEDPKGIEUOPTJ-KRWDZBQOSA-N 2 0 358.476 4.417 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480608502 1112499257 /nfs/dbraw/zinc/49/92/57/1112499257.db2.gz LFWQYAJSWPRNDU-OTWHNJEPSA-N 2 0 374.573 4.235 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000480610036 1112500584 /nfs/dbraw/zinc/50/05/84/1112500584.db2.gz NFSXGSVCKLNXTF-VAMGGRTRSA-N 2 0 354.542 4.281 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480614266 1112502555 /nfs/dbraw/zinc/50/25/55/1112502555.db2.gz SEHHHYKAUJSEJH-PMACEKPBSA-N 2 0 367.537 4.156 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000480641622 1112517713 /nfs/dbraw/zinc/51/77/13/1112517713.db2.gz QCGXXZTXPDWKOF-MRXNPFEDSA-N 2 0 352.494 4.006 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1 ZINC000480645945 1112519849 /nfs/dbraw/zinc/51/98/49/1112519849.db2.gz YFCKGCXDUKPTJN-KHUIQGCPSA-N 2 0 371.613 4.245 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCO2 ZINC000480636653 1112523535 /nfs/dbraw/zinc/52/35/35/1112523535.db2.gz CVSUNBKZMJXRTP-ROUUACIJSA-N 2 0 366.505 4.498 20 0 FIADRP C[N@H+](Cc1ccccc1)[C@H](CNC1CC[NH+](C2CCCCC2)CC1)C1CC1 ZINC000480709827 1112564012 /nfs/dbraw/zinc/56/40/12/1112564012.db2.gz OAGZZOLOXKKVSM-XMMPIXPASA-N 2 0 369.597 4.284 20 0 FIADRP Cc1cc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc(F)c1F ZINC001143604644 1112564488 /nfs/dbraw/zinc/56/44/88/1112564488.db2.gz BJJOAWJUQRFAKH-UHFFFAOYSA-N 2 0 371.475 4.156 20 0 FIADRP FC(F)(F)c1cccnc1[C@H](NC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC001168364316 1112591170 /nfs/dbraw/zinc/59/11/70/1112591170.db2.gz BFVONYHHFJZGQB-QGZVFWFLSA-N 2 0 353.432 4.016 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2c(C3CCC3)cnn2C)CC1)CC1CC1 ZINC000667758031 1112630454 /nfs/dbraw/zinc/63/04/54/1112630454.db2.gz SILJRXUVVZBKKN-UHFFFAOYSA-N 2 0 358.574 4.022 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC001649004380 1112662007 /nfs/dbraw/zinc/66/20/07/1112662007.db2.gz FNDSLJKJLJLFPY-GBXCKJPGSA-N 2 0 369.597 4.141 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000481306788 1112880206 /nfs/dbraw/zinc/88/02/06/1112880206.db2.gz NAKMVCGROFNVTB-HXUWFJFHSA-N 2 0 374.532 4.496 20 0 FIADRP Cc1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555618214 1112950031 /nfs/dbraw/zinc/95/00/31/1112950031.db2.gz FBHRDQKHMIOMFA-HSZRJFAPSA-N 2 0 364.533 4.013 20 0 FIADRP CC1(C)CC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c2ccccc21 ZINC000481659987 1113016333 /nfs/dbraw/zinc/01/63/33/1113016333.db2.gz QWBOAQLKUFWIJT-BDTNDASRSA-N 2 0 356.554 4.157 20 0 FIADRP C[N@@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877867 1113040863 /nfs/dbraw/zinc/04/08/63/1113040863.db2.gz KGCNLWXUFBEUKJ-DYVFJYSZSA-N 2 0 365.399 4.054 20 0 FIADRP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(OC(F)(F)F)ccc43)CC[C@@H]21 ZINC000899878677 1113042366 /nfs/dbraw/zinc/04/23/66/1113042366.db2.gz VULSJPLFMPSWHW-GUYCJALGSA-N 2 0 365.399 4.054 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccc(OC)c3)CC2)cc1 ZINC000481746277 1113060836 /nfs/dbraw/zinc/06/08/36/1113060836.db2.gz PVMBACFPJAZGDV-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CC[C@@H](c2ccccc2F)C1 ZINC000481816796 1113087479 /nfs/dbraw/zinc/08/74/79/1113087479.db2.gz QWVFXAQQDGNUES-AEFFLSMTSA-N 2 0 350.441 4.141 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1cccc(OCC[NH+](C)C)c1 ZINC000481993046 1113146400 /nfs/dbraw/zinc/14/64/00/1113146400.db2.gz QWZPCTSOASRNDR-INIZCTEOSA-N 2 0 369.484 4.141 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3F)C2)[C@@H](C)C1 ZINC000482074756 1113172158 /nfs/dbraw/zinc/17/21/58/1113172158.db2.gz KYNHVFUTXQYOBK-JYLXEMOASA-N 2 0 362.533 4.188 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000482326633 1113226223 /nfs/dbraw/zinc/22/62/23/1113226223.db2.gz ZDZURPNMNTWDMG-KSSFIOAISA-N 2 0 356.432 4.283 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1OC ZINC000482433642 1113253073 /nfs/dbraw/zinc/25/30/73/1113253073.db2.gz CWKVAGBFXQDVDK-UNMCSNQZSA-N 2 0 352.522 4.301 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482445254 1113258595 /nfs/dbraw/zinc/25/85/95/1113258595.db2.gz ISDJNYYEPXTVJU-FYYLOGMGSA-N 2 0 364.533 4.363 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000482490114 1113272966 /nfs/dbraw/zinc/27/29/66/1113272966.db2.gz WVUXXEATCIEWMO-LEWJYISDSA-N 2 0 365.565 4.278 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)CC1 ZINC000482501683 1113278717 /nfs/dbraw/zinc/27/87/17/1113278717.db2.gz CAOKDLDLNOVVEN-HNNXBMFYSA-N 2 0 358.448 4.400 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)CC1 ZINC000482503306 1113279463 /nfs/dbraw/zinc/27/94/63/1113279463.db2.gz DHAKLIXABDJLHM-OALUTQOASA-N 2 0 371.594 4.339 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Cl)c(OC)cc2OC)CC1 ZINC000482521179 1113283809 /nfs/dbraw/zinc/28/38/09/1113283809.db2.gz XGVAGESKGIREID-AWEZNQCLSA-N 2 0 354.922 4.130 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482514666 1113284713 /nfs/dbraw/zinc/28/47/13/1113284713.db2.gz ZVLIWTUODPERRR-HNAYVOBHSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cc2ccccc2o1 ZINC000482565228 1113298270 /nfs/dbraw/zinc/29/82/70/1113298270.db2.gz XQKZULKROOXEKT-QGZVFWFLSA-N 2 0 352.478 4.267 20 0 FIADRP CCn1cc([C@H](C)[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)cn1 ZINC000482864467 1113380891 /nfs/dbraw/zinc/38/08/91/1113380891.db2.gz HTEHCSFEYXLGSV-FQEVSTJZSA-N 2 0 368.569 4.289 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1Cl ZINC000482876198 1113386362 /nfs/dbraw/zinc/38/63/62/1113386362.db2.gz UHZMHUDZEICRLT-MAUKXSAKSA-N 2 0 359.341 4.271 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-c2ccccc2)cc1 ZINC000482875430 1113386578 /nfs/dbraw/zinc/38/65/78/1113386578.db2.gz LWLGAGSLTNHIFF-WMZHIEFXSA-N 2 0 352.522 4.241 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3c(s2)CCCC3)[C@H](C)C1 ZINC000483137036 1113446241 /nfs/dbraw/zinc/44/62/41/1113446241.db2.gz SZXDMYGEAAPVQU-AOIWGVFYSA-N 2 0 364.599 4.415 20 0 FIADRP COc1ccccc1/C=C/C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486461860 1113572856 /nfs/dbraw/zinc/57/28/56/1113572856.db2.gz PQAOILFBWFSTDI-ZUAAASGPSA-N 2 0 350.506 4.209 20 0 FIADRP C[C@H](NCc1csc(-c2ccco2)n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486514875 1113585399 /nfs/dbraw/zinc/58/53/99/1113585399.db2.gz FKAZJYGKBUNHNM-FUHWJXTLSA-N 2 0 367.518 4.403 20 0 FIADRP c1cc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000488089561 1113852897 /nfs/dbraw/zinc/85/28/97/1113852897.db2.gz POVPIMNVMKTXSM-BDTNDASRSA-N 2 0 354.538 4.110 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CC[C@@H]([NH+]4CCCCC4)C3)c2cc1OCC ZINC000488243316 1113887201 /nfs/dbraw/zinc/88/72/01/1113887201.db2.gz WHESPAUXXFXYHB-QGZVFWFLSA-N 2 0 369.509 4.097 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CS[C@@H](C(C)C)C3)CC2)cc1 ZINC000488415350 1113927253 /nfs/dbraw/zinc/92/72/53/1113927253.db2.gz AKJVBBFSWFQFQV-PZJWPPBQSA-N 2 0 362.583 4.027 20 0 FIADRP c1ccc(-c2nc3ccccn3c2C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000488434179 1113929646 /nfs/dbraw/zinc/92/96/46/1113929646.db2.gz KBMXYRILLHGMMA-UHFFFAOYSA-N 2 0 374.532 4.309 20 0 FIADRP COc1ccc([C@@H](NC[C@H]2CCC[N@@H+](C(C)C)C2)c2ccccc2)cc1 ZINC000491043185 1114366929 /nfs/dbraw/zinc/36/69/29/1114366929.db2.gz ZTBFAGWHSWHYLD-XXBNENTESA-N 2 0 352.522 4.495 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)[C@@H](C)C2 ZINC000491062913 1114368775 /nfs/dbraw/zinc/36/87/75/1114368775.db2.gz BRKYQESZRGAQBW-FDDCHVKYSA-N 2 0 352.522 4.349 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H](N[C@@H]2CCCC[C@H]2[NH3+])CCC3)cc1 ZINC000571073951 1114431566 /nfs/dbraw/zinc/43/15/66/1114431566.db2.gz NZWIEJNZVSLQIS-BRWVUGGUSA-N 2 0 357.523 4.056 20 0 FIADRP CSCc1cnc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000590184025 1114905046 /nfs/dbraw/zinc/90/50/46/1114905046.db2.gz XAUARJYYJRQMGI-UHFFFAOYSA-N 2 0 361.580 4.008 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000057973526 1115050859 /nfs/dbraw/zinc/05/08/59/1115050859.db2.gz MESZSTFAMOWLGX-UHFFFAOYSA-N 2 0 370.522 4.041 20 0 FIADRP COC(=O)c1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c(C)o1 ZINC000594600913 1115463277 /nfs/dbraw/zinc/46/32/77/1115463277.db2.gz OBDZTYSDHTUFNN-MRXNPFEDSA-N 2 0 370.493 4.039 20 0 FIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc(CC[NH+](C)C)cc3)c2C1 ZINC000575193294 1115547597 /nfs/dbraw/zinc/54/75/97/1115547597.db2.gz COWKLIBFVZRFNW-UHFFFAOYSA-N 2 0 365.521 4.015 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2ccc(F)cc2C(F)(F)F)CC[NH+](C)CC1 ZINC000599045386 1115780289 /nfs/dbraw/zinc/78/02/89/1115780289.db2.gz ALDXHNQJMMDQIU-GFCCVEGCSA-N 2 0 364.452 4.323 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[NH+](C3CCCC3)CC2)cc1 ZINC000606411768 1115940859 /nfs/dbraw/zinc/94/08/59/1115940859.db2.gz BVMWUYRQNGDFDP-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000606409621 1115943262 /nfs/dbraw/zinc/94/32/62/1115943262.db2.gz OJXPODKUDWALCP-QFIPXVFZSA-N 2 0 371.569 4.009 20 0 FIADRP C[C@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)c1ccc([S@@](C)=O)cc1 ZINC000534452299 1116200397 /nfs/dbraw/zinc/20/03/97/1116200397.db2.gz JKUFZCPOBWGPKI-HFJWLAOPSA-N 2 0 372.578 4.233 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535231264 1116283283 /nfs/dbraw/zinc/28/32/83/1116283283.db2.gz UWSFTATWGFMBNA-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)c2ccc(F)cc2)CC1)CC1CC1 ZINC000539727288 1116372167 /nfs/dbraw/zinc/37/21/67/1116372167.db2.gz TVIPVWVQIVTYOY-UHFFFAOYSA-N 2 0 360.517 4.233 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)[C@H](C)C1 ZINC000539819628 1116384997 /nfs/dbraw/zinc/38/49/97/1116384997.db2.gz NXXBEJFDHWZQLB-WIYYLYMNSA-N 2 0 353.510 4.344 20 0 FIADRP Cc1ccc(-c2cccc(C[NH+]3CCC(OCC[NH+](C)C)CC3)c2)cc1 ZINC000539831577 1116388214 /nfs/dbraw/zinc/38/82/14/1116388214.db2.gz FRYRNVZQSCSQKJ-UHFFFAOYSA-N 2 0 352.522 4.205 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CC[N@H+](Cc4ccoc4)C3)CC1)C2 ZINC001168432551 1117746418 /nfs/dbraw/zinc/74/64/18/1117746418.db2.gz WKCFBMSQUGQYNP-JOCHJYFZSA-N 2 0 368.496 4.264 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)cc1F ZINC000462783903 1117765488 /nfs/dbraw/zinc/76/54/88/1117765488.db2.gz YBVCXWBDEDSZBX-UHFFFAOYSA-N 2 0 372.484 4.132 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000462799152 1117769660 /nfs/dbraw/zinc/76/96/60/1117769660.db2.gz RNGFKZMEWKZHCQ-UHFFFAOYSA-N 2 0 356.485 4.356 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000462796883 1117779204 /nfs/dbraw/zinc/77/92/04/1117779204.db2.gz YLFHWOSAJINJAJ-AJSBUHFISA-N 2 0 356.554 4.357 20 0 FIADRP Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000462812260 1117782328 /nfs/dbraw/zinc/78/23/28/1117782328.db2.gz GZEUSWQQICTARQ-QFIPXVFZSA-N 2 0 366.505 4.034 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC000462799313 1117783819 /nfs/dbraw/zinc/78/38/19/1117783819.db2.gz SNIXWHXBTLJJSQ-FDFHNCONSA-N 2 0 374.569 4.092 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@@]2(C)CCOC2)c2ccc(F)cc2)CC1 ZINC000462802367 1117785805 /nfs/dbraw/zinc/78/58/05/1117785805.db2.gz LCPUUVLMNPXQLF-FCHUYYIVSA-N 2 0 362.533 4.395 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@]2(C)CCOC2)c2ccc(F)cc2)CC1 ZINC000462802370 1117785930 /nfs/dbraw/zinc/78/59/30/1117785930.db2.gz LCPUUVLMNPXQLF-VXKWHMMOSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462804154 1117786245 /nfs/dbraw/zinc/78/62/45/1117786245.db2.gz CVGQDNJELSZTOW-AQDKSWOWSA-N 2 0 351.332 4.013 20 0 FIADRP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(OCC)c(OCC)cc32)C1 ZINC000462943482 1117872193 /nfs/dbraw/zinc/87/21/93/1117872193.db2.gz DAUZFKRDZQWIJF-QGZVFWFLSA-N 2 0 371.525 4.200 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000540160371 1117904453 /nfs/dbraw/zinc/90/44/53/1117904453.db2.gz CTFZGLIRYTXFBB-WTOYTKOKSA-N 2 0 358.570 4.403 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1OC ZINC000540172798 1117913401 /nfs/dbraw/zinc/91/34/01/1117913401.db2.gz WPMMIAOWBYPUSQ-GOSISDBHSA-N 2 0 370.537 4.265 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCCOc3ccc(Cl)cc32)C[C@H](C)O1 ZINC000540171646 1117913570 /nfs/dbraw/zinc/91/35/70/1117913570.db2.gz UOGGBEZLSQYOSU-FCEWJHQRSA-N 2 0 366.933 4.033 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccc1OC(F)F ZINC000540172694 1117913624 /nfs/dbraw/zinc/91/36/24/1117913624.db2.gz SBTCVUCLFZKZSR-NUJGCVRESA-N 2 0 370.484 4.218 20 0 FIADRP CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540175339 1117915939 /nfs/dbraw/zinc/91/59/39/1117915939.db2.gz UFNZYOQEANTBRL-VGOFRKELSA-N 2 0 368.521 4.364 20 0 FIADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540178856 1117923255 /nfs/dbraw/zinc/92/32/55/1117923255.db2.gz HQZIPQCHYAWGRM-UTKZUKDTSA-N 2 0 354.494 4.028 20 0 FIADRP COC(=O)c1oc([C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1C ZINC000540337972 1117990566 /nfs/dbraw/zinc/99/05/66/1117990566.db2.gz IGAIDNJZUMBJGL-KRWDZBQOSA-N 2 0 362.514 4.024 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@@H](C)[C@H](C)C2)cc1)c1nccs1 ZINC000540394211 1118027518 /nfs/dbraw/zinc/02/75/18/1118027518.db2.gz IZUOSPRGEGLDIJ-KURKYZTESA-N 2 0 373.566 4.003 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2c3cc(Br)ccc3SC[C@@H]2C)C1 ZINC000540409270 1118037587 /nfs/dbraw/zinc/03/75/87/1118037587.db2.gz UZFOLHSJSAKFIN-AHIWAGSCSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@@H]1C[C@H](N[C@@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463279883 1118067706 /nfs/dbraw/zinc/06/77/06/1118067706.db2.gz KIIMKFKCLGHTJJ-CDIGIKMISA-N 2 0 363.549 4.075 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCNc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463288280 1118084356 /nfs/dbraw/zinc/08/43/56/1118084356.db2.gz ZZCLWWUFOSUNBD-GCJKJVERSA-N 2 0 355.501 4.270 20 0 FIADRP CCC1(CC)[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@@H]1OC ZINC000540494196 1118091625 /nfs/dbraw/zinc/09/16/25/1118091625.db2.gz XJIGVLLMYXPFDA-NRSPTQNISA-N 2 0 372.553 4.158 20 0 FIADRP c1cn2c(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)c(C3CC3)nc2s1 ZINC000540504600 1118096293 /nfs/dbraw/zinc/09/62/93/1118096293.db2.gz YDBGEHNDLMEGOR-UHFFFAOYSA-N 2 0 372.582 4.361 20 0 FIADRP CCN1CCC([NH2+][C@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540778301 1118240872 /nfs/dbraw/zinc/24/08/72/1118240872.db2.gz HWGASQFLBXCVKT-PMACEKPBSA-N 2 0 367.940 4.077 20 0 FIADRP c1sc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1-c1ccncc1 ZINC000540973549 1118331323 /nfs/dbraw/zinc/33/13/23/1118331323.db2.gz NZRHLYBLCRXJAU-UHFFFAOYSA-N 2 0 370.566 4.134 20 0 FIADRP CCc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C(C)C)cc1 ZINC000540988760 1118339100 /nfs/dbraw/zinc/33/91/00/1118339100.db2.gz OKZBKGBZNQCNEC-RPWUZVMVSA-N 2 0 366.549 4.303 20 0 FIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000541156170 1118404403 /nfs/dbraw/zinc/40/44/03/1118404403.db2.gz VQPDGJGNFJMHDZ-UTKZUKDTSA-N 2 0 363.977 4.187 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(Cl)ccc2Br)CC1 ZINC000464049379 1118413663 /nfs/dbraw/zinc/41/36/63/1118413663.db2.gz KWHHSJYZQCUVGP-UHFFFAOYSA-N 2 0 359.739 4.314 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000541555573 1118561158 /nfs/dbraw/zinc/56/11/58/1118561158.db2.gz GTZQRONKCKNOCR-SFHVURJKSA-N 2 0 364.468 4.485 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000541557814 1118562403 /nfs/dbraw/zinc/56/24/03/1118562403.db2.gz JKLKYYJNIXYIOB-RTBURBONSA-N 2 0 374.573 4.475 20 0 FIADRP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541666471 1118596966 /nfs/dbraw/zinc/59/69/66/1118596966.db2.gz BKSUWRVPWGEFRB-FQEVSTJZSA-N 2 0 365.565 4.250 20 0 FIADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC/C=C/c2ccc(Br)cc2)C1 ZINC000464791425 1118699716 /nfs/dbraw/zinc/69/97/16/1118699716.db2.gz TWRVHSBXBYWBJU-YXMMZVCTSA-N 2 0 351.332 4.126 20 0 FIADRP CC[N@H+](C)C[C@H]1CC[NH+](CC/C=C/c2ccc(Br)cc2)C1 ZINC000464791423 1118700016 /nfs/dbraw/zinc/70/00/16/1118700016.db2.gz TWRVHSBXBYWBJU-UKINESCASA-N 2 0 351.332 4.126 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000542249110 1118867293 /nfs/dbraw/zinc/86/72/93/1118867293.db2.gz HMBKMJOIKSEPCN-UHFFFAOYSA-N 2 0 350.441 4.274 20 0 FIADRP CS[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000542312263 1118896953 /nfs/dbraw/zinc/89/69/53/1118896953.db2.gz UIEMODPOBJZYTI-HXUWFJFHSA-N 2 0 363.615 4.084 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1OC ZINC000173320211 1119032487 /nfs/dbraw/zinc/03/24/87/1119032487.db2.gz LKMQKKKPHBUOBX-KRWDZBQOSA-N 2 0 356.510 4.395 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2coc(-c3ccc(F)c(F)c3)n2)CC1 ZINC000492168572 1119034885 /nfs/dbraw/zinc/03/48/85/1119034885.db2.gz NEWDWXQXRCRVLH-UHFFFAOYSA-N 2 0 363.452 4.174 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1OC ZINC000173351276 1119035137 /nfs/dbraw/zinc/03/51/37/1119035137.db2.gz NAEBCAZYZSHKRJ-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP COCC[C@@H]1CCCC[NH+]([C@@H](C)CC[N@H+]2CCCC[C@@H](CCOC)C2)C1 ZINC000467274295 1119288818 /nfs/dbraw/zinc/28/88/18/1119288818.db2.gz FZFZRSSFVHHXBJ-FKBYEOEOSA-N 2 0 368.606 4.042 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)ccc1SC(F)F ZINC000152467371 1119322258 /nfs/dbraw/zinc/32/22/58/1119322258.db2.gz LJSOIKOKYZOFKG-STQMWFEESA-N 2 0 356.482 4.145 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2ccc(O)cc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311491845 1119376796 /nfs/dbraw/zinc/37/67/96/1119376796.db2.gz CFPPSZIMPIFVME-WGGBDISSSA-N 2 0 350.506 4.270 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311807397 1119389751 /nfs/dbraw/zinc/38/97/51/1119389751.db2.gz LHQQEMSQCKHTJH-KSEOMHKRSA-N 2 0 356.554 4.369 20 0 FIADRP c1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](CC4CCCCC4)CC3)C2)cc1 ZINC000152543263 1119446259 /nfs/dbraw/zinc/44/62/59/1119446259.db2.gz GOPQCYUGKLMALZ-NRFANRHFSA-N 2 0 355.570 4.147 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000493968790 1119518533 /nfs/dbraw/zinc/51/85/33/1119518533.db2.gz LSYLRHBSXGSIDT-UHFFFAOYSA-N 2 0 365.359 4.407 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000183794938 1119583774 /nfs/dbraw/zinc/58/37/74/1119583774.db2.gz YCOSMEKQWLEQIC-SFHVURJKSA-N 2 0 363.299 4.063 20 0 FIADRP CN(CC[N@H+](C)C1CC1)C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000183954859 1119590263 /nfs/dbraw/zinc/59/02/63/1119590263.db2.gz VAYOASUXKGUNLT-UHFFFAOYSA-N 2 0 372.557 4.009 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(SCC)c2)[C@H](C)C1 ZINC000185538589 1119670239 /nfs/dbraw/zinc/67/02/39/1119670239.db2.gz MDGJRILQRGYYAX-YLJYHZDGSA-N 2 0 350.572 4.025 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000186599165 1119738987 /nfs/dbraw/zinc/73/89/87/1119738987.db2.gz QCEKZWNDNSWLNW-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542485086 1119902445 /nfs/dbraw/zinc/90/24/45/1119902445.db2.gz IELMXIDFAXVDLV-YWZLYKJASA-N 2 0 370.884 4.095 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)n1 ZINC000190745960 1119947437 /nfs/dbraw/zinc/94/74/37/1119947437.db2.gz HSAVVZRIAPSQPA-UHFFFAOYSA-N 2 0 361.489 4.109 20 0 FIADRP C[C@H]1COCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000192542795 1120066949 /nfs/dbraw/zinc/06/69/49/1120066949.db2.gz XYBQQVPHHVOUTH-FDDCHVKYSA-N 2 0 361.489 4.113 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192929411 1120090914 /nfs/dbraw/zinc/09/09/14/1120090914.db2.gz QMIPIENNOAASIZ-JOCHJYFZSA-N 2 0 374.532 4.101 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3sccc3Cl)cc2)C[C@H](C)O1 ZINC000192994885 1120093433 /nfs/dbraw/zinc/09/34/33/1120093433.db2.gz QXIRDQYTPJOIAN-GJZGRUSLSA-N 2 0 364.942 4.301 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494891609 1120358917 /nfs/dbraw/zinc/35/89/17/1120358917.db2.gz QLUSPRISNMCVPB-WOIUINJBSA-N 2 0 362.533 4.395 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2C)C2CCCC2)CC1 ZINC000494925027 1120381516 /nfs/dbraw/zinc/38/15/16/1120381516.db2.gz SKKNKWPEQRESKN-QHCPKHFHSA-N 2 0 357.586 4.234 20 0 FIADRP C[C@H](CCCCO)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000670161066 1120762935 /nfs/dbraw/zinc/76/29/35/1120762935.db2.gz GHFAJUQERLZYAH-BDWVSVIHSA-N 2 0 364.961 4.395 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1C ZINC000237411851 1120976898 /nfs/dbraw/zinc/97/68/98/1120976898.db2.gz IPJAOJXEUIELNR-WOJBJXKFSA-N 2 0 352.522 4.202 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]C[C@H](C)C[NH+]3CCCCC3)cc2)cs1 ZINC000237406458 1120977106 /nfs/dbraw/zinc/97/71/06/1120977106.db2.gz MMKBBYAIJNZGGQ-KRWDZBQOSA-N 2 0 373.566 4.242 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1C ZINC000237621578 1120980368 /nfs/dbraw/zinc/98/03/68/1120980368.db2.gz IPJAOJXEUIELNR-BGYRXZFFSA-N 2 0 352.522 4.202 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4cc[nH]c43)cc2)C[C@H](C)O1 ZINC000237781308 1120984180 /nfs/dbraw/zinc/98/41/80/1120984180.db2.gz XTXOIJPLMXXBCI-ROUUACIJSA-N 2 0 363.505 4.067 20 0 FIADRP Cc1c(C[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)sc2nc(C)nc(C)c12 ZINC000915678474 1121018855 /nfs/dbraw/zinc/01/88/55/1121018855.db2.gz NRVOKYYLPLVFLE-KBPBESRZSA-N 2 0 360.571 4.074 20 0 FIADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000155083540 1121177978 /nfs/dbraw/zinc/17/79/78/1121177978.db2.gz NSLMHZIZAIDTDU-ROUUACIJSA-N 2 0 365.521 4.320 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCc3cccnc3)cc2)CC1 ZINC000154656235 1121305724 /nfs/dbraw/zinc/30/57/24/1121305724.db2.gz HVIMNLAZITYGCH-GOSISDBHSA-N 2 0 353.510 4.186 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]Cc2ccc3occc3c2)CC1 ZINC000671716130 1121431206 /nfs/dbraw/zinc/43/12/06/1121431206.db2.gz JJLUYVGLGNWELZ-UHFFFAOYSA-N 2 0 369.896 4.128 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000166263012 1121467560 /nfs/dbraw/zinc/46/75/60/1121467560.db2.gz KXZMXNJILWYYTB-ZWKOTPCHSA-N 2 0 363.343 4.087 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cccc3ccccc32)CC1 ZINC000061070295 1121506827 /nfs/dbraw/zinc/50/68/27/1121506827.db2.gz JANGABNVBJQWAE-UHFFFAOYSA-N 2 0 373.544 4.267 20 0 FIADRP COc1ccc(OCC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000671739783 1121637298 /nfs/dbraw/zinc/63/72/98/1121637298.db2.gz SGMZSDZDDUJTGJ-UHFFFAOYSA-N 2 0 368.521 4.107 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c(C)c1OC ZINC000671741415 1121638312 /nfs/dbraw/zinc/63/83/12/1121638312.db2.gz LZKYFLNPQIPMJA-ZWKOTPCHSA-N 2 0 362.558 4.187 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000124642901 1121710232 /nfs/dbraw/zinc/71/02/32/1121710232.db2.gz KKBKRAMKAHPFGL-FHWLQOOXSA-N 2 0 368.521 4.155 20 0 FIADRP CCCC[N@H+](C)CC1CCN([C@@H](C)c2nnc(-c3cccs3)o2)CC1 ZINC000066960616 1121763148 /nfs/dbraw/zinc/76/31/48/1121763148.db2.gz RHWHVXQJPMJFBC-HNNXBMFYSA-N 2 0 362.543 4.303 20 0 FIADRP CC(C)(C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC001649101072 1121786014 /nfs/dbraw/zinc/78/60/14/1121786014.db2.gz DRJXTXNDFICBKH-UHFFFAOYSA-N 2 0 370.512 4.368 20 0 FIADRP C[C@@H]([NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC000671764616 1121796654 /nfs/dbraw/zinc/79/66/54/1121796654.db2.gz KLSXMBDLIZOTEY-FOIQADDNSA-N 2 0 350.934 4.128 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000126546794 1121964349 /nfs/dbraw/zinc/96/43/49/1121964349.db2.gz AUGAXYCFWOCZIF-QFIPXVFZSA-N 2 0 373.585 4.031 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CN2CCC[C@H]2CO1)c1ccc(-c2ccccc2F)s1 ZINC000765792183 1121997972 /nfs/dbraw/zinc/99/79/72/1121997972.db2.gz PMATWTRQXKZETK-HRCADAONSA-N 2 0 360.498 4.068 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)c(F)c3)cc2)C1 ZINC000917008508 1122000752 /nfs/dbraw/zinc/00/07/52/1122000752.db2.gz KUSABSRGESQXPO-OPAMFIHVSA-N 2 0 374.475 4.020 20 0 FIADRP CC1(C)OCc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)ccc2O1 ZINC000186406089 1122099183 /nfs/dbraw/zinc/09/91/83/1122099183.db2.gz WGQFBOMWRCNIFW-UHFFFAOYSA-N 2 0 366.505 4.217 20 0 FIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616148 1122103836 /nfs/dbraw/zinc/10/38/36/1122103836.db2.gz QODCVAMIOVCXGE-VYIQXXGSSA-N 2 0 360.542 4.158 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000066960806 1122116042 /nfs/dbraw/zinc/11/60/42/1122116042.db2.gz KYMRJYXIFATXKO-IBGZPJMESA-N 2 0 359.558 4.074 20 0 FIADRP COCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)o1 ZINC000127585025 1122122014 /nfs/dbraw/zinc/12/20/14/1122122014.db2.gz PUZDDNCDQPIPPC-UHFFFAOYSA-N 2 0 362.901 4.081 20 0 FIADRP C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000497658541 1122341364 /nfs/dbraw/zinc/34/13/64/1122341364.db2.gz ZHQFCQUOOYPEGP-QZTJIDSGSA-N 2 0 372.557 4.007 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497867175 1122452979 /nfs/dbraw/zinc/45/29/79/1122452979.db2.gz INCDKBFVPDUZLO-LAUBAEHRSA-N 2 0 357.542 4.136 20 0 FIADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556232842 1122749659 /nfs/dbraw/zinc/74/96/59/1122749659.db2.gz LGNIDBIDOUUSCD-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cn2ccccc2n1 ZINC000556232822 1122749846 /nfs/dbraw/zinc/74/98/46/1122749846.db2.gz CQXJOHLZHBBNLV-LJQANCHMSA-N 2 0 362.521 4.417 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000556239186 1122756127 /nfs/dbraw/zinc/75/61/27/1122756127.db2.gz BBJPJCHBRZKPCU-KNQAVFIVSA-N 2 0 362.533 4.395 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC(C)(C)CCO)c2ccc(F)cc2)CC1 ZINC000556247338 1122760715 /nfs/dbraw/zinc/76/07/15/1122760715.db2.gz VZOIDXHXPYHAIB-NRFANRHFSA-N 2 0 364.549 4.377 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000556480719 1122913612 /nfs/dbraw/zinc/91/36/12/1122913612.db2.gz KJHMUCMRTCNSFI-HSZRJFAPSA-N 2 0 357.586 4.195 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccc(OC)c1 ZINC000556606015 1122996144 /nfs/dbraw/zinc/99/61/44/1122996144.db2.gz PTICHSGJNWLPML-QHCPKHFHSA-N 2 0 368.521 4.409 20 0 FIADRP COc1cc(OC)c([C@@H](C)NC2CC[NH+](CC(C)C)CC2)cc1Cl ZINC000131224241 1123006010 /nfs/dbraw/zinc/00/60/10/1123006010.db2.gz UZOYFAXZNOKMKT-CQSZACIVSA-N 2 0 354.922 4.128 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000131299055 1123030653 /nfs/dbraw/zinc/03/06/53/1123030653.db2.gz AKXAZFMJQLVPDF-GOSISDBHSA-N 2 0 365.993 4.405 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCCN(Cc3cc(-c4ccc(F)cc4)no3)C2)CC1 ZINC000498878415 1123058601 /nfs/dbraw/zinc/05/86/01/1123058601.db2.gz ACWDSYULEQHUPY-SFHVURJKSA-N 2 0 371.500 4.425 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c(C)c1OC ZINC000556868977 1123151231 /nfs/dbraw/zinc/15/12/31/1123151231.db2.gz ZPRROHBXXQCETH-GOSISDBHSA-N 2 0 362.558 4.421 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(C)c1OC ZINC000556871491 1123153755 /nfs/dbraw/zinc/15/37/55/1123153755.db2.gz MUHNTMZEVSVOEF-OAHLLOKOSA-N 2 0 360.473 4.064 20 0 FIADRP CCC[C@H](CCO)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556871815 1123153808 /nfs/dbraw/zinc/15/38/08/1123153808.db2.gz MXXHRQKNRHDLBI-YPIGPJMWSA-N 2 0 358.570 4.066 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCc4ccccn4)[C@H]3C2)cc1 ZINC000556887496 1123164223 /nfs/dbraw/zinc/16/42/23/1123164223.db2.gz YKBVIFKIDPXNGC-OEMFJLHTSA-N 2 0 363.549 4.295 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)c1ccc2n[nH]cc2c1 ZINC000556923534 1123233003 /nfs/dbraw/zinc/23/30/03/1123233003.db2.gz KWIJFDYDYRLPFL-YOVFKVCWSA-N 2 0 360.505 4.124 20 0 FIADRP C[C@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@@H]1CCC[NH2+]C1 ZINC000556951943 1123262298 /nfs/dbraw/zinc/26/22/98/1123262298.db2.gz FCCPJIXOKDKMIA-LSDHHAIUSA-N 2 0 371.352 4.019 20 0 FIADRP Cc1ccccc1OCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499139680 1123282770 /nfs/dbraw/zinc/28/27/70/1123282770.db2.gz QTDSXKUCRNHHMU-KOUNCHBCSA-N 2 0 350.506 4.159 20 0 FIADRP COc1cccc(CCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499142778 1123285040 /nfs/dbraw/zinc/28/50/40/1123285040.db2.gz QGMCQVMNGJLIRS-NUNAXRQHSA-N 2 0 364.533 4.413 20 0 FIADRP COc1cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1C ZINC000499144488 1123285820 /nfs/dbraw/zinc/28/58/20/1123285820.db2.gz DINVWEVKFXWUFR-DKUWSORSSA-N 2 0 350.506 4.289 20 0 FIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1 ZINC000132646653 1123313189 /nfs/dbraw/zinc/31/31/89/1123313189.db2.gz JOBIXPXQICVBPN-LJQANCHMSA-N 2 0 352.522 4.111 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1F ZINC000499235279 1123342796 /nfs/dbraw/zinc/34/27/96/1123342796.db2.gz PYZPTCJQGFDWIY-WLRLJWMZSA-N 2 0 368.496 4.378 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1F ZINC000499235281 1123342866 /nfs/dbraw/zinc/34/28/66/1123342866.db2.gz PYZPTCJQGFDWIY-ZIBCJSCZSA-N 2 0 368.496 4.378 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCOC1 ZINC000133412994 1123485281 /nfs/dbraw/zinc/48/52/81/1123485281.db2.gz GRRQWVOXZNZKRB-FYYLOGMGSA-N 2 0 352.522 4.320 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000245528803 1124109660 /nfs/dbraw/zinc/10/96/60/1124109660.db2.gz GEKYWHCESGIEIE-PZJWPPBQSA-N 2 0 372.553 4.040 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CCOc4ccccc42)C3)cc1 ZINC000245652507 1124167308 /nfs/dbraw/zinc/16/73/08/1124167308.db2.gz CUUINBMNHBWJSY-MYGLTJDJSA-N 2 0 362.517 4.338 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245687166 1124195820 /nfs/dbraw/zinc/19/58/20/1124195820.db2.gz JSYFDZQTRXCCOG-JOZNFPNDSA-N 3 0 363.549 4.033 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2[C@H]4CCO[C@@H]4C24CCCC4)C3)cc1 ZINC000245695103 1124204737 /nfs/dbraw/zinc/20/47/37/1124204737.db2.gz KYRYLTQLEWPNSF-NCKLTAKHSA-N 2 0 366.549 4.119 20 0 FIADRP CCc1nc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC000245702189 1124209752 /nfs/dbraw/zinc/20/97/52/1124209752.db2.gz MAHBLWOIVAUIIR-ACDBMABISA-N 2 0 355.551 4.033 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NC2CC[NH+](C4CCCC4)CC2)C3)cc1 ZINC000245706075 1124211399 /nfs/dbraw/zinc/21/13/99/1124211399.db2.gz MKZGEVNTEUQMQT-VILGAWFOSA-N 2 0 367.581 4.179 20 0 FIADRP c1nc2ccccc2n1CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245710253 1124216140 /nfs/dbraw/zinc/21/61/40/1124216140.db2.gz NBPCMSIEKZBIEJ-KOUNCHBCSA-N 2 0 374.532 4.212 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245724531 1124220646 /nfs/dbraw/zinc/22/06/46/1124220646.db2.gz PGNWBGPJQALPEF-MVWVFHAYSA-N 2 0 350.506 4.108 20 0 FIADRP CO[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245733510 1124228060 /nfs/dbraw/zinc/22/80/60/1124228060.db2.gz QOBJSBLGUCDSKF-BJESRGMDSA-N 2 0 350.506 4.159 20 0 FIADRP Cc1nc2ccccc2n1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245738841 1124231838 /nfs/dbraw/zinc/23/18/38/1124231838.db2.gz REKWBRWEKQTSBJ-DKUWSORSSA-N 2 0 374.532 4.130 20 0 FIADRP CN(C)[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccs1 ZINC000245754485 1124241181 /nfs/dbraw/zinc/24/11/81/1124241181.db2.gz UPDBWZHKOGZTQE-MXEMCNAFSA-N 2 0 369.578 4.136 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc2c(s1)CCCC2 ZINC000542845585 1124446290 /nfs/dbraw/zinc/44/62/90/1124446290.db2.gz DAVXVJDWKWCNOP-OXQOHEQNSA-N 2 0 370.562 4.044 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC000542848571 1124449205 /nfs/dbraw/zinc/44/92/05/1124449205.db2.gz RWLYHQQSGKKLPQ-XMSQKQJNSA-N 2 0 370.924 4.074 20 0 FIADRP CCOc1ccccc1Oc1ccc(CN[C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)cn1 ZINC000247030488 1124583900 /nfs/dbraw/zinc/58/39/00/1124583900.db2.gz MFKFTCVTAXRQMN-ZHALLVOQSA-N 2 0 369.509 4.091 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC(F)F)cc2)[C@@H](C)C1 ZINC000248031047 1124739283 /nfs/dbraw/zinc/73/92/83/1124739283.db2.gz QJHQVTASKQNDPP-FCEWJHQRSA-N 2 0 370.484 4.076 20 0 FIADRP CCN1CC[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248444838 1124769061 /nfs/dbraw/zinc/76/90/61/1124769061.db2.gz WHJGPTHPVNENEH-WOJBJXKFSA-N 2 0 367.940 4.077 20 0 FIADRP Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1C ZINC000248453060 1124771895 /nfs/dbraw/zinc/77/18/95/1124771895.db2.gz QGUJFVUCSKCLHO-KNQAVFIVSA-N 2 0 352.522 4.111 20 0 FIADRP Fc1cc(C(F)(F)F)cc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c1 ZINC000249117071 1124845572 /nfs/dbraw/zinc/84/55/72/1124845572.db2.gz SMNVHPMCUHJNRA-IRXDYDNUSA-N 2 0 356.407 4.093 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cnc2ccsc2c1 ZINC000089215442 1124891181 /nfs/dbraw/zinc/89/11/81/1124891181.db2.gz ICSZVQGJAADDSB-OAHLLOKOSA-N 2 0 352.507 4.259 20 0 FIADRP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089214537 1124891777 /nfs/dbraw/zinc/89/17/77/1124891777.db2.gz QZTBSQDPJQFJDS-OAQYLSRUSA-N 2 0 363.505 4.334 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OC1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000090027694 1124976087 /nfs/dbraw/zinc/97/60/87/1124976087.db2.gz LETDRECDBAKFHV-SFHVURJKSA-N 2 0 368.521 4.409 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc2ccccc2c1 ZINC000090525019 1125001713 /nfs/dbraw/zinc/00/17/13/1125001713.db2.gz DLYQYYRCBZXBOD-IMRHEYAYSA-N 2 0 352.522 4.258 20 0 FIADRP Cc1cc2ncc([C@H](C)[NH2+]C3CCC([NH+]4CCC(C)CC4)CC3)c(C)n2n1 ZINC000090775429 1125020128 /nfs/dbraw/zinc/02/01/28/1125020128.db2.gz VRJGZFSAGWXFLS-KKXNLOMOSA-N 2 0 369.557 4.040 20 0 FIADRP CCCO[C@@H]1CCC[NH+](C/C=C\C[N@H+]2CCC[C@@H](OCCC)CC2)CC1 ZINC000254928551 1125065723 /nfs/dbraw/zinc/06/57/23/1125065723.db2.gz YJVXXAKTHGWQHL-UQMQSGJDSA-N 2 0 366.590 4.105 20 0 FIADRP CC(C)[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091367565 1125068067 /nfs/dbraw/zinc/06/80/67/1125068067.db2.gz VIXBHZDTAFIHEA-LJQANCHMSA-N 2 0 371.491 4.018 20 0 FIADRP c1ccc(C([NH2+]C2CCN(C[C@@H]3CCCO3)CC2)c2ccccc2)cc1 ZINC000679342725 1125069738 /nfs/dbraw/zinc/06/97/38/1125069738.db2.gz QMCSQMMTQDDMNH-QFIPXVFZSA-N 2 0 350.506 4.009 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ncc(Br)cc1F ZINC000186902572 568007382 /nfs/dbraw/zinc/00/73/82/568007382.db2.gz FCIQNNPWHQDOSJ-QWHCGFSZSA-N 2 0 360.315 4.144 20 0 FIADRP CSc1cc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)ccn1 ZINC000563120107 568224839 /nfs/dbraw/zinc/22/48/39/568224839.db2.gz RNYYBVOVAYVWJJ-LJQANCHMSA-N 2 0 353.535 4.090 20 0 FIADRP CCCO[C@@H]1CCC[N@H+](CC[C@H](C)[NH+]2CCC[C@H](OCCC)CC2)CC1 ZINC000431594910 568333618 /nfs/dbraw/zinc/33/36/18/568333618.db2.gz HGBMYOQDTOZKBJ-BDTNDASRSA-N 2 0 368.606 4.327 20 0 FIADRP c1ccc2c(c1)SC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605165963 568594415 /nfs/dbraw/zinc/59/44/15/568594415.db2.gz JAWGPBUVQNIGGR-FQEVSTJZSA-N 2 0 354.519 4.098 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@@H]2C2CC[NH2+]CC2)nc1 ZINC001164419798 718893368 /nfs/dbraw/zinc/89/33/68/718893368.db2.gz RDBISPNAAPOEHH-FCHUYYIVSA-N 2 0 370.585 4.377 20 0 FIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@@H](Cc4ccccc4)C3)c2)CC1 ZINC001165038277 721900400 /nfs/dbraw/zinc/90/04/00/721900400.db2.gz PNZSFNZCKOPIDJ-FQEVSTJZSA-N 2 0 365.521 4.014 20 0 FIADRP COc1cc2cc[nH+]c(N3CCCC[C@H]3CC[NH+]3CCCC3)c2cc1OC ZINC001165048305 721971555 /nfs/dbraw/zinc/97/15/55/721971555.db2.gz NPLRWGCERRCXDT-SFHVURJKSA-N 2 0 369.509 4.097 20 0 FIADRP c1cn(CCCC2CC[NH+](Cc3ncc(-c4ccccc4)o3)CC2)cn1 ZINC000543061864 1125580606 /nfs/dbraw/zinc/58/06/06/1125580606.db2.gz NAJJCBCARCUIFV-UHFFFAOYSA-N 2 0 350.466 4.231 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCc2nccs2)cc1C[NH+]1CCCCC1 ZINC000182694707 1125600883 /nfs/dbraw/zinc/60/08/83/1125600883.db2.gz JZTKIAMLJOJWLC-MRXNPFEDSA-N 2 0 359.539 4.031 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000152774832 1125649884 /nfs/dbraw/zinc/64/98/84/1125649884.db2.gz LQFITOKNWYXJJS-MRXNPFEDSA-N 2 0 360.473 4.016 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(CO)c2)cc1C[NH+]1CCCCC1 ZINC000182851882 1125656911 /nfs/dbraw/zinc/65/69/11/1125656911.db2.gz DZDJFYFGCUZVDB-SFHVURJKSA-N 2 0 368.521 4.024 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(OCc3ccccc3F)c2)C1 ZINC000619772560 1125700714 /nfs/dbraw/zinc/70/07/14/1125700714.db2.gz OKPSYQRAHUQCFB-LJQANCHMSA-N 2 0 356.485 4.226 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H]2CC[NH2+]C4(CCC4)C2)CCC3)cc1 ZINC000643545822 1079658093 /nfs/dbraw/zinc/65/80/93/1079658093.db2.gz COQXRDOZAYJNDF-IRXDYDNUSA-N 2 0 353.535 4.452 20 0 FIADRP Brc1ccccc1C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643547241 1079678071 /nfs/dbraw/zinc/67/80/71/1079678071.db2.gz BSOHHACQNCDQIP-WMZOPIPTSA-N 2 0 363.343 4.035 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643547919 1079681532 /nfs/dbraw/zinc/68/15/32/1079681532.db2.gz KXLYHPQBVFDPFJ-IFMALSPDSA-N 2 0 350.506 4.243 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)ccc1F ZINC000153402183 1125789451 /nfs/dbraw/zinc/78/94/51/1125789451.db2.gz GCZBTSDAOUPPEL-HNNXBMFYSA-N 2 0 362.514 4.459 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(C[NH+]3CCCC3)CC2)c(C)c1 ZINC000137069371 1080159931 /nfs/dbraw/zinc/15/99/31/1080159931.db2.gz CEOQYCDGCAHUSI-UHFFFAOYSA-N 2 0 371.569 4.138 20 0 FIADRP CN(CC[NH+]1CCCC1)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000118793892 1080189068 /nfs/dbraw/zinc/18/90/68/1080189068.db2.gz KGMDJWAMENZASX-UHFFFAOYSA-N 2 0 372.557 4.011 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](CC3CCC(c4ccccc4)CC3)C2)CC1 ZINC000547738391 1080332092 /nfs/dbraw/zinc/33/20/92/1080332092.db2.gz BQKZGMFHCZDVPW-HQNXYIODSA-N 2 0 369.597 4.061 20 0 FIADRP CCOC(C)(C)C[NH+]1CCC2(CCC[N@H+](Cc3ccc(C)cc3)C2)CC1 ZINC001209072884 1080371374 /nfs/dbraw/zinc/37/13/74/1080371374.db2.gz OFWOSVGJCGQIHQ-UHFFFAOYSA-N 2 0 358.570 4.488 20 0 FIADRP FC(F)(F)COc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533534554 1080552791 /nfs/dbraw/zinc/55/27/91/1080552791.db2.gz XKJSPPFOYHAONC-APWZRJJASA-N 2 0 368.443 4.076 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+]C3CCC(C4CCCCC4)CC3)CC2)CC1 ZINC000683473145 1081024950 /nfs/dbraw/zinc/02/49/50/1081024950.db2.gz ZAVAAQZDGWXOQD-UHFFFAOYSA-N 2 0 361.618 4.274 20 0 FIADRP [NH3+][C@H](CCC(=O)Nc1cccc(C[NH+]2CCCCC2)c1)c1ccccc1 ZINC000237952444 1081073550 /nfs/dbraw/zinc/07/35/50/1081073550.db2.gz POYIWOKKOUTOKE-OAQYLSRUSA-N 2 0 351.494 4.091 20 0 FIADRP CCOc1cncc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)c1 ZINC001648808660 1081114292 /nfs/dbraw/zinc/11/42/92/1081114292.db2.gz YYKMENCLEGULEY-OALUTQOASA-N 2 0 367.537 4.248 20 0 FIADRP Fc1ccccc1-c1n[nH]cc1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000579937976 1081118298 /nfs/dbraw/zinc/11/82/98/1081118298.db2.gz QYKFBEWZTNPIBQ-UHFFFAOYSA-N 2 0 367.472 4.105 20 0 FIADRP Brc1c2ccccc2oc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000655766215 1081182509 /nfs/dbraw/zinc/18/25/09/1081182509.db2.gz BPQFGADZPDYBJW-UHFFFAOYSA-N 2 0 363.299 4.159 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2ccccc2Br)C1 ZINC000655804941 1081211530 /nfs/dbraw/zinc/21/15/30/1081211530.db2.gz GSEQMYRXVVXQDP-OXFYSEKESA-N 2 0 373.338 4.468 20 0 FIADRP COc1ccc([C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C(C)C)c(Br)c1 ZINC000655804442 1081213836 /nfs/dbraw/zinc/21/38/36/1081213836.db2.gz YTFLHEYVHQQMAN-IYOUNJFTSA-N 2 0 369.347 4.085 20 0 FIADRP Cc1cnc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c(C)c1 ZINC000655806980 1081215569 /nfs/dbraw/zinc/21/55/69/1081215569.db2.gz HYHYOMOKVHWQOW-UHFFFAOYSA-N 2 0 351.538 4.274 20 0 FIADRP FC(F)(F)Oc1cccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000655820806 1081232034 /nfs/dbraw/zinc/23/20/34/1081232034.db2.gz LYBTVNYICCQRNX-IAGOWNOFSA-N 2 0 368.443 4.223 20 0 FIADRP CN(CCC[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC001167307173 1081246913 /nfs/dbraw/zinc/24/69/13/1081246913.db2.gz RUFCNPTXGVFOLF-UHFFFAOYSA-N 2 0 365.565 4.357 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC000137683292 1081264158 /nfs/dbraw/zinc/26/41/58/1081264158.db2.gz BEEYVSUFTWSAIU-OAQYLSRUSA-N 2 0 371.569 4.138 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)C1 ZINC001648828685 1081266204 /nfs/dbraw/zinc/26/62/04/1081266204.db2.gz PTEQMVHCNYRYRS-MECCDNJOSA-N 2 0 350.506 4.210 20 0 FIADRP CO[C@@H](Cc1ccccc1)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC001167310133 1081271082 /nfs/dbraw/zinc/27/10/82/1081271082.db2.gz NWKRCYXZDIJCPJ-DEOSSOPVSA-N 2 0 366.549 4.088 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000683816216 1081618362 /nfs/dbraw/zinc/61/83/62/1081618362.db2.gz NBZSUICJKYXKQM-LSWJPFSZSA-N 2 0 352.522 4.264 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)c2ccccc21 ZINC000580218709 1081757360 /nfs/dbraw/zinc/75/73/60/1081757360.db2.gz UOSXUTKFOHCQBA-FCHUYYIVSA-N 2 0 370.537 4.165 20 0 FIADRP C[C@H](NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000471585483 1081984640 /nfs/dbraw/zinc/98/46/40/1081984640.db2.gz MKILJLNUKXBVDB-CQIJRDABSA-N 2 0 357.586 4.311 20 0 FIADRP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398202625 1082116761 /nfs/dbraw/zinc/11/67/61/1082116761.db2.gz PXNDEWGKKDHYMU-XXBNENTESA-N 2 0 352.522 4.476 20 0 FIADRP COc1ccc2oc([C@H](C)[NH2+]CC3(SC)CC[NH+](C)CC3)c(C)c2c1 ZINC000580803835 1082149732 /nfs/dbraw/zinc/14/97/32/1082149732.db2.gz UUBTWVHLCYWZPQ-HNNXBMFYSA-N 2 0 362.539 4.228 20 0 FIADRP Cc1cccc2c1OC[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC000581101574 1082314866 /nfs/dbraw/zinc/31/48/66/1082314866.db2.gz MIZVAHPDPPJFQF-ODAXIHTASA-N 2 0 362.517 4.084 20 0 FIADRP C[C@@H]([NH2+]CC(C)(C)Oc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155454 1082391345 /nfs/dbraw/zinc/39/13/45/1082391345.db2.gz GJXIFIJBSRRMAA-TZIWHRDSSA-N 2 0 352.522 4.344 20 0 FIADRP [NH3+]C[C@H](Cc1ccccc1)[C@@H]1CCCC[N@@H+]1Cc1scnc1C1CC1 ZINC000581429536 1082572226 /nfs/dbraw/zinc/57/22/26/1082572226.db2.gz PQYOHUZEVONNKQ-OALUTQOASA-N 2 0 355.551 4.193 20 0 FIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(C)c1OC ZINC000581511266 1082629891 /nfs/dbraw/zinc/62/98/91/1082629891.db2.gz FDXTUTHVUXATOW-UHFFFAOYSA-N 2 0 374.550 4.076 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@H]4C)CC3)CC2)c1 ZINC000581517869 1082633514 /nfs/dbraw/zinc/63/35/14/1082633514.db2.gz BLOJQRXOYSLZPN-GCJKJVERSA-N 2 0 356.554 4.360 20 0 FIADRP Clc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000656682896 1082714501 /nfs/dbraw/zinc/71/45/01/1082714501.db2.gz HWYHNIDKPQBROB-OAQYLSRUSA-N 2 0 355.913 4.224 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)[C@H](C)C1 ZINC000430758015 1083145947 /nfs/dbraw/zinc/14/59/47/1083145947.db2.gz YHQTVEOAHDYVQP-DRRHNWJESA-N 2 0 369.322 4.154 20 0 FIADRP Fc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1Br ZINC000430762017 1083156090 /nfs/dbraw/zinc/15/60/90/1083156090.db2.gz NNLDWTHMSOMSNN-FPCVCCKLSA-N 2 0 367.306 4.051 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000548392864 1083213974 /nfs/dbraw/zinc/21/39/74/1083213974.db2.gz QICYTFUFBZNISZ-UHFFFAOYSA-N 2 0 357.542 4.184 20 0 FIADRP CC[C@H](c1ccccc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430926426 1083235774 /nfs/dbraw/zinc/23/57/74/1083235774.db2.gz GCZVYLHJPAWDPM-HSZRJFAPSA-N 2 0 357.586 4.266 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000430922876 1083237274 /nfs/dbraw/zinc/23/72/74/1083237274.db2.gz CREZHEZBEFXFAT-SJORKVTESA-N 2 0 351.494 4.059 20 0 FIADRP C[C@@H](NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cn2ccccc2n1 ZINC000658317938 1083404538 /nfs/dbraw/zinc/40/45/38/1083404538.db2.gz NZKLWAFMQJTBKB-TZIWHRDSSA-N 2 0 374.532 4.287 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCCc4cccnc43)C3(CCC3)C2)cc1 ZINC000658318718 1083406461 /nfs/dbraw/zinc/40/64/61/1083406461.db2.gz SJLVZDQOFSVSEW-FGZHOGPDSA-N 2 0 361.533 4.351 20 0 FIADRP C[C@H](O)[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000658358940 1083429558 /nfs/dbraw/zinc/42/95/58/1083429558.db2.gz BBEDRGGYTHCJFC-QVYZHRQISA-N 2 0 352.522 4.141 20 0 FIADRP CCCCCn1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)n1 ZINC000548482326 1083454855 /nfs/dbraw/zinc/45/48/55/1083454855.db2.gz CWKRQROKWKOWOG-KNQAVFIVSA-N 2 0 368.569 4.382 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccccc2OCc2ccncc2)cc1 ZINC000520952698 1083456447 /nfs/dbraw/zinc/45/64/47/1083456447.db2.gz BTAWTHJYOHLQME-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)c1ccccc1 ZINC000548483542 1083468111 /nfs/dbraw/zinc/46/81/11/1083468111.db2.gz GOBWWXLAMJMSNF-URVUXULASA-N 2 0 351.538 4.012 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000510980643 1083556301 /nfs/dbraw/zinc/55/63/01/1083556301.db2.gz YMVBCEVJQZTXKJ-WVBUVRCRSA-N 2 0 368.496 4.322 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000181318866 1083871644 /nfs/dbraw/zinc/87/16/44/1083871644.db2.gz DEOKKHRSLAODOL-KKSFZXQISA-N 2 0 372.484 4.331 20 0 FIADRP CC[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC[C@@H]1[NH3+] ZINC000647497524 1084252175 /nfs/dbraw/zinc/25/21/75/1084252175.db2.gz JSXVBCSMQGYPKY-UZLBHIALSA-N 2 0 371.912 4.152 20 0 FIADRP Cc1cc(C)c(NC(=O)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c(C)n1 ZINC000653178410 1084264562 /nfs/dbraw/zinc/26/45/62/1084264562.db2.gz XALOGXPNKZQLQX-FQEVSTJZSA-N 2 0 366.509 4.041 20 0 FIADRP C[C@H]1C[C@H](N(C)Cc2sccc2NC(=O)OC(C)(C)C)CC[N@@H+]1C ZINC000892104698 1084299465 /nfs/dbraw/zinc/29/94/65/1084299465.db2.gz DPNJHZGKJYVWFZ-UONOGXRCSA-N 2 0 353.532 4.010 20 0 FIADRP Fc1c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cccc1OC1CC1 ZINC000657298444 1084305604 /nfs/dbraw/zinc/30/56/04/1084305604.db2.gz UPGPTCGHOIRODB-UHFFFAOYSA-N 2 0 354.469 4.253 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2c(C3CCC3)cnn2C)cc1 ZINC000657311015 1084404547 /nfs/dbraw/zinc/40/45/47/1084404547.db2.gz VOYMCZCWOPNAQK-GOSISDBHSA-N 2 0 366.553 4.352 20 0 FIADRP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)C2)c1 ZINC000414068140 1084420112 /nfs/dbraw/zinc/42/01/12/1084420112.db2.gz AWJSQCUFNMDAJQ-YRISNDGFSA-N 2 0 362.945 4.067 20 0 FIADRP OCC[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCc2ccccc21 ZINC001167529669 1084465577 /nfs/dbraw/zinc/46/55/77/1084465577.db2.gz QPMYPQPKQXAPGI-XMMPIXPASA-N 2 0 364.533 4.154 20 0 FIADRP c1c2ccncc2sc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000657335324 1084622456 /nfs/dbraw/zinc/62/24/56/1084622456.db2.gz NQBUIWRSTRKXNY-SFHVURJKSA-N 2 0 351.519 4.298 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3ccc(-c4cccs4)cc3)CC2)CC1 ZINC000657337906 1084630916 /nfs/dbraw/zinc/63/09/16/1084630916.db2.gz LNVYTTLQUCOPIZ-UHFFFAOYSA-N 2 0 369.578 4.063 20 0 FIADRP c1c2ccncc2sc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000657358580 1084718306 /nfs/dbraw/zinc/71/83/06/1084718306.db2.gz YXAXKRYNJYDYEM-UHFFFAOYSA-N 2 0 367.518 4.061 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccc(F)cc2)cc1 ZINC000414191433 1084775496 /nfs/dbraw/zinc/77/54/96/1084775496.db2.gz RWYKEDIKKRPDBM-VGSWGCGISA-N 2 0 356.485 4.245 20 0 FIADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000414219984 1084846730 /nfs/dbraw/zinc/84/67/30/1084846730.db2.gz IKYNOWDUDYHSOF-CMOSFIGNSA-N 2 0 362.517 4.084 20 0 FIADRP C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000414240338 1084890348 /nfs/dbraw/zinc/89/03/48/1084890348.db2.gz ZVWGKEWILJJZOD-KRWDZBQOSA-N 2 0 355.526 4.170 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cc(F)ccc1F ZINC000414298268 1084991707 /nfs/dbraw/zinc/99/17/07/1084991707.db2.gz GWMUAHPQOVOLSW-OAQYLSRUSA-N 2 0 374.475 4.033 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@@H]([NH3+])c1ccccc1)C1CCCCC1 ZINC000237167023 1085097611 /nfs/dbraw/zinc/09/76/11/1085097611.db2.gz JSJAHWJTQCCTFW-OAQYLSRUSA-N 2 0 365.521 4.480 20 0 FIADRP C[N@@H+]1CC[C@]2(C1)CCCN(CCOC(c1ccccc1)c1ccccc1)C2 ZINC000660653648 1085202705 /nfs/dbraw/zinc/20/27/05/1085202705.db2.gz UCFFJHWSTKETGI-DEOSSOPVSA-N 2 0 364.533 4.210 20 0 FIADRP Cc1nn(-c2cccc(C)c2)cc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000651669883 1085317623 /nfs/dbraw/zinc/31/76/23/1085317623.db2.gz MMNNBEHUSWXKSK-UHFFFAOYSA-N 2 0 374.532 4.375 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000549528119 1085364360 /nfs/dbraw/zinc/36/43/60/1085364360.db2.gz SETIYOWSJLULMH-YADHBBJMSA-N 2 0 366.505 4.020 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)s1 ZINC000657535869 1085451281 /nfs/dbraw/zinc/45/12/81/1085451281.db2.gz SJEAWXDBFAEYQO-UHFFFAOYSA-N 2 0 350.572 4.026 20 0 FIADRP C[N@@H+](Cc1ccc(F)c2cccnc12)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110188 1085554333 /nfs/dbraw/zinc/55/43/33/1085554333.db2.gz DBNBQKJUWYSTOD-LJQANCHMSA-N 2 0 363.480 4.328 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)C1 ZINC000563460840 1085639064 /nfs/dbraw/zinc/63/90/64/1085639064.db2.gz ZBGNTIHZZYTZFX-WIYYLYMNSA-N 2 0 374.912 4.318 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(C4CCCC4)cc3)cc2)C1 ZINC000657597544 1085669608 /nfs/dbraw/zinc/66/96/08/1085669608.db2.gz UNMOSUUMUQWGQP-XMMPIXPASA-N 2 0 364.533 4.201 20 0 FIADRP CCOc1c(Cl)cccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613214 1085691584 /nfs/dbraw/zinc/69/15/84/1085691584.db2.gz IWFNTJSTVIXSQT-UHFFFAOYSA-N 2 0 373.928 4.136 20 0 FIADRP CCSc1cccc(C[NH+]2CCC(OCC[NH+](CC)CC)CC2)c1 ZINC000473131415 1085724370 /nfs/dbraw/zinc/72/43/70/1085724370.db2.gz HTSSNHUOSHCCSK-UHFFFAOYSA-N 2 0 350.572 4.121 20 0 FIADRP CCCC[NH+]1CCC(N(C)Cc2ccc(F)c(OC(F)(F)F)c2)CC1 ZINC001143447901 1085756038 /nfs/dbraw/zinc/75/60/38/1085756038.db2.gz IHXBFVORRLEVMJ-UHFFFAOYSA-N 2 0 362.411 4.421 20 0 FIADRP COc1ccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)cc1 ZINC001167647380 1086024187 /nfs/dbraw/zinc/02/41/87/1086024187.db2.gz MBWRTMSTDMLFLE-GGAORHGYSA-N 2 0 350.506 4.182 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](Cn2ccnc2)C(C)(C)C)CC1 ZINC000796702862 1086212322 /nfs/dbraw/zinc/21/23/22/1086212322.db2.gz PVAVAGCVZNQFFM-LZBANZJXSA-N 2 0 368.569 4.331 20 0 FIADRP COc1cccc(OCC[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167659333 1086395224 /nfs/dbraw/zinc/39/52/24/1086395224.db2.gz QCULIGKKECPLLB-IBGZPJMESA-N 2 0 360.542 4.051 20 0 FIADRP COc1cccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000662291150 1086397186 /nfs/dbraw/zinc/39/71/86/1086397186.db2.gz BVXGAQIGBSBRGO-SFHVURJKSA-N 2 0 371.550 4.030 20 0 FIADRP COc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H](C)[C@H]2CCC[NH3+])cs1 ZINC000662311206 1086410033 /nfs/dbraw/zinc/41/00/33/1086410033.db2.gz AFLFDARHRRJCBS-CRAIPNDOSA-N 2 0 359.539 4.158 20 0 FIADRP c1c(C2CC[NH+](Cc3ccc4ccccc4c3)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662328918 1086418753 /nfs/dbraw/zinc/41/87/53/1086418753.db2.gz WNNZYKBFSOMUNQ-UHFFFAOYSA-N 2 0 374.532 4.410 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000663466293 1086563182 /nfs/dbraw/zinc/56/31/82/1086563182.db2.gz QPCUAOJBWIOXRU-MAUKXSAKSA-N 2 0 367.459 4.189 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000663466294 1086563406 /nfs/dbraw/zinc/56/34/06/1086563406.db2.gz QPCUAOJBWIOXRU-QAPCUYQASA-N 2 0 367.459 4.189 20 0 FIADRP C[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1sccc1Br ZINC000663468935 1086570697 /nfs/dbraw/zinc/57/06/97/1086570697.db2.gz NOIAPLAPBRNZQX-GXTWGEPZSA-N 2 0 357.361 4.283 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000583351627 1086596958 /nfs/dbraw/zinc/59/69/58/1086596958.db2.gz IMMLAELMYVKZRS-HSZRJFAPSA-N 2 0 352.522 4.301 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2ccc(F)cc2F)CC1 ZINC001167826590 1086617485 /nfs/dbraw/zinc/61/74/85/1086617485.db2.gz QZEXGMIEIRIVGN-MRXNPFEDSA-N 2 0 354.485 4.319 20 0 FIADRP C[C@H]1CN(CCC[NH2+]Cc2ccc(-c3ccccc3F)s2)CCCO1 ZINC000432350347 1086648077 /nfs/dbraw/zinc/64/80/77/1086648077.db2.gz YLCJYUCLVCLVIW-INIZCTEOSA-N 2 0 362.514 4.145 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC1)CC(=O)c1cc(C)ccc1O2 ZINC001167837912 1086712220 /nfs/dbraw/zinc/71/22/20/1086712220.db2.gz NTFRNFYXGNYOKF-IBGZPJMESA-N 2 0 372.553 4.305 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432410196 1086733146 /nfs/dbraw/zinc/73/31/46/1086733146.db2.gz MJSYRGQRPNDGTA-UHFFFAOYSA-N 2 0 365.359 4.407 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167841743 1086738988 /nfs/dbraw/zinc/73/89/88/1086738988.db2.gz PZHOLNHBJFOKKR-RTBURBONSA-N 2 0 369.594 4.076 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C1(C)CCN(C(=O)OC(C)(C)C)CC1 ZINC001167841732 1086739339 /nfs/dbraw/zinc/73/93/39/1086739339.db2.gz PRRYXWVEAQVNST-GOSISDBHSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@@]2(CCCN2Cc2ccccc2)C1 ZINC001167842372 1086745380 /nfs/dbraw/zinc/74/53/80/1086745380.db2.gz WPVYFNVGUUHCDZ-GGAORHGYSA-N 2 0 357.586 4.237 20 0 FIADRP CCCCc1oc2ccccc2c1C[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000650706310 1086755690 /nfs/dbraw/zinc/75/56/90/1086755690.db2.gz ILUCNOWVVBCBKI-BSRJHKFKSA-N 2 0 370.537 4.494 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000432428241 1086756991 /nfs/dbraw/zinc/75/69/91/1086756991.db2.gz JEVBUPPNNJDJQT-QBKZBJQZSA-N 2 0 358.570 4.470 20 0 FIADRP Cc1ccc(-c2cccc(C[N@@H+]3CCC[C@H]([C@@H]4C[C@@H]([NH3+])CCO4)C3)c2)cc1 ZINC000650706825 1086759563 /nfs/dbraw/zinc/75/95/63/1086759563.db2.gz TWQWFAWCDMZIPZ-HJOGWXRNSA-N 2 0 364.533 4.380 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432438974 1086770901 /nfs/dbraw/zinc/77/09/01/1086770901.db2.gz DYVYDLPALHEXSN-CCRGXQTGSA-N 2 0 351.332 4.158 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)cn1 ZINC000512113484 1086782823 /nfs/dbraw/zinc/78/28/23/1086782823.db2.gz DGIYRKPLRGRHQK-RTBURBONSA-N 2 0 351.538 4.412 20 0 FIADRP CCc1nc(CNC[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cs1 ZINC000657771738 1086801990 /nfs/dbraw/zinc/80/19/90/1086801990.db2.gz NKAUQILSFCQVIZ-SFHVURJKSA-N 2 0 355.551 4.097 20 0 FIADRP Fc1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1F ZINC000512135415 1086814032 /nfs/dbraw/zinc/81/40/32/1086814032.db2.gz JYGATWGJJDFPOJ-PDGUBNMISA-N 2 0 356.460 4.132 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)cc1 ZINC000512137522 1086817077 /nfs/dbraw/zinc/81/70/77/1086817077.db2.gz VAKAYGNBRJMOMJ-HWKANZROSA-N 2 0 360.448 4.098 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000650722573 1086820339 /nfs/dbraw/zinc/82/03/39/1086820339.db2.gz WRNDGROPTKXVQS-YFVAEKQCSA-N 2 0 374.912 4.461 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000650722572 1086820930 /nfs/dbraw/zinc/82/09/30/1086820930.db2.gz WRNDGROPTKXVQS-SLYNCCJLSA-N 2 0 374.912 4.461 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000650723008 1086822933 /nfs/dbraw/zinc/82/29/33/1086822933.db2.gz GFEKJMSDILSTOL-MISYRCLQSA-N 2 0 374.525 4.415 20 0 FIADRP COCC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657773890 1086855172 /nfs/dbraw/zinc/85/51/72/1086855172.db2.gz VOWCRMGIKFAYFO-ATKRNPRHSA-N 2 0 356.554 4.084 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc3ccccc3c2)CC1 ZINC000728571850 1086883018 /nfs/dbraw/zinc/88/30/18/1086883018.db2.gz OHDLHKKRFAJRMA-GOSISDBHSA-N 2 0 367.537 4.219 20 0 FIADRP C[C@@H](CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)C1CC[NH2+]CC1 ZINC000246209798 1086908000 /nfs/dbraw/zinc/90/80/00/1086908000.db2.gz FTXCFVFHRNUDKR-ROUUACIJSA-N 2 0 357.542 4.025 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3c(Br)cccc32)c(F)c1 ZINC000650754195 1086960289 /nfs/dbraw/zinc/96/02/89/1086960289.db2.gz CVKMTEPVZKLVHK-GOSISDBHSA-N 2 0 363.274 4.214 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CC2 ZINC000650754518 1086961931 /nfs/dbraw/zinc/96/19/31/1086961931.db2.gz KWHIDPAUVUPBCD-QGZVFWFLSA-N 2 0 363.274 4.132 20 0 FIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000657834450 1087214664 /nfs/dbraw/zinc/21/46/64/1087214664.db2.gz KBFYWRHNGZDPDH-TZMCWYRMSA-N 2 0 360.851 4.364 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Br)c(Cl)c1 ZINC000657836572 1087226357 /nfs/dbraw/zinc/22/63/57/1087226357.db2.gz WIGNQCNXYSZIDF-VXGBXAGGSA-N 2 0 357.723 4.237 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc3cc(OC)c(OC)cc3c2)C1 ZINC000657845364 1087291914 /nfs/dbraw/zinc/29/19/14/1087291914.db2.gz NJAPFPCXTFDFPG-SJORKVTESA-N 2 0 356.510 4.240 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCCc2nc3ccccc3n2C)CC1 ZINC000090050260 1087401525 /nfs/dbraw/zinc/40/15/25/1087401525.db2.gz VRGQPLYWPORKMW-GHTZIAJQSA-N 2 0 368.569 4.139 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC1 ZINC000091285544 1087427278 /nfs/dbraw/zinc/42/72/78/1087427278.db2.gz IRVIQSILHTYCJW-VQIMIIECSA-N 2 0 371.491 4.018 20 0 FIADRP Brc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000062426679 1087599230 /nfs/dbraw/zinc/59/92/30/1087599230.db2.gz BNSHMXNFNOMVEX-LJQANCHMSA-N 2 0 373.338 4.451 20 0 FIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Br)c(Cl)c1 ZINC000658028394 1087699017 /nfs/dbraw/zinc/69/90/17/1087699017.db2.gz DHQWBBNMSMDJSK-HLVVYCRESA-N 2 0 357.723 4.378 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000658067630 1087710100 /nfs/dbraw/zinc/71/01/00/1087710100.db2.gz ONXIETDYBAHKOS-AWEZNQCLSA-N 2 0 354.897 4.021 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)cc1Cl ZINC000658069373 1087710980 /nfs/dbraw/zinc/71/09/80/1087710980.db2.gz PAPSHIJGOZIOFN-AWEZNQCLSA-N 2 0 354.897 4.021 20 0 FIADRP c1cncc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CCCCC2)c1 ZINC000658070083 1087711592 /nfs/dbraw/zinc/71/15/92/1087711592.db2.gz KXMHYUTXDNFWOR-QHCPKHFHSA-N 2 0 371.569 4.184 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc(F)ccc1F ZINC000658134555 1087728037 /nfs/dbraw/zinc/72/80/37/1087728037.db2.gz BGCZWMRGJAFLNG-UGKGYDQZSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccnc3ccccc23)CC1 ZINC000658128196 1087733700 /nfs/dbraw/zinc/73/37/00/1087733700.db2.gz TYBZJLJGFULGBQ-JPYJTQIMSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@@H]([NH2+]CCc1ccnc2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000658128148 1087733822 /nfs/dbraw/zinc/73/38/22/1087733822.db2.gz SDDXDOOTJHNAIM-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(F)cc1 ZINC000658142493 1087734980 /nfs/dbraw/zinc/73/49/80/1087734980.db2.gz ZNCFVNOYZLQGNA-XZOQPEGZSA-N 2 0 370.512 4.269 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc2ccccc21 ZINC000658143664 1087735111 /nfs/dbraw/zinc/73/51/11/1087735111.db2.gz IDZYGIRGTMQWQL-XMSQKQJNSA-N 2 0 360.501 4.257 20 0 FIADRP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658161761 1087749885 /nfs/dbraw/zinc/74/98/85/1087749885.db2.gz AKEMXKILQKCKRQ-HSZRJFAPSA-N 2 0 374.532 4.442 20 0 FIADRP Cc1cccc(C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)c1 ZINC000658163792 1087757325 /nfs/dbraw/zinc/75/73/25/1087757325.db2.gz AZOYNZORPCEZNP-XMMPIXPASA-N 2 0 363.549 4.213 20 0 FIADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164390 1087760669 /nfs/dbraw/zinc/76/06/69/1087760669.db2.gz CUPHJONXHKGQNC-HSZRJFAPSA-N 2 0 369.528 4.290 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(OC)c1 ZINC000658165274 1087762230 /nfs/dbraw/zinc/76/22/30/1087762230.db2.gz HRQKERGSQUENMM-JOCHJYFZSA-N 2 0 353.510 4.043 20 0 FIADRP C[C@@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518849 1087916747 /nfs/dbraw/zinc/91/67/47/1087916747.db2.gz LEERLPGVMBDCHA-TXQGORRRSA-N 2 0 364.574 4.130 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C[C@@H]3CCCC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424343561 1087953431 /nfs/dbraw/zinc/95/34/31/1087953431.db2.gz FTIAOXXFZRAASJ-USWKJHDZSA-N 2 0 356.554 4.082 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424375804 1087962889 /nfs/dbraw/zinc/96/28/89/1087962889.db2.gz KCFIUUBTTOLCRZ-OAHLLOKOSA-N 2 0 372.944 4.107 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000414791801 1088015422 /nfs/dbraw/zinc/01/54/22/1088015422.db2.gz RBTXQTMNUJCCPV-MRXNPFEDSA-N 2 0 370.497 4.071 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000414812618 1088225271 /nfs/dbraw/zinc/22/52/71/1088225271.db2.gz XOFSAXOAQGSOKR-OXQOHEQNSA-N 2 0 371.912 4.199 20 0 FIADRP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414815881 1088248261 /nfs/dbraw/zinc/24/82/61/1088248261.db2.gz YRPAXRGYEJEHPG-CYBMUJFWSA-N 2 0 370.447 4.077 20 0 FIADRP Clc1ccc(Cl)c(-c2csc(C[NH2+]CC[C@H]3CC[NH2+]C3)n2)c1 ZINC000414824155 1088310688 /nfs/dbraw/zinc/31/06/88/1088310688.db2.gz AIOMCUHPLDPLTI-LLVKDONJSA-N 2 0 356.322 4.206 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000467314249 1088385731 /nfs/dbraw/zinc/38/57/31/1088385731.db2.gz JXWLXQRZHVCTLL-NRFANRHFSA-N 2 0 356.485 4.453 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)C1(c2ccccc2)CCCC1 ZINC000472625955 1088491070 /nfs/dbraw/zinc/49/10/70/1088491070.db2.gz ZNGCWUCDRKFJBG-WWPVKYPJSA-N 2 0 370.581 4.244 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2Cc3ccccc3O2)CC1 ZINC000514084810 1088725276 /nfs/dbraw/zinc/72/52/76/1088725276.db2.gz RMHDYABZYXWDGG-HRTMPFAESA-N 2 0 350.506 4.023 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000514093592 1088740831 /nfs/dbraw/zinc/74/08/31/1088740831.db2.gz JTYISLIFZNNKKL-XXBNENTESA-N 2 0 367.537 4.228 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+]C3CCN(c4ccccc4)CC3)C2)cc1 ZINC000312433105 1089085653 /nfs/dbraw/zinc/08/56/53/1089085653.db2.gz AWDPONKOOCUEFQ-JOCHJYFZSA-N 2 0 363.549 4.157 20 0 FIADRP COc1cc(Br)ccc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415045456 1089089313 /nfs/dbraw/zinc/08/93/13/1089089313.db2.gz BSFRGRWZZZLJNJ-KRWDZBQOSA-N 2 0 363.299 4.028 20 0 FIADRP COc1c(Br)cccc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415044670 1089091110 /nfs/dbraw/zinc/09/11/10/1089091110.db2.gz AWAXILWYZZSCRJ-KRWDZBQOSA-N 2 0 363.299 4.028 20 0 FIADRP CCOc1ccc(C2(C[NH2+][C@H](C)C[C@@H]3CCCCC[NH2+]3)CCOCC2)cc1 ZINC000415090023 1089142075 /nfs/dbraw/zinc/14/20/75/1089142075.db2.gz OMFSSQALJRVTDX-CTNGQTDRSA-N 2 0 374.569 4.034 20 0 FIADRP CCOc1ccc(C2(C[NH2+][C@@H](C)C[C@H]3CCCCC[NH2+]3)CCOCC2)cc1 ZINC000415090039 1089142774 /nfs/dbraw/zinc/14/27/74/1089142774.db2.gz OMFSSQALJRVTDX-PZJWPPBQSA-N 2 0 374.569 4.034 20 0 FIADRP CC(C)Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cn1 ZINC000894303103 1089166787 /nfs/dbraw/zinc/16/67/87/1089166787.db2.gz YKPQLWCHHUMFGX-UHFFFAOYSA-N 2 0 367.537 4.043 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)s3)CC2)C1 ZINC000415119902 1089183219 /nfs/dbraw/zinc/18/32/19/1089183219.db2.gz FUHFNWSEDOPCCM-AZUAARDMSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000415125031 1089187725 /nfs/dbraw/zinc/18/77/25/1089187725.db2.gz KZKIVLVHOXMZTF-TZIWHRDSSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3cccc(Oc4ccccc4)c3)CC2)C1 ZINC000415127754 1089192553 /nfs/dbraw/zinc/19/25/53/1089192553.db2.gz REGKODGULOETFB-REWPJTCUSA-N 2 0 366.505 4.197 20 0 FIADRP C[NH+](C)[C@H]1CCOc2c(N[C@@H]3CCC[N@H+](Cc4ccccc4)C3)cccc21 ZINC000435023452 1089209559 /nfs/dbraw/zinc/20/95/59/1089209559.db2.gz KKONVTUCWYMUMP-KNQAVFIVSA-N 2 0 365.521 4.148 20 0 FIADRP C[NH+](C)[C@H]1CCOc2c(NC3CC[NH+](Cc4ccccc4)CC3)cccc21 ZINC000435034076 1089230903 /nfs/dbraw/zinc/23/09/03/1089230903.db2.gz LAKWOBMWRNIERO-QFIPXVFZSA-N 2 0 365.521 4.148 20 0 FIADRP C[NH+](C)C[C@H](NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000549223057 1089269248 /nfs/dbraw/zinc/26/92/48/1089269248.db2.gz UXCPCVHWMVWZEP-NRFANRHFSA-N 2 0 363.977 4.329 20 0 FIADRP C[C@@H](Cn1cccn1)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549225481 1089283499 /nfs/dbraw/zinc/28/34/99/1089283499.db2.gz NDRWILFPEZIUJX-AZQUWAFASA-N 2 0 372.944 4.129 20 0 FIADRP C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccnn1C ZINC000549235818 1089314009 /nfs/dbraw/zinc/31/40/09/1089314009.db2.gz OSSBBAZTZNPMJD-MXPIYFSTSA-N 2 0 372.944 4.338 20 0 FIADRP C[NH2+]CC1CC[NH+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000435377947 1089583052 /nfs/dbraw/zinc/58/30/52/1089583052.db2.gz BLBFEVOOFVLOOP-UHFFFAOYSA-N 2 0 371.912 4.024 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000435394163 1089601225 /nfs/dbraw/zinc/60/12/25/1089601225.db2.gz MOUPSSRKKZWKNW-HNNXBMFYSA-N 2 0 371.912 4.152 20 0 FIADRP C[C@H](CC1CCOCC1)C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435424760 1089641269 /nfs/dbraw/zinc/64/12/69/1089641269.db2.gz ALLWPVVKIBTRRC-XLIONFOSSA-N 2 0 362.583 4.145 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@H](CCO)c2ccc(Cl)c(Cl)c2)CC1 ZINC000515067271 1089753720 /nfs/dbraw/zinc/75/37/20/1089753720.db2.gz AIXTZGALKFQGAO-QGZVFWFLSA-N 2 0 359.341 4.269 20 0 FIADRP Cc1ccccc1CCC[N@H+](Cc1nccs1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435694552 1089877595 /nfs/dbraw/zinc/87/75/95/1089877595.db2.gz LWHKUSJVAWGDJQ-LJQANCHMSA-N 2 0 355.551 4.028 20 0 FIADRP O[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccc2ccccc2c1 ZINC000515235175 1089914863 /nfs/dbraw/zinc/91/48/63/1089914863.db2.gz UHQRJXXECNBDRN-DEOSSOPVSA-N 2 0 366.549 4.130 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@H]3C[C@H](c4ccccc4F)C3)sc2C1 ZINC000435784730 1089945401 /nfs/dbraw/zinc/94/54/01/1089945401.db2.gz HVSQRFRXPZKONO-SHTZXODSSA-N 2 0 359.514 4.085 20 0 FIADRP FC(F)(F)[C@@H]1CC([NH2+][C@@H]2CC[NH2+]C23CCCC3)C[C@@H](C(F)(F)F)C1 ZINC000925527629 1090270618 /nfs/dbraw/zinc/27/06/18/1090270618.db2.gz WAKSJMKUYJUCGV-GMXVVIOVSA-N 2 0 358.370 4.160 20 0 FIADRP Fc1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000363863362 1090418382 /nfs/dbraw/zinc/41/83/82/1090418382.db2.gz KQVDCPTWPUDMDJ-RBBKRZOGSA-N 2 0 360.517 4.433 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCCCC3)c2)o1 ZINC000042722180 1090983800 /nfs/dbraw/zinc/98/38/00/1090983800.db2.gz MLGJBCCSUBWAJA-UHFFFAOYSA-N 2 0 369.509 4.360 20 0 FIADRP Cc1cc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)n(C)n1 ZINC000418035826 1091033062 /nfs/dbraw/zinc/03/30/62/1091033062.db2.gz BGXDAGWGXQUZBZ-ZJVRTDGDSA-N 2 0 372.944 4.086 20 0 FIADRP CC(C)[C@H](c1ccccc1Cl)[N@H+](C)CCCN1CC[NH+](C(C)C)CC1 ZINC000500129808 1091056247 /nfs/dbraw/zinc/05/62/47/1091056247.db2.gz BRZIEETXJVXOFS-OAQYLSRUSA-N 2 0 365.993 4.385 20 0 FIADRP CC[N@H+]1CC=C(c2cnc(NCCC[NH+]3CCCC[C@H]3C)c(C)c2)CC1 ZINC001167752899 1091168240 /nfs/dbraw/zinc/16/82/40/1091168240.db2.gz ZEHNWPAIYVROPH-LJQANCHMSA-N 2 0 356.558 4.175 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCNc1cc(C[NH+](C)C)ccc1Br ZINC001167753458 1091171655 /nfs/dbraw/zinc/17/16/55/1091171655.db2.gz ITKKFCHHZWUZON-HNNXBMFYSA-N 2 0 368.363 4.187 20 0 FIADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390551006 1091244394 /nfs/dbraw/zinc/24/43/94/1091244394.db2.gz KCGCMNGZXRCDHD-PFPLVKHPSA-N 2 0 355.570 4.082 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000390685392 1091399486 /nfs/dbraw/zinc/39/94/86/1091399486.db2.gz XPVVBLFSSASETL-PGRDOPGGSA-N 2 0 352.522 4.214 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)C2CCC2)cc1 ZINC000187377450 1091879001 /nfs/dbraw/zinc/87/90/01/1091879001.db2.gz REHGVGJTALBYSB-XPWALMASSA-N 2 0 356.554 4.194 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)c1 ZINC000236668655 1092408431 /nfs/dbraw/zinc/40/84/31/1092408431.db2.gz YEMUVCNGZVYJMK-UHFFFAOYSA-N 2 0 374.912 4.241 20 0 FIADRP C[C@H]1CC([NH2+]C2CC(C)(C)N(O)C(C)(C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168014153 1092684007 /nfs/dbraw/zinc/68/40/07/1092684007.db2.gz KPYDTVPKJVJSLT-ROUUACIJSA-N 2 0 373.585 4.428 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]C3CCC(C(F)F)CC3)cc2)C[C@H](C)O1 ZINC000442723083 1092748036 /nfs/dbraw/zinc/74/80/36/1092748036.db2.gz WSWCAUXUTXCJSY-BANKROOTSA-N 2 0 366.496 4.209 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCC[C@H](C)C2)cc1)C(C)C ZINC000110175676 1092789318 /nfs/dbraw/zinc/78/93/18/1092789318.db2.gz WHKBBUGAYAPKPO-FQEVSTJZSA-N 2 0 373.585 4.159 20 0 FIADRP C[C@H](CCc1cccc(F)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000521636472 1092810913 /nfs/dbraw/zinc/81/09/13/1092810913.db2.gz NTKBTXRSIVBFIR-GOSISDBHSA-N 2 0 370.512 4.410 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000521844091 1092943301 /nfs/dbraw/zinc/94/33/01/1092943301.db2.gz LYRMMHJPFHZRKO-HXUWFJFHSA-N 2 0 374.532 4.279 20 0 FIADRP Cc1ccccc1[C@H]([C@@H](C)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000443193776 1092983618 /nfs/dbraw/zinc/98/36/18/1092983618.db2.gz NDLLPFLYWGUUIX-XXBNENTESA-N 2 0 357.586 4.373 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@@H]1C ZINC000512673413 1093120990 /nfs/dbraw/zinc/12/09/90/1093120990.db2.gz QMTNXSCQHGAOBH-PWHSHALESA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@H]1C ZINC000512673412 1093121432 /nfs/dbraw/zinc/12/14/32/1093121432.db2.gz QMTNXSCQHGAOBH-MSYCTHLASA-N 2 0 374.569 4.091 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3[C@H]3CCOC3)CC2)cc1 ZINC000474055851 1093160136 /nfs/dbraw/zinc/16/01/36/1093160136.db2.gz UAULLWJLDFENQF-RJGXRXQPSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-n3cccn3)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168018023 1093164392 /nfs/dbraw/zinc/16/43/92/1093164392.db2.gz YLYQWKPQAPNLAA-JHDGKUDLSA-N 2 0 374.532 4.404 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2(CO)CC(c3ccccc3)C2)CC1 ZINC000433076212 1093203178 /nfs/dbraw/zinc/20/31/78/1093203178.db2.gz MVDTYVBIZJTCCR-BXDDPRONSA-N 2 0 370.581 4.175 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2(CO)CC(c3ccccc3)C2)CC1 ZINC000433076214 1093203565 /nfs/dbraw/zinc/20/35/65/1093203565.db2.gz MVDTYVBIZJTCCR-LDOASJGRSA-N 2 0 370.581 4.175 20 0 FIADRP CCOC(=O)CCCCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168021511 1093241505 /nfs/dbraw/zinc/24/15/05/1093241505.db2.gz PFQULMFBUMJQAZ-CEQLMSFQSA-N 2 0 360.542 4.141 20 0 FIADRP C[C@@H]1CC(n2cc(CC[NH3+])c3c[nH+]ccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024458 1093392697 /nfs/dbraw/zinc/39/26/97/1093392697.db2.gz GYHITWIVXDWGDC-QZTJIDSGSA-N 2 0 362.521 4.152 20 0 FIADRP Cc1ncc(CNc2cccc3c2OCC[C@@H]3[NH+](C)C)n1-c1ccccc1 ZINC000433190776 1093393380 /nfs/dbraw/zinc/39/33/80/1093393380.db2.gz RRATVTJUEPUMCQ-NRFANRHFSA-N 2 0 362.477 4.178 20 0 FIADRP CC(C)n1ncc2cc(CN3CCC[C@@H](C[N@@H+]4CCCC[C@@H]4C)C3)cnc21 ZINC000113934826 1093514911 /nfs/dbraw/zinc/51/49/11/1093514911.db2.gz YNPGLJAHBBXFRH-RBUKOAKNSA-N 2 0 369.557 4.099 20 0 FIADRP COCCc1cccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168028671 1093539286 /nfs/dbraw/zinc/53/92/86/1093539286.db2.gz PZVGXRMIBJOZLX-WOJBJXKFSA-N 2 0 366.549 4.407 20 0 FIADRP COCCc1cccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168028669 1093539588 /nfs/dbraw/zinc/53/95/88/1093539588.db2.gz PZVGXRMIBJOZLX-IRJINJETSA-N 2 0 366.549 4.407 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(-c3cc[nH]n3)o2)C[N@@H+]1Cc1ccccc1 ZINC000433310822 1093565501 /nfs/dbraw/zinc/56/55/01/1093565501.db2.gz JRLAMZDTQVPBMZ-MJGOQNOKSA-N 2 0 364.493 4.060 20 0 FIADRP CCOC(=O)[C@@H]1CCC[C@H]([NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168032220 1093652744 /nfs/dbraw/zinc/65/27/44/1093652744.db2.gz GQDPZVMSRRGFPI-UKAVVXHISA-N 2 0 372.553 4.140 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000474284772 1093657684 /nfs/dbraw/zinc/65/76/84/1093657684.db2.gz SGOINXLSHMZZOW-HSZRJFAPSA-N 2 0 371.613 4.307 20 0 FIADRP C[C@@H](NCC(C)(C)C[NH+](C)C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433405913 1093672344 /nfs/dbraw/zinc/67/23/44/1093672344.db2.gz JZLNWXLYXWBGJH-AEFFLSMTSA-N 2 0 366.521 4.012 20 0 FIADRP COc1ccc2nc(C[NH2+]CC3CC[NH+](CCC(C)C)CC3)sc2c1 ZINC000474346643 1093696629 /nfs/dbraw/zinc/69/66/29/1093696629.db2.gz CLDFEHKEZUXLNI-UHFFFAOYSA-N 2 0 361.555 4.153 20 0 FIADRP C[C@H]1CC(NCc2ccc3oc(=O)[nH]c3c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168033139 1093703899 /nfs/dbraw/zinc/70/38/99/1093703899.db2.gz JWWSWNRCRLNMSX-HOTGVXAUSA-N 2 0 365.477 4.065 20 0 FIADRP C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000623866741 1093735372 /nfs/dbraw/zinc/73/53/72/1093735372.db2.gz DSIGKMYCGSYVJC-QWHCGFSZSA-N 2 0 363.855 4.006 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H]2CC[NH+](CC3CCCC3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168034085 1093738765 /nfs/dbraw/zinc/73/87/65/1093738765.db2.gz OHFUEWBGNDUZNT-KZTDQWPFSA-N 2 0 369.597 4.282 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000513078919 1093780234 /nfs/dbraw/zinc/78/02/34/1093780234.db2.gz XNNNSPANOYARGD-ILWGZMRPSA-N 2 0 369.553 4.305 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)c1ccco1 ZINC000513078776 1093780625 /nfs/dbraw/zinc/78/06/25/1093780625.db2.gz WBWGZPLONVMURT-CEWLAPEOSA-N 2 0 361.574 4.295 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2Cc3ccc(F)cc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168035086 1093792706 /nfs/dbraw/zinc/79/27/06/1093792706.db2.gz SNTIUPQRAOWIGE-SEPYTNNBSA-N 2 0 352.497 4.324 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000474473446 1093818563 /nfs/dbraw/zinc/81/85/63/1093818563.db2.gz PNWSUGOGTNYTBX-UHFFFAOYSA-N 2 0 374.532 4.456 20 0 FIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC(F)F ZINC000513365669 1094082710 /nfs/dbraw/zinc/08/27/10/1094082710.db2.gz RRCGKMQESSSOFY-GDBMZVCRSA-N 2 0 368.468 4.039 20 0 FIADRP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000513405035 1094103855 /nfs/dbraw/zinc/10/38/55/1094103855.db2.gz QSMDJSZEUWEZLP-NRFANRHFSA-N 2 0 372.459 4.217 20 0 FIADRP COCc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513487681 1094158257 /nfs/dbraw/zinc/15/82/57/1094158257.db2.gz IQOZTGBOZOPEIT-DENIHFKCSA-N 2 0 352.522 4.223 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)[NH+]2CCCC2)o1 ZINC000513490394 1094158835 /nfs/dbraw/zinc/15/88/35/1094158835.db2.gz DXAXFZRWCQFUBI-QIJUGHKUSA-N 2 0 373.585 4.358 20 0 FIADRP Cc1cccn2c(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cnc12 ZINC000513494991 1094162096 /nfs/dbraw/zinc/16/20/96/1094162096.db2.gz LCXVTFDYKCMLMS-PZJWPPBQSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1ccc2ncc(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)n2c1 ZINC000513500297 1094173047 /nfs/dbraw/zinc/17/30/47/1094173047.db2.gz LTEXZIYGTUBQON-FPOVZHCZSA-N 2 0 362.521 4.033 20 0 FIADRP CC(=O)Nc1ccccc1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513501972 1094173794 /nfs/dbraw/zinc/17/37/94/1094173794.db2.gz WEFQSXYXOKQWTE-NQIIRXRSSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000513502230 1094173862 /nfs/dbraw/zinc/17/38/62/1094173862.db2.gz YGOQPOCPQVIIEX-PZJWPPBQSA-N 2 0 374.532 4.467 20 0 FIADRP C[NH+](CCC(F)(F)F)Cc1ccc(C[N@H+](C)CCC(F)(F)F)cc1 ZINC000513652663 1094255437 /nfs/dbraw/zinc/25/54/37/1094255437.db2.gz AZBIZKZCJCGCRQ-UHFFFAOYSA-N 2 0 356.354 4.455 20 0 FIADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000513678614 1094269647 /nfs/dbraw/zinc/26/96/47/1094269647.db2.gz PVOGIMNQNKQHER-FDFHNCONSA-N 2 0 358.570 4.066 20 0 FIADRP C[C@H]1CC(NC2CC[NH+](CC3CCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168037272 1094360787 /nfs/dbraw/zinc/36/07/87/1094360787.db2.gz XHECMJQMRBQWGF-PMACEKPBSA-N 2 0 369.597 4.282 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474598668 1094394193 /nfs/dbraw/zinc/39/41/93/1094394193.db2.gz JMFPOSFWRJXFDQ-UHDSXZAQSA-N 2 0 370.990 4.373 20 0 FIADRP CC(C)c1ccc(C[C@@H]2CC[N@@H+](CCCN3CC[NH+](C(C)C)CC3)C2)cc1 ZINC000501030364 1094429927 /nfs/dbraw/zinc/42/99/27/1094429927.db2.gz UTJPGYTVRRLGKD-QHCPKHFHSA-N 2 0 371.613 4.091 20 0 FIADRP C[N@@H+](Cc1ncc(-c2cccs2)o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066581 1094478114 /nfs/dbraw/zinc/47/81/14/1094478114.db2.gz FUKFYXPQRWMGJM-UHFFFAOYSA-N 2 0 368.506 4.147 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(C(=O)OC(C)(C)C)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168040477 1094513681 /nfs/dbraw/zinc/51/36/81/1094513681.db2.gz NHNQEXXWRYRELC-OPVJXMOQSA-N 2 0 372.553 4.140 20 0 FIADRP CCc1cccc(F)c1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000474714435 1094537031 /nfs/dbraw/zinc/53/70/31/1094537031.db2.gz NVPGFYCJYCYILB-UHFFFAOYSA-N 2 0 356.485 4.153 20 0 FIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000474730289 1094546086 /nfs/dbraw/zinc/54/60/86/1094546086.db2.gz PAKGNJLDCGQJJP-MRXNPFEDSA-N 2 0 370.990 4.167 20 0 FIADRP CC(C)C[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccccc1 ZINC000474797807 1094614004 /nfs/dbraw/zinc/61/40/04/1094614004.db2.gz ABALIQAGEVXYGA-AKIFATBCSA-N 2 0 358.570 4.174 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@H](F)C(F)(F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041852 1094634565 /nfs/dbraw/zinc/63/45/65/1094634565.db2.gz WMYXXUDTHZCIJV-MDZRGWNJSA-N 2 0 354.460 4.497 20 0 FIADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C1 ZINC000474802706 1094637600 /nfs/dbraw/zinc/63/76/00/1094637600.db2.gz YXLIWOFOMBLQEF-SIKLNZKXSA-N 2 0 358.570 4.338 20 0 FIADRP C[C@@H]1C[C@@H](N2CC[NH+](C3CCCCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168042048 1094669867 /nfs/dbraw/zinc/66/98/67/1094669867.db2.gz YHAHYUCOZFHHQK-RUMRUAAYSA-N 2 0 369.597 4.378 20 0 FIADRP Cc1ccc(CCC[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000474881342 1094844943 /nfs/dbraw/zinc/84/49/43/1094844943.db2.gz VWQQKVARSJIZRM-NZQKXSOJSA-N 2 0 351.538 4.213 20 0 FIADRP [NH3+]CC[C@@H]1CCC[N@@H+]([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000420315022 1094877581 /nfs/dbraw/zinc/87/75/81/1094877581.db2.gz RKSPEYBYAUNEJJ-HTAPYJJXSA-N 2 0 361.489 4.153 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420386594 1094907151 /nfs/dbraw/zinc/90/71/51/1094907151.db2.gz VEJFNXIEBBODRF-UUWFMWQGSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000420382943 1094907353 /nfs/dbraw/zinc/90/73/53/1094907353.db2.gz PZSGATSBQDECBN-BEFAXECRSA-N 2 0 364.942 4.273 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420394246 1094910447 /nfs/dbraw/zinc/91/04/47/1094910447.db2.gz RNBKUGOAESANCE-HNJNHCNJSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420397674 1094912090 /nfs/dbraw/zinc/91/20/90/1094912090.db2.gz XUTFNQAXFMYDPN-DWQUBVKVSA-N 2 0 357.325 4.273 20 0 FIADRP COc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)cc1 ZINC000501771577 1094915470 /nfs/dbraw/zinc/91/54/70/1094915470.db2.gz BZDOEQUOXOANKA-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP CCOC(=O)CC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168045051 1095025673 /nfs/dbraw/zinc/02/56/73/1095025673.db2.gz ILSCDGHXGMHMFW-OALUTQOASA-N 2 0 372.553 4.093 20 0 FIADRP C[C@H]1CC([NH+]2CCC(OC3CCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168046564 1095203598 /nfs/dbraw/zinc/20/35/98/1095203598.db2.gz OBZDRYGYSOZWJD-OALUTQOASA-N 2 0 356.554 4.462 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000502239936 1095244288 /nfs/dbraw/zinc/24/42/88/1095244288.db2.gz DHRBFIONTKHNOR-IBGZPJMESA-N 2 0 362.558 4.045 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000502254652 1095273449 /nfs/dbraw/zinc/27/34/49/1095273449.db2.gz NVPPJGPGUNJRRB-KNQAVFIVSA-N 2 0 356.554 4.500 20 0 FIADRP Clc1ccc2c(c1)OCCC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000421344739 1095537218 /nfs/dbraw/zinc/53/72/18/1095537218.db2.gz UPUOLIRZWNSBJB-IBGZPJMESA-N 2 0 357.885 4.207 20 0 FIADRP c1nn(C2CCCC2)c(-c2ccccc2)c1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000421334781 1095547709 /nfs/dbraw/zinc/54/77/09/1095547709.db2.gz QSIYEFWQHGUJOH-GOSISDBHSA-N 2 0 364.537 4.239 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]C[C@@H]4CC45CCSCC5)[C@H]3C2)cc1 ZINC000421384112 1095587294 /nfs/dbraw/zinc/58/72/94/1095587294.db2.gz OWHBYWHNGQTVFA-TUFLPTIASA-N 2 0 356.579 4.020 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cnn(C2CCCC2)c1 ZINC000502699932 1095724403 /nfs/dbraw/zinc/72/44/03/1095724403.db2.gz OERHFLDYVQPBOJ-SFHVURJKSA-N 2 0 370.541 4.180 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)nn1C ZINC000502705942 1095731567 /nfs/dbraw/zinc/73/15/67/1095731567.db2.gz CYENLMROSKWJLH-HXUWFJFHSA-N 2 0 368.569 4.114 20 0 FIADRP C[C@@H]1CC(N2CC[NH+](CC3CCCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053023 1095921560 /nfs/dbraw/zinc/92/15/60/1095921560.db2.gz LXDCLIPMIGPARO-NHCUHLMSSA-N 2 0 369.597 4.236 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421821989 1095934497 /nfs/dbraw/zinc/93/44/97/1095934497.db2.gz VEWAXZXXRVHYNI-JOCHJYFZSA-N 2 0 372.484 4.016 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C2CC2)c(F)c1 ZINC000421819223 1095952476 /nfs/dbraw/zinc/95/24/76/1095952476.db2.gz FVLHTVLVQSZAMD-QFIPXVFZSA-N 2 0 372.484 4.016 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)c(F)c1 ZINC000421841036 1095964780 /nfs/dbraw/zinc/96/47/80/1095964780.db2.gz HYRGDVMNGVJWFR-QFIPXVFZSA-N 2 0 369.484 4.187 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)c1OC ZINC000513759855 1095966090 /nfs/dbraw/zinc/96/60/90/1095966090.db2.gz HIJMXKVIEKENQP-SFHVURJKSA-N 2 0 368.521 4.459 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000421870696 1095980583 /nfs/dbraw/zinc/98/05/83/1095980583.db2.gz FIBRHNWQTSIBSB-VMBOVVBDSA-N 2 0 367.331 4.125 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CC24CCSCC4)C3)cc1 ZINC000421872270 1095980749 /nfs/dbraw/zinc/98/07/49/1095980749.db2.gz GNLOTSVIFWUHJK-BURNTYAHSA-N 2 0 356.579 4.305 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000503074294 1096052924 /nfs/dbraw/zinc/05/29/24/1096052924.db2.gz QJOPOUFOBPDRHL-ICSRJNTNSA-N 2 0 374.573 4.246 20 0 FIADRP CC(C[NH+](C)C[C@@H](C)c1nccs1)C[N@H+](C)C[C@@H](C)c1nccs1 ZINC000273087630 1096232468 /nfs/dbraw/zinc/23/24/68/1096232468.db2.gz SBTZFADDVNQVQG-HZPDHXFCSA-N 2 0 366.600 4.007 20 0 FIADRP COCC[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503428738 1096395524 /nfs/dbraw/zinc/39/55/24/1096395524.db2.gz HWXRJOBXUYDVNE-CTNGQTDRSA-N 2 0 353.510 4.177 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000414669329 1096397471 /nfs/dbraw/zinc/39/74/71/1096397471.db2.gz ZSWYVLHXHAIUND-AVRDEDQJSA-N 2 0 360.505 4.017 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C(C)(C)c1ccccc1 ZINC000422703569 1096458311 /nfs/dbraw/zinc/45/83/11/1096458311.db2.gz IDIWDYDPHABNNX-NYDSKATKSA-N 2 0 350.506 4.198 20 0 FIADRP CCc1cc(OC)ccc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000503559219 1096473922 /nfs/dbraw/zinc/47/39/22/1096473922.db2.gz DBCHFHSIZRYIHH-UHFFFAOYSA-N 2 0 353.510 4.001 20 0 FIADRP CC[C@@H]1C[C@@H](C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000503581068 1096475057 /nfs/dbraw/zinc/47/50/57/1096475057.db2.gz IWODGEWXWAAZHL-FCHUYYIVSA-N 2 0 358.570 4.474 20 0 FIADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCCSc1ccccc1Br ZINC000422759086 1096475322 /nfs/dbraw/zinc/47/53/22/1096475322.db2.gz OVAJGZATPZWIQC-UKRRQHHQSA-N 2 0 357.361 4.038 20 0 FIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000422753820 1096483995 /nfs/dbraw/zinc/48/39/95/1096483995.db2.gz GNTUHJLBBAIIOE-ZWKOTPCHSA-N 2 0 370.459 4.003 20 0 FIADRP c1cc(Oc2ccccc2)oc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000503585971 1096485169 /nfs/dbraw/zinc/48/51/69/1096485169.db2.gz HAHANLKZCWHHJB-UHFFFAOYSA-N 2 0 363.461 4.473 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(OC)cc2)cc1 ZINC000422769706 1096486396 /nfs/dbraw/zinc/48/63/96/1096486396.db2.gz PDKJJJCCOOFFLH-PXLSRWGNSA-N 2 0 368.521 4.095 20 0 FIADRP FC(F)(F)c1ccccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422776066 1096488894 /nfs/dbraw/zinc/48/88/94/1096488894.db2.gz CBDHJEJFHPHNTB-PKOBYXMFSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784643 1096489945 /nfs/dbraw/zinc/48/99/45/1096489945.db2.gz PZPNAWXPFUUQDD-ODOSVJCGSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422783435 1096490312 /nfs/dbraw/zinc/49/03/12/1096490312.db2.gz HKBDOLRQBPOIPH-CYBMUJFWSA-N 2 0 353.388 4.110 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422795383 1096492105 /nfs/dbraw/zinc/49/21/05/1096492105.db2.gz HLVNUWKFUDIKAF-PKOBYXMFSA-N 2 0 362.395 4.051 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)s2)cs1 ZINC000422793558 1096492582 /nfs/dbraw/zinc/49/25/82/1096492582.db2.gz FTFLVEHNKPVNBW-GFCCVEGCSA-N 2 0 372.563 4.235 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)c(Cl)c1 ZINC000422831893 1096501901 /nfs/dbraw/zinc/50/19/01/1096501901.db2.gz FLSBEFUFSSFPCA-BMGDILEWSA-N 2 0 371.352 4.018 20 0 FIADRP COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)c(C)c2c1 ZINC000422855004 1096505835 /nfs/dbraw/zinc/50/58/35/1096505835.db2.gz BRVHELWRBWOSQM-DZGCQCFKSA-N 2 0 353.466 4.324 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(OC(F)F)c1 ZINC000422876605 1096509892 /nfs/dbraw/zinc/50/98/92/1096509892.db2.gz GMTRUSIWBWJSRR-XQAUZQBESA-N 2 0 374.431 4.195 20 0 FIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422879457 1096511419 /nfs/dbraw/zinc/51/14/19/1096511419.db2.gz KNIWLESRRUCGLG-JWNTYJGQSA-N 2 0 366.505 4.380 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000422886584 1096514440 /nfs/dbraw/zinc/51/44/40/1096514440.db2.gz XCCPQPFGSMQNBW-ZWKOTPCHSA-N 3 0 366.553 4.074 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+][C@@H]1CCSc2ccccc21 ZINC000422870412 1096515849 /nfs/dbraw/zinc/51/58/49/1096515849.db2.gz YSZFIUZWADCLBP-LVCYWYKZSA-N 2 0 352.503 4.069 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+][C@@H]1CCSc2ccccc21 ZINC000422870411 1096516010 /nfs/dbraw/zinc/51/60/10/1096516010.db2.gz YSZFIUZWADCLBP-DBXWQHBBSA-N 2 0 352.503 4.069 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+][C@H]1CCSc2ccccc21 ZINC000422870410 1096516494 /nfs/dbraw/zinc/51/64/94/1096516494.db2.gz YSZFIUZWADCLBP-BBTUJRGHSA-N 2 0 352.503 4.069 20 0 FIADRP Cc1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(OC(C)C)c1 ZINC000422872337 1096517240 /nfs/dbraw/zinc/51/72/40/1096517240.db2.gz GQYOIQGMPLYMFM-REWPJTCUSA-N 2 0 366.505 4.128 20 0 FIADRP COc1ccc(C2(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)CCCCC2)cc1 ZINC000422898773 1096519679 /nfs/dbraw/zinc/51/96/79/1096519679.db2.gz FWSYOSASCZUOSI-QGZVFWFLSA-N 2 0 367.537 4.410 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCS2 ZINC000422911739 1096522455 /nfs/dbraw/zinc/52/24/55/1096522455.db2.gz LHHZOEPJRGUAKP-DBXWQHBBSA-N 2 0 370.493 4.208 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000422911479 1096522938 /nfs/dbraw/zinc/52/29/38/1096522938.db2.gz SXZOBTWVOXELAR-ZDUSSCGKSA-N 2 0 365.443 4.496 20 0 FIADRP Cc1sc(CC[NH2+][C@H](Cc2ccccc2)[C@@H](C)[NH3+])nc1-c1ccccc1 ZINC000422927542 1096527353 /nfs/dbraw/zinc/52/73/53/1096527353.db2.gz GQWYIYNTFAWMLB-OXQOHEQNSA-N 2 0 365.546 4.209 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000422992370 1096541170 /nfs/dbraw/zinc/54/11/70/1096541170.db2.gz PVXUKBIVRCZFOY-BBRMVZONSA-N 2 0 352.931 4.473 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cnccc1N ZINC000422970391 1096542390 /nfs/dbraw/zinc/54/23/90/1096542390.db2.gz WIMPBEWYWARDPY-KRWDZBQOSA-N 2 0 360.505 4.074 20 0 FIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)OC(C)C ZINC000423047331 1096553001 /nfs/dbraw/zinc/55/30/01/1096553001.db2.gz GCYXKLXWKZRVBT-RQGSJKACSA-N 2 0 360.542 4.062 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC000423040780 1096557031 /nfs/dbraw/zinc/55/70/31/1096557031.db2.gz HXTLVNRMPHKMRG-CHWSQXEVSA-N 2 0 351.416 4.149 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccc(C(F)(F)F)cc1 ZINC000423066827 1096561632 /nfs/dbraw/zinc/56/16/32/1096561632.db2.gz FKGISMPIBNHSLJ-CYBMUJFWSA-N 2 0 365.443 4.496 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000423067339 1096561806 /nfs/dbraw/zinc/56/18/06/1096561806.db2.gz ZBKMXSLROZGUFB-AWEZNQCLSA-N 2 0 359.464 4.290 20 0 FIADRP CCCOc1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000423066300 1096562235 /nfs/dbraw/zinc/56/22/35/1096562235.db2.gz DKISOPDDMPOEMF-JTHBVZDNSA-N 2 0 366.505 4.129 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089872 1096571430 /nfs/dbraw/zinc/57/14/30/1096571430.db2.gz WETDCLKTZGYCIL-KCZVDYSFSA-N 2 0 352.453 4.049 20 0 FIADRP CCc1nc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)ccc2n1C1CC1 ZINC000423116903 1096578114 /nfs/dbraw/zinc/57/81/14/1096578114.db2.gz RZTQGTVLSKMCAV-SLFFLAALSA-N 2 0 366.553 4.334 20 0 FIADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423119775 1096579245 /nfs/dbraw/zinc/57/92/45/1096579245.db2.gz DQXBFCXEIGBPNF-USBNGQNGSA-N 2 0 350.304 4.023 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000423106738 1096583712 /nfs/dbraw/zinc/58/37/12/1096583712.db2.gz OZDJNDPUQLCTNR-KDOFPFPSSA-N 2 0 358.448 4.280 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000423133188 1096590850 /nfs/dbraw/zinc/59/08/50/1096590850.db2.gz VRTVWVDRTPFVSV-UZUQRXQVSA-N 2 0 368.569 4.001 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000423139898 1096595159 /nfs/dbraw/zinc/59/51/59/1096595159.db2.gz WUECVEIMAVVRAA-UGSOOPFHSA-N 2 0 351.416 4.236 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc12 ZINC000423169032 1096601003 /nfs/dbraw/zinc/60/10/03/1096601003.db2.gz IOXHKYVOQWBESD-VWNXMTODSA-N 2 0 358.485 4.494 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000503950479 1096603290 /nfs/dbraw/zinc/60/32/90/1096603290.db2.gz UHFIVSARMDGUJI-USYVTKNRSA-N 2 0 364.480 4.037 20 0 FIADRP C[NH2+]CCC[NH2+][C@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423204068 1096615986 /nfs/dbraw/zinc/61/59/86/1096615986.db2.gz UGDVQPSVPXUQTP-LLVKDONJSA-N 2 0 368.344 4.141 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]C2CCC([NH3+])CC2)nc1 ZINC000423234072 1096616882 /nfs/dbraw/zinc/61/68/82/1096616882.db2.gz PASPIWAWLFENOO-QETWGEEDSA-N 2 0 371.956 4.311 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1OC ZINC000423239573 1096618169 /nfs/dbraw/zinc/61/81/69/1096618169.db2.gz BJKVOEUTDVMGFE-QVKFZJNVSA-N 2 0 374.912 4.036 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)[C@@H]1CCC[NH2+]C1 ZINC000423221827 1096621505 /nfs/dbraw/zinc/62/15/05/1096621505.db2.gz YIDQPQNIDFQYGO-VBQJREDUSA-N 2 0 359.514 4.304 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccc(F)c(F)c2)c1 ZINC000423254781 1096631587 /nfs/dbraw/zinc/63/15/87/1096631587.db2.gz ZJWGRDYDWKSCRZ-XOBRGWDASA-N 2 0 362.489 4.365 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)NCC(C)(C)[NH3+] ZINC000423287019 1096635230 /nfs/dbraw/zinc/63/52/30/1096635230.db2.gz JWYAPJYTTOHJHJ-SNVBAGLBSA-N 2 0 368.344 4.269 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]C[C@H]([NH3+])C(C)C)nc1 ZINC000423269470 1096637912 /nfs/dbraw/zinc/63/79/12/1096637912.db2.gz HHVOVUYLPYWBLE-RTWAWAEBSA-N 2 0 359.945 4.024 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423316450 1096642411 /nfs/dbraw/zinc/64/24/11/1096642411.db2.gz BOCXMWASDVOOBC-KRWDZBQOSA-N 2 0 351.263 4.006 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423295941 1096644284 /nfs/dbraw/zinc/64/42/84/1096644284.db2.gz XXQBIBLDAVIURI-GAJHUEQPSA-N 2 0 361.489 4.184 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423295962 1096644815 /nfs/dbraw/zinc/64/48/15/1096644815.db2.gz XXQBIBLDAVIURI-UZUQRXQVSA-N 2 0 361.489 4.184 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)CCC3)cc1 ZINC000423344801 1096646756 /nfs/dbraw/zinc/64/67/56/1096646756.db2.gz YEAULUVWWBUYPG-DYESRHJHSA-N 2 0 371.550 4.175 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cc1 ZINC000423341459 1096650912 /nfs/dbraw/zinc/65/09/12/1096650912.db2.gz UMUUJEXIACWEBD-DLBZAZTESA-N 2 0 351.494 4.191 20 0 FIADRP C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423339594 1096651065 /nfs/dbraw/zinc/65/10/65/1096651065.db2.gz IYPOWVWGVJQZJP-DFWAIWNTSA-N 2 0 366.549 4.126 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000423353866 1096653974 /nfs/dbraw/zinc/65/39/74/1096653974.db2.gz FBGLKHSUJNGHNP-QGZVFWFLSA-N 2 0 351.494 4.335 20 0 FIADRP Brc1cccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423356366 1096655353 /nfs/dbraw/zinc/65/53/53/1096655353.db2.gz QNBWUXGXHXFTPJ-IBGZPJMESA-N 2 0 357.295 4.048 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)CCC3)cc1 ZINC000423424082 1096670316 /nfs/dbraw/zinc/67/03/16/1096670316.db2.gz CKNTYAGYWUOQLI-YQVWRLOYSA-N 2 0 353.535 4.165 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)nc1 ZINC000423406258 1096673335 /nfs/dbraw/zinc/67/33/35/1096673335.db2.gz UMYLPTRRAHIGLJ-WQTXXOFMSA-N 2 0 371.956 4.039 20 0 FIADRP COCC1(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)CC[NH2+]CC1 ZINC000423410593 1096674787 /nfs/dbraw/zinc/67/47/87/1096674787.db2.gz SFCCWHBISOLRNO-QGZVFWFLSA-N 2 0 358.448 4.008 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccco2)cc1 ZINC000423470847 1096692771 /nfs/dbraw/zinc/69/27/71/1096692771.db2.gz DMKGCVHBEAZBEA-SJLPKXTDSA-N 2 0 363.299 4.253 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCSc3ccc(Br)cc32)C1 ZINC000423469717 1096693252 /nfs/dbraw/zinc/69/32/52/1096693252.db2.gz VPJYACFZKMDBGO-KYOSRNDESA-N 2 0 355.345 4.093 20 0 FIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423471309 1096694160 /nfs/dbraw/zinc/69/41/60/1096694160.db2.gz FAQOMAMDXURKLH-NEPJUHHUSA-N 2 0 364.383 4.072 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)ccc1F ZINC000423473846 1096695696 /nfs/dbraw/zinc/69/56/96/1096695696.db2.gz OLAPYVWSPPTANO-DKSSEZFCSA-N 2 0 360.448 4.017 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCC2 ZINC000423474382 1096695904 /nfs/dbraw/zinc/69/59/04/1096695904.db2.gz HGSOLRUVZUVSPJ-RHSMWYFYSA-N 2 0 359.514 4.448 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c2ccc(OC)cc2)cc1 ZINC000423479173 1096698492 /nfs/dbraw/zinc/69/84/92/1096698492.db2.gz UMMLOAPFFAHKQL-LEDOBFOHSA-N 2 0 368.521 4.095 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2ccc(F)cc2)CC1 ZINC000423503288 1096700868 /nfs/dbraw/zinc/70/08/68/1096700868.db2.gz KJANFJMGLXOBAL-COPCDDAFSA-N 3 0 361.549 4.096 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423483490 1096703247 /nfs/dbraw/zinc/70/32/47/1096703247.db2.gz QBNQWTBEYMSBDU-YOEHRIQHSA-N 2 0 355.295 4.161 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000423493364 1096706973 /nfs/dbraw/zinc/70/69/73/1096706973.db2.gz BHQHDDSIPYGTCE-RISOHXOYSA-N 2 0 362.489 4.493 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000423525189 1096712967 /nfs/dbraw/zinc/71/29/67/1096712967.db2.gz KCPGPCLOIPKQNX-XLIONFOSSA-N 2 0 369.578 4.270 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423524513 1096713170 /nfs/dbraw/zinc/71/31/70/1096713170.db2.gz XHLPQCNRVMYRKU-YLJYHZDGSA-N 2 0 356.510 4.013 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1OCc1ccccc1 ZINC000423538714 1096715496 /nfs/dbraw/zinc/71/54/96/1096715496.db2.gz GYZJDXMSOJPNQZ-MJUUVYJYSA-N 2 0 350.506 4.304 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423551857 1096720322 /nfs/dbraw/zinc/72/03/22/1096720322.db2.gz UKWUEWYCHUQTEF-OBZJAWTPSA-N 2 0 359.514 4.296 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)cn2)nc1 ZINC000425425764 1098591253 /nfs/dbraw/zinc/59/12/53/1098591253.db2.gz UVSGNWWEJKVLQQ-UHFFFAOYSA-N 2 0 364.537 4.232 20 0 FIADRP Cc1ncsc1CN(C[C@@H]1CC[NH2+]C1)[C@H](C)c1ccc(F)c(Cl)c1 ZINC000436056241 1098682082 /nfs/dbraw/zinc/68/20/82/1098682082.db2.gz SHVRXDGYWQIURJ-ZIAGYGMSSA-N 2 0 367.921 4.417 20 0 FIADRP Cc1ncsc1C[N@H+](CCCc1ccc(Cl)cc1)C[C@@H]1CC[NH2+]C1 ZINC000436058809 1098685489 /nfs/dbraw/zinc/68/54/89/1098685489.db2.gz ZPUZTAIOIJWUCQ-QGZVFWFLSA-N 2 0 363.958 4.149 20 0 FIADRP FC(F)(F)Oc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533075802 1098741850 /nfs/dbraw/zinc/74/18/50/1098741850.db2.gz PMTGKRHOBWOHTA-YJBOKZPZSA-N 2 0 354.416 4.034 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000436272318 1098898597 /nfs/dbraw/zinc/89/85/97/1098898597.db2.gz GJMXDWLUGYEWNZ-UHFFFAOYSA-N 2 0 366.534 4.140 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)cc1OC ZINC000436296604 1098909805 /nfs/dbraw/zinc/90/98/05/1098909805.db2.gz VFUZGRDKELLIDE-FXAWDEMLSA-N 2 0 360.542 4.022 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(N2CC[NH+](C)CC2)cc1C ZINC001211993728 1099144333 /nfs/dbraw/zinc/14/43/33/1099144333.db2.gz CKEYTAISRFZHFB-UHFFFAOYSA-N 2 0 366.553 4.332 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC001211994322 1099158432 /nfs/dbraw/zinc/15/84/32/1099158432.db2.gz SVOYEBDOUPTKRE-UHFFFAOYSA-N 2 0 366.553 4.019 20 0 FIADRP CCCCOc1ccc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459387025 1099330619 /nfs/dbraw/zinc/33/06/19/1099330619.db2.gz IQZFPCRRGMETCY-UHFFFAOYSA-N 2 0 353.510 4.062 20 0 FIADRP COc1cc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)ccc1OC(C)C ZINC000459388602 1099348083 /nfs/dbraw/zinc/34/80/83/1099348083.db2.gz LVUHQJIOEPDPLC-KRWDZBQOSA-N 2 0 369.509 4.197 20 0 FIADRP COc1ccc2c(c1)[C@@H]([N@@H+](Cc1ccccc1)CC1CC[NH2+]CC1)CCO2 ZINC000261678640 1099637356 /nfs/dbraw/zinc/63/73/56/1099637356.db2.gz IDQBNMCQRXEYNV-QFIPXVFZSA-N 2 0 366.505 4.021 20 0 FIADRP C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000079492325 1099757552 /nfs/dbraw/zinc/75/75/52/1099757552.db2.gz ZPSUGKQKTDOHDH-CQSZACIVSA-N 2 0 362.905 4.115 20 0 FIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000162497653 1099811870 /nfs/dbraw/zinc/81/18/70/1099811870.db2.gz URKPEPRFDHYEPR-OAHLLOKOSA-N 2 0 361.555 4.366 20 0 FIADRP CC[C@]1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)OCCc2ccccc21 ZINC000516818774 1099828180 /nfs/dbraw/zinc/82/81/80/1099828180.db2.gz AAULWICWLQYNNS-HSZRJFAPSA-N 2 0 356.554 4.251 20 0 FIADRP Cc1csc(CCCC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000508698585 1099830718 /nfs/dbraw/zinc/83/07/18/1099830718.db2.gz PFBMYGOQBZXOLX-QUCCMNQESA-N 2 0 357.567 4.274 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508697993 1099831808 /nfs/dbraw/zinc/83/18/08/1099831808.db2.gz KPYCSKMQAGRMIZ-FUDKSRODSA-N 3 0 357.586 4.141 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2ccsc2S1 ZINC000162554626 1099842721 /nfs/dbraw/zinc/84/27/21/1099842721.db2.gz KSZBXVJAFUZOPE-KSSFIOAISA-N 2 0 362.564 4.404 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(-n2ccnc2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703638 1099856619 /nfs/dbraw/zinc/85/66/19/1099856619.db2.gz ZEWFWECILGOBCE-MIZPHKNDSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508702249 1099857045 /nfs/dbraw/zinc/85/70/45/1099857045.db2.gz VZBCVXKACOATEQ-JTOYRKQZSA-N 3 0 371.613 4.245 20 0 FIADRP C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710629 1099894961 /nfs/dbraw/zinc/89/49/61/1099894961.db2.gz NAZDZNSHSMPOJW-UYAOXDASSA-N 2 0 352.497 4.358 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(OC(F)F)cc1 ZINC000162586229 1099900482 /nfs/dbraw/zinc/90/04/82/1099900482.db2.gz SFJCSDNEAPXJGK-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711709 1099902852 /nfs/dbraw/zinc/90/28/52/1099902852.db2.gz OZVDSXUEROQNBC-SXWKCWPCSA-N 2 0 366.549 4.374 20 0 FIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000162587767 1099902952 /nfs/dbraw/zinc/90/29/52/1099902952.db2.gz PIMSEUDESQUXHM-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP COc1cc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508717881 1099908326 /nfs/dbraw/zinc/90/83/26/1099908326.db2.gz MQRAWUKTVMYHBN-DENIHFKCSA-N 2 0 352.522 4.046 20 0 FIADRP C[C@H](NC1CC[NH+](CC2CCCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508716217 1099913206 /nfs/dbraw/zinc/91/32/06/1099913206.db2.gz KIZRRCNBGQWJAJ-NZQKXSOJSA-N 2 0 369.597 4.141 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000536652506 1100104811 /nfs/dbraw/zinc/10/48/11/1100104811.db2.gz SSUBOEKXVKNWOE-UHFFFAOYSA-N 2 0 374.960 4.386 20 0 FIADRP COc1ccccc1[C@H](CC(C)C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434319 1100172675 /nfs/dbraw/zinc/17/26/75/1100172675.db2.gz UJEBLKRZVJOOBD-NRFANRHFSA-N 2 0 353.510 4.436 20 0 FIADRP CC[C@@H](CSc1ccc(C)c(C)c1)[NH2+]Cc1cc(C2CC[NH2+]CC2)no1 ZINC000425894018 1100185110 /nfs/dbraw/zinc/18/51/10/1100185110.db2.gz FOFPDAINXSXDPO-SFHVURJKSA-N 2 0 373.566 4.419 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc(Cl)c1O ZINC000459462306 1100206519 /nfs/dbraw/zinc/20/65/19/1100206519.db2.gz KUFXOCMCFVMZIA-HOCLYGCPSA-N 2 0 366.933 4.187 20 0 FIADRP C[C@@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000459502215 1100241085 /nfs/dbraw/zinc/24/10/85/1100241085.db2.gz DVBZJPLJDJAQEK-HNNXBMFYSA-N 2 0 363.427 4.463 20 0 FIADRP Cn1nccc1[C@@H]1CCC[C@H]([NH2+]CC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000517278540 1100251695 /nfs/dbraw/zinc/25/16/95/1100251695.db2.gz JDEOECAOSDAXMD-UXHICEINSA-N 2 0 358.574 4.225 20 0 FIADRP Cn1nccc1[C@@H]1CCC[C@@H]([NH2+]CC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000517278542 1100253228 /nfs/dbraw/zinc/25/32/28/1100253228.db2.gz JDEOECAOSDAXMD-WOJBJXKFSA-N 2 0 358.574 4.225 20 0 FIADRP COCCCC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459528525 1100278848 /nfs/dbraw/zinc/27/88/48/1100278848.db2.gz NLYVKPRDLMTNEW-QFIPXVFZSA-N 2 0 353.510 4.198 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[NH2+]CC2)ccc1OCc1ccc(Cl)cc1 ZINC000666856618 1100297405 /nfs/dbraw/zinc/29/74/05/1100297405.db2.gz UQOOCQBERYLHPV-LJQANCHMSA-N 2 0 374.912 4.159 20 0 FIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc(C)ccc1OC ZINC000536825974 1100341933 /nfs/dbraw/zinc/34/19/33/1100341933.db2.gz JNQZXDYAMWOQDI-OAQYLSRUSA-N 2 0 353.510 4.356 20 0 FIADRP CCN1CCC[C@@H](C[N@H+](C)C[C@@H](C)c2ccc(F)cc2)[C@@H]1c1cnn(C)c1 ZINC000437982456 1100347562 /nfs/dbraw/zinc/34/75/62/1100347562.db2.gz ZGCPFGOYZLHZQO-ZWCUEREDSA-N 2 0 372.532 4.068 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000536876107 1100398084 /nfs/dbraw/zinc/39/80/84/1100398084.db2.gz LGUGFNDEQPRUMF-AUSIDOKSSA-N 2 0 352.522 4.128 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2Cl)[C@H](C)C1 ZINC000536875013 1100398310 /nfs/dbraw/zinc/39/83/10/1100398310.db2.gz GPVBCVYDKCMWIM-QAPCUYQASA-N 2 0 373.368 4.263 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000536878965 1100403784 /nfs/dbraw/zinc/40/37/84/1100403784.db2.gz WSYVLDZDAZSGPA-LJQANCHMSA-N 2 0 357.567 4.310 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000425951559 1100446050 /nfs/dbraw/zinc/44/60/50/1100446050.db2.gz QCXJNKYFOYGXPS-ACRUOGEOSA-N 2 0 355.913 4.235 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]CC2=Cc3ccccc3OC2)C1 ZINC000517537484 1100473732 /nfs/dbraw/zinc/47/37/32/1100473732.db2.gz UFDUAFUOTHVDJW-IBGZPJMESA-N 2 0 362.517 4.484 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000517547064 1100489442 /nfs/dbraw/zinc/48/94/42/1100489442.db2.gz FJVKQNOFHHSYPB-FQEVSTJZSA-N 2 0 362.521 4.236 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cc(C)ccc2C)CC1 ZINC000517547517 1100490176 /nfs/dbraw/zinc/49/01/76/1100490176.db2.gz XXHRVOOOPDJVGS-LJQANCHMSA-N 2 0 369.528 4.435 20 0 FIADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000517783748 1100651925 /nfs/dbraw/zinc/65/19/25/1100651925.db2.gz XTIGOAFGUHKDKF-SFHVURJKSA-N 2 0 373.566 4.136 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426031405 1100682452 /nfs/dbraw/zinc/68/24/52/1100682452.db2.gz RSTBAUQQBMLUJQ-NJDAHSKKSA-N 2 0 357.929 4.481 20 0 FIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414932712 1100695210 /nfs/dbraw/zinc/69/52/10/1100695210.db2.gz DESFIFFQVGKRAE-RDTXWAMCSA-N 2 0 360.933 4.046 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)C2 ZINC000426034473 1100700918 /nfs/dbraw/zinc/70/09/18/1100700918.db2.gz FXIPIHPIWYYQGY-KBWCOIMZSA-N 2 0 356.554 4.185 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414946990 1100904259 /nfs/dbraw/zinc/90/42/59/1100904259.db2.gz KFAHSURLPVIFRG-AZUAARDMSA-N 2 0 360.505 4.078 20 0 FIADRP COc1cc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)ccc1OCc1ccc(F)cc1 ZINC000414975588 1101088766 /nfs/dbraw/zinc/08/87/66/1101088766.db2.gz OUYIKZRYSDXSEQ-HXUWFJFHSA-N 2 0 372.484 4.035 20 0 FIADRP C[C@@H](C[NH2+][C@H](c1ccc(Br)s1)C1CC1)C[NH+]1CCCC1 ZINC000439133815 1101190013 /nfs/dbraw/zinc/19/00/13/1101190013.db2.gz SWOZVBKONYIFCD-LRDDRELGSA-N 2 0 357.361 4.283 20 0 FIADRP CC(C)c1nnc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000426304585 1101237374 /nfs/dbraw/zinc/23/73/74/1101237374.db2.gz DFFUNPHCFJYNOG-UHFFFAOYSA-N 2 0 372.582 4.237 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc(F)cc1 ZINC000414991368 1101291292 /nfs/dbraw/zinc/29/12/92/1101291292.db2.gz BBOYVOCWRISYLV-YLJYHZDGSA-N 2 0 372.484 4.020 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1OCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000426342647 1101316150 /nfs/dbraw/zinc/31/61/50/1101316150.db2.gz MUULIVRPXLEGQR-QYWGDWMGSA-N 2 0 374.550 4.042 20 0 FIADRP Clc1cnc2oc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)cc2c1 ZINC000648434932 1101332911 /nfs/dbraw/zinc/33/29/11/1101332911.db2.gz CUCDSKZFAYERMF-UHFFFAOYSA-N 2 0 369.896 4.483 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)C1 ZINC000537014668 1101396453 /nfs/dbraw/zinc/39/64/53/1101396453.db2.gz WJARBFWHJIKNLO-OXQOHEQNSA-N 2 0 359.514 4.188 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]Cc3cccc(-c4ccncc4)c3)C2)cc1 ZINC000439476548 1101476965 /nfs/dbraw/zinc/47/69/65/1101476965.db2.gz QWOPOOSIHVGWAL-QHCPKHFHSA-N 2 0 371.528 4.403 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)C1 ZINC000518750249 1101502297 /nfs/dbraw/zinc/50/22/97/1101502297.db2.gz LLVMNOCMQQRPLM-GOSISDBHSA-N 2 0 352.526 4.097 20 0 FIADRP CC[N@@H+](Cc1ccc(OCc2cccs2)c(OC)c1)CC1CC[NH2+]CC1 ZINC000178956001 1101540600 /nfs/dbraw/zinc/54/06/00/1101540600.db2.gz GTWNEOCJTXMUPG-UHFFFAOYSA-N 2 0 374.550 4.157 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCc3cc(F)ccc31)c1ccccc1O2 ZINC000537190023 1101540926 /nfs/dbraw/zinc/54/09/26/1101540926.db2.gz OFRYIDNGDILHQC-LEWJYISDSA-N 2 0 366.480 4.391 20 0 FIADRP C[N@H+](CC1CC1)C[C@@H]1CCN(Cc2c(Cl)cccc2N2CCCC2)C1 ZINC000537203396 1101557688 /nfs/dbraw/zinc/55/76/88/1101557688.db2.gz ZTXDACVAZIXEOF-SFHVURJKSA-N 2 0 361.961 4.104 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1 ZINC000537292252 1101611703 /nfs/dbraw/zinc/61/17/03/1101611703.db2.gz HGFGVTLLGMFWAI-UXHICEINSA-N 2 0 350.522 4.130 20 0 FIADRP CC(C)(C)C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1 ZINC000537292256 1101613157 /nfs/dbraw/zinc/61/31/57/1101613157.db2.gz HGFGVTLLGMFWAI-WOJBJXKFSA-N 2 0 350.522 4.130 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccccc2F)CC1 ZINC001168166595 1101781340 /nfs/dbraw/zinc/78/13/40/1101781340.db2.gz JXFMXVZITFAGIF-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168167701 1101818899 /nfs/dbraw/zinc/81/88/99/1101818899.db2.gz NWHCFFDKQSOTAW-SNRMKQJTSA-N 2 0 350.934 4.022 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC)c(OC)c1 ZINC000120890644 1102263370 /nfs/dbraw/zinc/26/33/70/1102263370.db2.gz USSKAQOMDSRTCN-IBGZPJMESA-N 2 0 360.473 4.145 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000415022484 1102263912 /nfs/dbraw/zinc/26/39/12/1102263912.db2.gz ZRLVPPNOXYPEMN-JTQLQIEISA-N 2 0 353.226 4.075 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(Br)cc1C(F)(F)F ZINC000415022485 1102264356 /nfs/dbraw/zinc/26/43/56/1102264356.db2.gz ZRLVPPNOXYPEMN-SNVBAGLBSA-N 2 0 353.226 4.075 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000187582709 1102285392 /nfs/dbraw/zinc/28/53/92/1102285392.db2.gz NWNDUGKVFJZFFW-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC(F)F)cc1 ZINC000120961463 1102289430 /nfs/dbraw/zinc/28/94/30/1102289430.db2.gz CMKLOLHFOVUBDC-CYBMUJFWSA-N 2 0 352.400 4.340 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC(F)F)cc1 ZINC000120961271 1102289594 /nfs/dbraw/zinc/28/95/94/1102289594.db2.gz CMKLOLHFOVUBDC-ZDUSSCGKSA-N 2 0 352.400 4.340 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c(C)n1 ZINC000121046444 1102314018 /nfs/dbraw/zinc/31/40/18/1102314018.db2.gz WGMVSOHLCJWVAK-QGZVFWFLSA-N 2 0 352.526 4.176 20 0 FIADRP C[C@@H]1C[C@@H](NC[C@@H](c2ccco2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000532441726 1102330333 /nfs/dbraw/zinc/33/03/33/1102330333.db2.gz FHAKPWRZKLRPMI-HJNYFJLDSA-N 2 0 367.537 4.059 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(Cl)cc2)CC1 ZINC000532447320 1102339793 /nfs/dbraw/zinc/33/97/93/1102339793.db2.gz BFAQJRJXEYZZSD-GOSISDBHSA-N 2 0 371.956 4.328 20 0 FIADRP CC(C)[NH+]1CCC(NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)CC1 ZINC000532450097 1102348050 /nfs/dbraw/zinc/34/80/50/1102348050.db2.gz VVRUNHUVPZFCCB-IBGZPJMESA-N 2 0 367.940 4.078 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cccc(CO)c1 ZINC000121238905 1102354753 /nfs/dbraw/zinc/35/47/53/1102354753.db2.gz HQXBFIHIFAUJTK-MOPGFXCFSA-N 2 0 352.522 4.404 20 0 FIADRP CC[NH+]1CCC(C[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000044517719 1102366120 /nfs/dbraw/zinc/36/61/20/1102366120.db2.gz WTUNFHRTXAMWPQ-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2c3cc(Br)ccc3SC[C@H]2C)CCN1C ZINC000532483208 1102424234 /nfs/dbraw/zinc/42/42/34/1102424234.db2.gz ZALBTJIERXERET-ALYFQZSWSA-N 2 0 369.372 4.304 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1F ZINC000110911118 1102426258 /nfs/dbraw/zinc/42/62/58/1102426258.db2.gz YAQXKSZQAXCZEY-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(SC)c(F)c2)[C@H](C)C1 ZINC000122268149 1102553309 /nfs/dbraw/zinc/55/33/09/1102553309.db2.gz HBUJSOUOFGADAX-GJYPPUQNSA-N 2 0 368.562 4.335 20 0 FIADRP CCc1cc2c(cc1CC)CC([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)C2 ZINC001167974825 1102567948 /nfs/dbraw/zinc/56/79/48/1102567948.db2.gz ASHQIXWQEBZFGG-CWAQXLGLSA-N 2 0 352.566 4.274 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@@H](c3ccco3)[NH+]3CCCC3)CC2)C1 ZINC000152276118 1102583665 /nfs/dbraw/zinc/58/36/65/1102583665.db2.gz VGXSBUZBNQUZEA-NRSPTQNISA-N 2 0 359.558 4.049 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168253281 1102655250 /nfs/dbraw/zinc/65/52/50/1102655250.db2.gz WVZZLIYPQJHKNO-FKBYEOEOSA-N 2 0 356.554 4.315 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)C1 ZINC000550885009 1102656961 /nfs/dbraw/zinc/65/69/61/1102656961.db2.gz AYYAALWJYQFOAH-DDRJZQQSSA-N 3 0 357.586 4.140 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC001168252605 1102660091 /nfs/dbraw/zinc/66/00/91/1102660091.db2.gz PMPSHFJTZNVPLJ-NRFANRHFSA-N 2 0 364.961 4.398 20 0 FIADRP COc1ccc(CCC[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1OC ZINC000551007865 1102758644 /nfs/dbraw/zinc/75/86/44/1102758644.db2.gz SDUIRPOQLQZBRG-SFTDATJTSA-N 2 0 368.521 4.062 20 0 FIADRP COc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1OC ZINC000551007861 1102758688 /nfs/dbraw/zinc/75/86/88/1102758688.db2.gz SDUIRPOQLQZBRG-NHCUHLMSSA-N 2 0 368.521 4.062 20 0 FIADRP COc1ccc2oc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc2c1 ZINC000123051730 1102772139 /nfs/dbraw/zinc/77/21/39/1102772139.db2.gz LXNRPNYTRNLBST-UHFFFAOYSA-N 2 0 350.462 4.327 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccsc1 ZINC000187911226 1102779393 /nfs/dbraw/zinc/77/93/93/1102779393.db2.gz TWULWQJTIDCKCS-RTWAWAEBSA-N 2 0 358.551 4.336 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)[C@@]1(C)CCCO1 ZINC000551030139 1102809949 /nfs/dbraw/zinc/80/99/49/1102809949.db2.gz XYCVWGVCRQWSGD-OXJNMPFZSA-N 2 0 350.934 4.099 20 0 FIADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550269990 1102895161 /nfs/dbraw/zinc/89/51/61/1102895161.db2.gz DSIXPJMPYNOAPN-MZYLBHOOSA-N 2 0 370.581 4.331 20 0 FIADRP c1ccc2oc(C3CC[NH+](C4C[C@H]5CC[C@@H](C4)[N@H+]5CC4CC4)CC3)nc2c1 ZINC001167983821 1102913779 /nfs/dbraw/zinc/91/37/79/1102913779.db2.gz IPNUXNSZMANNBT-YOFSQIOKSA-N 2 0 365.521 4.413 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccc1O ZINC000459365375 1102928465 /nfs/dbraw/zinc/92/84/65/1102928465.db2.gz BAAGPDORBPBULB-SFHVURJKSA-N 2 0 368.521 4.455 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C\c3ccc(F)cc3)cc2)CC1 ZINC000551271250 1103032521 /nfs/dbraw/zinc/03/25/21/1103032521.db2.gz MTNXOACNFCHKQS-IHWYPQMZSA-N 2 0 354.469 4.102 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000729682521 1103034596 /nfs/dbraw/zinc/03/45/96/1103034596.db2.gz ZFRNJOCMFVKGTA-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)ccc1O ZINC000459380532 1103039786 /nfs/dbraw/zinc/03/97/86/1103039786.db2.gz TUSNBESFMOHDHF-SFHVURJKSA-N 2 0 368.521 4.313 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnn(Cc2ccccc2Cl)c1)c1ccccc1 ZINC000666976004 1103044116 /nfs/dbraw/zinc/04/41/16/1103044116.db2.gz SWRSOQAMNHDWIK-OAQYLSRUSA-N 2 0 368.912 4.155 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)cn1 ZINC000462544171 1103073814 /nfs/dbraw/zinc/07/38/14/1103073814.db2.gz MUWBJZJIKYABEF-UHFFFAOYSA-N 2 0 351.538 4.215 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000507403548 1103359755 /nfs/dbraw/zinc/35/97/55/1103359755.db2.gz NSZHUTRWUZZODL-XJKSGUPXSA-N 2 0 351.332 4.319 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CS[C@@H](C(C)(C)C)C3)cc2)CC1 ZINC000551567392 1103369927 /nfs/dbraw/zinc/36/99/27/1103369927.db2.gz SLRNMADZZDIFEG-FXAWDEMLSA-N 2 0 362.583 4.169 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000507470841 1103418356 /nfs/dbraw/zinc/41/83/56/1103418356.db2.gz NXJLELMOVWEUMG-QRVBRYPASA-N 2 0 367.537 4.104 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccncc1 ZINC000507633832 1103568643 /nfs/dbraw/zinc/56/86/43/1103568643.db2.gz FJVGYSAKCLZBFE-FQEVSTJZSA-N 2 0 351.538 4.467 20 0 FIADRP CC(C)C(C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)C(C)C ZINC000551805535 1103652921 /nfs/dbraw/zinc/65/29/21/1103652921.db2.gz AQWGKHBXTRKIIJ-UHFFFAOYSA-N 2 0 351.623 4.043 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000551790576 1103663259 /nfs/dbraw/zinc/66/32/59/1103663259.db2.gz CQJVYHWXZICHQU-NMNUPHIUSA-N 2 0 374.569 4.284 20 0 FIADRP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1)C1CCCCC1 ZINC000519698819 1103786989 /nfs/dbraw/zinc/78/69/89/1103786989.db2.gz VTQWGJHQORXBEJ-YPAWHYETSA-N 2 0 369.553 4.216 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])on1 ZINC000519763930 1103835784 /nfs/dbraw/zinc/83/57/84/1103835784.db2.gz HYGDQQBPRITAPU-VQIMIIECSA-N 2 0 365.477 4.111 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000519816567 1103881571 /nfs/dbraw/zinc/88/15/71/1103881571.db2.gz OSNZGBJQDLKMQI-FPOVZHCZSA-N 2 0 351.538 4.168 20 0 FIADRP C[C@@H]([NH3+])c1ccc(-c2nc(-c3cccc(C[NH+]4CCCCC4)c3)no2)cc1 ZINC000416399921 1104073009 /nfs/dbraw/zinc/07/30/09/1104073009.db2.gz ITBARNTWODROEP-MRXNPFEDSA-N 2 0 362.477 4.409 20 0 FIADRP Cc1cc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1F ZINC000538267447 1104090488 /nfs/dbraw/zinc/09/04/88/1104090488.db2.gz JAGFPYUPZWNQLH-FQEVSTJZSA-N 2 0 354.469 4.212 20 0 FIADRP CCOc1ccccc1OCCN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000441386498 1104321671 /nfs/dbraw/zinc/32/16/71/1104321671.db2.gz FGROTJJZRJWSMW-VQTJNVASSA-N 2 0 360.542 4.051 20 0 FIADRP Clc1ccc(SCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441397517 1104329193 /nfs/dbraw/zinc/32/91/93/1104329193.db2.gz WSNYSMXVGLJFSA-BEFAXECRSA-N 2 0 350.959 4.381 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000237161956 1104523096 /nfs/dbraw/zinc/52/30/96/1104523096.db2.gz GIXYZDHHNCIHFW-UHFFFAOYSA-N 2 0 367.971 4.379 20 0 FIADRP CCCc1cc(NC2CC[NH+](C[C@H]3CCOC3)CC2)c2ccccc2[nH+]1 ZINC000125296340 1104647693 /nfs/dbraw/zinc/64/76/93/1104647693.db2.gz VTNXGWKADMOBBI-QGZVFWFLSA-N 2 0 353.510 4.100 20 0 FIADRP FC(F)(F)c1cccc(OCCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000441438404 1104704551 /nfs/dbraw/zinc/70/45/51/1104704551.db2.gz MBHUEFICDALGSI-KRWDZBQOSA-N 2 0 370.459 4.282 20 0 FIADRP CCc1cc(C[NH+]2CCC3(CCC[N@H+](Cc4ccc(C)cc4)C3)CC2)on1 ZINC001203217819 1104974844 /nfs/dbraw/zinc/97/48/44/1104974844.db2.gz KWQVXAJWBZTNFP-UHFFFAOYSA-N 2 0 367.537 4.424 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152371145 1105056642 /nfs/dbraw/zinc/05/66/42/1105056642.db2.gz OQORAKVVXMZLFL-UKRRQHHQSA-N 2 0 359.514 4.393 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152371241 1105056814 /nfs/dbraw/zinc/05/68/14/1105056814.db2.gz OQORAKVVXMZLFL-DZGCQCFKSA-N 2 0 359.514 4.393 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152396309 1105082741 /nfs/dbraw/zinc/08/27/41/1105082741.db2.gz CIESYYXQQVODRH-HIFRSBDPSA-N 2 0 359.514 4.393 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)Cc1cccc(Br)c1 ZINC000247133762 1105090974 /nfs/dbraw/zinc/09/09/74/1105090974.db2.gz XAEDLBHPNVTFNA-IPELMVKDSA-N 2 0 365.359 4.234 20 0 FIADRP Cc1ccn2c(CN[C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)[C@@H](C)C3)cnc2c1 ZINC001168006811 1105119155 /nfs/dbraw/zinc/11/91/55/1105119155.db2.gz PEQBUMIEUKHOMV-CEQLMSFQSA-N 2 0 362.521 4.174 20 0 FIADRP Clc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)C1 ZINC000665234008 1105227270 /nfs/dbraw/zinc/22/72/70/1105227270.db2.gz VNRZJFRYTGJECL-IZBJGVDFSA-N 2 0 361.961 4.067 20 0 FIADRP c1cc(C2CCCCC2)ccc1CC[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000665235806 1105232601 /nfs/dbraw/zinc/23/26/01/1105232601.db2.gz AOOJYYRHRWRVES-RJGXRXQPSA-N 2 0 356.554 4.024 20 0 FIADRP c1cc(C2CCCCC2)ccc1CC[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000665235808 1105232607 /nfs/dbraw/zinc/23/26/07/1105232607.db2.gz AOOJYYRHRWRVES-YTFSRNRJSA-N 2 0 356.554 4.024 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCC[C@@H](C)C2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000508204646 1105358597 /nfs/dbraw/zinc/35/85/97/1105358597.db2.gz IHDBRZNQAMWRHO-AKHDSKFASA-N 2 0 357.542 4.118 20 0 FIADRP CC[C@H](Cc1ccccc1)[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000475351400 1106741463 /nfs/dbraw/zinc/74/14/63/1106741463.db2.gz GLOIRXVKPBIPSL-LMDPOFIKSA-N 2 0 354.460 4.403 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000392261386 1106978916 /nfs/dbraw/zinc/97/89/16/1106978916.db2.gz HVHVTOARECDUCS-UHFFFAOYSA-N 2 0 352.322 4.076 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[N@@H+]1C ZINC000152434031 1107435722 /nfs/dbraw/zinc/43/57/22/1107435722.db2.gz BLFCHZNKVUXLLN-ZBFHGGJFSA-N 2 0 371.352 4.114 20 0 FIADRP Cc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc(C)c1OCc1ccccn1 ZINC000067507190 1107594122 /nfs/dbraw/zinc/59/41/22/1107594122.db2.gz VYPFVBUWWPYDCD-HXUWFJFHSA-N 2 0 367.537 4.097 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1F)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475573332 1107767559 /nfs/dbraw/zinc/76/75/59/1107767559.db2.gz HQZAWHMJNQYTTN-IGEOTXOUSA-N 2 0 369.322 4.126 20 0 FIADRP C[C@@H](Cc1ccc(Br)c(F)c1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576772 1107784576 /nfs/dbraw/zinc/78/45/76/1107784576.db2.gz VYUOKJYJLFKILS-JEYLPNPQSA-N 2 0 369.322 4.126 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000531687624 1108052035 /nfs/dbraw/zinc/05/20/35/1108052035.db2.gz SWYBUFCBUMDVJK-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccc(-c3ccsc3)cc2)CCN1C1CC[NH+](C)CC1 ZINC000444679794 1108080956 /nfs/dbraw/zinc/08/09/56/1108080956.db2.gz CIZSLLITWHMVTK-SFHVURJKSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ncc(-c2ccccc2)n1C ZINC000453054946 1108131136 /nfs/dbraw/zinc/13/11/36/1108131136.db2.gz CYFVFIVZJYFFJE-RTBURBONSA-N 2 0 354.542 4.250 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453089177 1108159815 /nfs/dbraw/zinc/15/98/15/1108159815.db2.gz JXFMKXREVNNYCT-FQEVSTJZSA-N 2 0 350.934 4.272 20 0 FIADRP Clc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCC2)cc1 ZINC000453112606 1108181164 /nfs/dbraw/zinc/18/11/64/1108181164.db2.gz QYPTWSTVPOJNGQ-IERDGZPVSA-N 2 0 362.945 4.272 20 0 FIADRP CCC1(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000453186681 1108256378 /nfs/dbraw/zinc/25/63/78/1108256378.db2.gz WZMBFWNAUUPWLN-QUCCMNQESA-N 2 0 352.526 4.171 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000453213574 1108282162 /nfs/dbraw/zinc/28/21/62/1108282162.db2.gz APFMPANFOGJRHN-PKTZIBPZSA-N 2 0 370.581 4.474 20 0 FIADRP CO[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000453289288 1108365251 /nfs/dbraw/zinc/36/52/51/1108365251.db2.gz LXRNINSGGLVCAE-KIHHCIJBSA-N 2 0 364.533 4.029 20 0 FIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000531965174 1108461340 /nfs/dbraw/zinc/46/13/40/1108461340.db2.gz RAGWMWMROQNHQQ-FCHUYYIVSA-N 2 0 371.956 4.369 20 0 FIADRP CCC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000531965238 1108461360 /nfs/dbraw/zinc/46/13/60/1108461360.db2.gz DKSJZAXDHVRPAC-PKTZIBPZSA-N 2 0 351.538 4.106 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453386519 1108471009 /nfs/dbraw/zinc/47/10/09/1108471009.db2.gz VETLZMGKGSNRRU-XMSQKQJNSA-N 2 0 367.537 4.249 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCc2c1cc(Br)cc2F)C1CC1 ZINC000453386201 1108471243 /nfs/dbraw/zinc/47/12/43/1108471243.db2.gz AHAPFNIWLAKDGN-QGZVFWFLSA-N 2 0 355.295 4.040 20 0 FIADRP COc1ccc([C@@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)cc1C[NH+]1CCCCC1 ZINC000453365419 1108481049 /nfs/dbraw/zinc/48/10/49/1108481049.db2.gz LYRGSEZIVOUPIU-AUSIDOKSSA-N 2 0 372.553 4.245 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)Oc1cccc(C(F)(F)F)c1 ZINC000531979221 1108496369 /nfs/dbraw/zinc/49/63/69/1108496369.db2.gz ZBQHZYLMKRBCMN-GARXJVFOSA-N 2 0 358.448 4.181 20 0 FIADRP COc1ccc([C@H]([NH2+]CCCC[N@H+](C)C2CC2)c2ccc(F)cc2)cc1 ZINC000453402787 1108504193 /nfs/dbraw/zinc/50/41/93/1108504193.db2.gz NXDNXXLOVFYHHG-JOCHJYFZSA-N 2 0 356.485 4.388 20 0 FIADRP c1ccc(C[NH+]2CCC([C@H]3CCCCC[N@@H+]3Cc3cncnc3)CC2)cc1 ZINC000453601148 1108651535 /nfs/dbraw/zinc/65/15/35/1108651535.db2.gz SMBYZQKBDSETLO-HSZRJFAPSA-N 2 0 364.537 4.133 20 0 FIADRP Cn1ccnc1C[N@@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453603721 1108653019 /nfs/dbraw/zinc/65/30/19/1108653019.db2.gz YMTBYLXICHQJKV-QFIPXVFZSA-N 2 0 366.553 4.077 20 0 FIADRP C[C@@H]1C[C@@H]1c1ccc(CNC2CC[NH+](CCc3ccc(F)cc3)CC2)o1 ZINC000532210913 1108712375 /nfs/dbraw/zinc/71/23/75/1108712375.db2.gz DHMPQOFENDTCAJ-IERDGZPVSA-N 2 0 356.485 4.339 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc21 ZINC000532214181 1108715161 /nfs/dbraw/zinc/71/51/61/1108715161.db2.gz ZIEZTFWGBDNVFD-YGOYIFOWSA-N 2 0 363.549 4.203 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532225244 1108722438 /nfs/dbraw/zinc/72/24/38/1108722438.db2.gz FNIJCKKMCYYFQK-HKUYNNGSSA-N 2 0 356.485 4.397 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(OC)c(Br)c1 ZINC000034991371 1108917034 /nfs/dbraw/zinc/91/70/34/1108917034.db2.gz APSIOICSSHXUAP-AWEZNQCLSA-N 2 0 357.336 4.058 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@@H](C)c3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000524750887 1109137479 /nfs/dbraw/zinc/13/74/79/1109137479.db2.gz DVTPMUZUUMXOTN-UGKGYDQZSA-N 2 0 357.586 4.145 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c2ccccc2n1 ZINC000524753183 1109138336 /nfs/dbraw/zinc/13/83/36/1109138336.db2.gz ZQQGRKUAHJOGBV-NRFANRHFSA-N 2 0 359.517 4.497 20 0 FIADRP COC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CCCC1 ZINC000446837215 1109356514 /nfs/dbraw/zinc/35/65/14/1109356514.db2.gz VRILNJKMSYFMDV-QFIPXVFZSA-N 2 0 356.510 4.206 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446840376 1109361468 /nfs/dbraw/zinc/36/14/68/1109361468.db2.gz FURKFYZYBHIPTB-INIZCTEOSA-N 2 0 359.739 4.485 20 0 FIADRP c1ccc(COc2cccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)c2)cc1 ZINC000446887039 1109383465 /nfs/dbraw/zinc/38/34/65/1109383465.db2.gz NDVHZCJNBVOOOA-UHFFFAOYSA-N 2 0 350.506 4.230 20 0 FIADRP COc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OCCC(C)C ZINC000446887861 1109383492 /nfs/dbraw/zinc/38/34/92/1109383492.db2.gz ZGKCFQRITZPKMN-UHFFFAOYSA-N 2 0 360.542 4.084 20 0 FIADRP C[C@@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Cl)c1 ZINC000525874953 1109548586 /nfs/dbraw/zinc/54/85/86/1109548586.db2.gz WNLDUEWIIONXFQ-PGRDOPGGSA-N 2 0 371.956 4.022 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)o1 ZINC000447560014 1109581807 /nfs/dbraw/zinc/58/18/07/1109581807.db2.gz BSYMKQADEDAUGK-JKSUJKDBSA-N 2 0 359.489 4.199 20 0 FIADRP C[C@H]([NH2+]CCOCC[NH+](C)C)c1ccc(-c2ccccc2Cl)s1 ZINC000447593452 1109590029 /nfs/dbraw/zinc/59/00/29/1109590029.db2.gz SAWOWMRTCFBJQF-AWEZNQCLSA-N 2 0 352.931 4.297 20 0 FIADRP C[C@H](C[NH+]1CCCCCC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447608318 1109601592 /nfs/dbraw/zinc/60/15/92/1109601592.db2.gz VCHTZRKNOSJPNO-XBYSBRQOSA-N 2 0 355.570 4.036 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc21 ZINC000447609737 1109601911 /nfs/dbraw/zinc/60/19/11/1109601911.db2.gz YYLYZDCQRNIAQI-FGCOXFRFSA-N 2 0 364.533 4.227 20 0 FIADRP CC(C)c1cccc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000527859750 1109840774 /nfs/dbraw/zinc/84/07/74/1109840774.db2.gz QKJZGNOWUSRFIM-RDPSFJRHSA-N 2 0 365.565 4.449 20 0 FIADRP Cc1cccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C(C)C)c1 ZINC000527889060 1109850740 /nfs/dbraw/zinc/85/07/40/1109850740.db2.gz XYYBNONKNGXQDI-DHIUTWEWSA-N 2 0 352.522 4.049 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000527971030 1109871638 /nfs/dbraw/zinc/87/16/38/1109871638.db2.gz UNILYUHNZJEKBO-JTSKRJEESA-N 2 0 353.510 4.214 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000527969782 1109877642 /nfs/dbraw/zinc/87/76/42/1109877642.db2.gz RMEWOXMBZXMFOW-HTAPYJJXSA-N 2 0 353.510 4.214 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(CCc3ccccc3)s2)[C@@H](C)C1 ZINC000449028945 1109959418 /nfs/dbraw/zinc/95/94/18/1109959418.db2.gz NHULIUGHTDNGAC-PXNSSMCTSA-N 2 0 357.567 4.090 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCc3[nH]c(=O)ccc32)CC1 ZINC000449071729 1109972914 /nfs/dbraw/zinc/97/29/14/1109972914.db2.gz OKWPXOGXZHXCEY-SFHVURJKSA-N 2 0 359.558 4.433 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2-n2ccnc2)CC1 ZINC000449099771 1109976073 /nfs/dbraw/zinc/97/60/73/1109976073.db2.gz UUWMZLDSAWMOLM-HXUWFJFHSA-N 2 0 374.532 4.058 20 0 FIADRP COc1cc2ccccc2cc1C[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000449104412 1109976370 /nfs/dbraw/zinc/97/63/70/1109976370.db2.gz FMDUJMCUHDWDOJ-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP COc1cccc2c(C[NH2+]Cc3cccc(OCC[NH+](C)C)c3)cccc12 ZINC000449091048 1109978701 /nfs/dbraw/zinc/97/87/01/1109978701.db2.gz OWQIAGNURCSTGX-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP C[C@H]([NH2+]Cc1cccc2ccoc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000449129602 1109981795 /nfs/dbraw/zinc/98/17/95/1109981795.db2.gz CTPDHYGCXUEAPO-INIZCTEOSA-N 2 0 367.468 4.175 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2cc3cccnc3o2)CC1 ZINC000449128996 1109981817 /nfs/dbraw/zinc/98/18/17/1109981817.db2.gz UFMZAJIIYSAHSW-UHFFFAOYSA-N 2 0 369.896 4.483 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449131621 1109982376 /nfs/dbraw/zinc/98/23/76/1109982376.db2.gz OIXQRUYDMCKXJZ-OALUTQOASA-N 2 0 352.522 4.008 20 0 FIADRP Cc1cn2c(n1)[C@@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)CCC2 ZINC000449171742 1109988474 /nfs/dbraw/zinc/98/84/74/1109988474.db2.gz UMFZZHXTBNHBKJ-GOSISDBHSA-N 2 0 360.590 4.338 20 0 FIADRP CCOCCC1(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCC1 ZINC000449184530 1109993897 /nfs/dbraw/zinc/99/38/97/1109993897.db2.gz GJVDBBHYXWZOGH-FQEVSTJZSA-N 2 0 358.570 4.269 20 0 FIADRP CCC[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3F)C2)CC1 ZINC000449218196 1109999771 /nfs/dbraw/zinc/99/97/71/1109999771.db2.gz GGGXOWDQGYJTTC-UHFFFAOYSA-N 2 0 369.322 4.298 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000449308373 1110023266 /nfs/dbraw/zinc/02/32/66/1110023266.db2.gz WPQVAKZAKSQBGU-KRWDZBQOSA-N 2 0 350.497 4.497 20 0 FIADRP Cc1cc(Br)c(C[N@H+]2CC[C@@H](c3nccn3C)C2)cc1Cl ZINC000449324916 1110026965 /nfs/dbraw/zinc/02/69/65/1110026965.db2.gz IFXLFMYDJWEMKL-GFCCVEGCSA-N 2 0 368.706 4.134 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@@H]4CCOC5(CCC5)C4)[C@@H]3C2)cc1 ZINC000449478396 1110085227 /nfs/dbraw/zinc/08/52/27/1110085227.db2.gz KCKOWOICXAGURL-ACESQOTJSA-N 2 0 368.565 4.226 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000449618769 1110126840 /nfs/dbraw/zinc/12/68/40/1110126840.db2.gz ZVYXRXYBDDTLRC-IFMALSPDSA-N 2 0 367.537 4.050 20 0 FIADRP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@@H]4CCO[C@H](C)C4)CC3)C2)cc1 ZINC001168114892 1110239063 /nfs/dbraw/zinc/23/90/63/1110239063.db2.gz FLAZJRONNWRNIU-IFMALSPDSA-N 2 0 356.554 4.241 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)C[N@@H+]1Cc1ccccc1 ZINC000538407789 1111129142 /nfs/dbraw/zinc/12/91/42/1111129142.db2.gz KUSCVWRJMRZQJO-BLCKVISQSA-N 2 0 356.554 4.080 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000538410875 1111130282 /nfs/dbraw/zinc/13/02/82/1111130282.db2.gz LHXIRIGBCSCLII-CTNGQTDRSA-N 2 0 374.532 4.420 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc(C(F)F)cc2)CC1 ZINC000461371802 1111178132 /nfs/dbraw/zinc/17/81/32/1111178132.db2.gz MQGHKGCDQJYZBH-UHFFFAOYSA-N 2 0 354.485 4.195 20 0 FIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cnc(C3CCCCC3)s2)C1 ZINC000538749881 1111280819 /nfs/dbraw/zinc/28/08/19/1111280819.db2.gz LJVWEZYSUFCBIC-SFHVURJKSA-N 2 0 365.587 4.124 20 0 FIADRP c1[nH]nc2cc(CN3CC[C@H]4[C@@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc12 ZINC000538798625 1111294996 /nfs/dbraw/zinc/29/49/96/1111294996.db2.gz PTPUWHFPLYNRIS-GMAHTHKFSA-N 2 0 360.505 4.049 20 0 FIADRP COc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c2ccccc12 ZINC000538799121 1111295592 /nfs/dbraw/zinc/29/55/92/1111295592.db2.gz OKCUGSZJBCRHTK-XMSQKQJNSA-N 2 0 350.506 4.297 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)C1 ZINC000461794421 1111358872 /nfs/dbraw/zinc/35/88/72/1111358872.db2.gz ASMVNZHYWUBHBM-KRWDZBQOSA-N 2 0 358.476 4.050 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000539064233 1111405798 /nfs/dbraw/zinc/40/57/98/1111405798.db2.gz DRAVPKNTBDOGNV-PCCBWWKXSA-N 2 0 362.945 4.075 20 0 FIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)CCC2 ZINC000539064993 1111408561 /nfs/dbraw/zinc/40/85/61/1111408561.db2.gz OEAQQYBAUQYWOU-QFIPXVFZSA-N 2 0 367.537 4.313 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000539063649 1111408569 /nfs/dbraw/zinc/40/85/69/1111408569.db2.gz PQRSJOFMZFBLGB-HSALFYBXSA-N 2 0 370.562 4.246 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c2ccccc12 ZINC000539072430 1111419520 /nfs/dbraw/zinc/41/95/20/1111419520.db2.gz RMCHPOUSTDYFHY-FHWLQOOXSA-N 2 0 370.537 4.388 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)C(C)C)cc1 ZINC000539215301 1111478936 /nfs/dbraw/zinc/47/89/36/1111478936.db2.gz LOQCTLNOIKTWRY-RJGXRXQPSA-N 2 0 358.570 4.304 20 0 FIADRP CC[NH+]1CCC(Nc2ccc(C[N@H+](C[C@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000462070057 1111488402 /nfs/dbraw/zinc/48/84/02/1111488402.db2.gz VDNKNBWHMGWMDK-HSZRJFAPSA-N 2 0 373.585 4.362 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3SCCc4ccccc43)CC2)cc1 ZINC000462113672 1111502182 /nfs/dbraw/zinc/50/21/82/1111502182.db2.gz UICPFRXQPKKGCZ-HSZRJFAPSA-N 2 0 366.574 4.314 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H](CC)Cc2ccccc2Br)CC1 ZINC000539293769 1111505173 /nfs/dbraw/zinc/50/51/73/1111505173.db2.gz XNRWYUYQRJHQPJ-MRXNPFEDSA-N 2 0 353.348 4.234 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H]2CCC[C@@H]21 ZINC000552056382 1111559827 /nfs/dbraw/zinc/55/98/27/1111559827.db2.gz ATHUTBIDRCTHCC-DBDQLMEASA-N 2 0 352.444 4.414 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H]2CCC[C@@H]21 ZINC000552056383 1111560103 /nfs/dbraw/zinc/56/01/03/1111560103.db2.gz ATHUTBIDRCTHCC-GBBGEASQSA-N 2 0 352.444 4.414 20 0 FIADRP CC(C)C1CCC([NH+]2CCN([C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)CC1 ZINC000552281378 1111658917 /nfs/dbraw/zinc/65/89/17/1111658917.db2.gz TYLINTIFHVNPSG-VHYCJAOWSA-N 2 0 369.597 4.093 20 0 FIADRP C[C@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ncc(Br)cc1F ZINC000927039685 1111691320 /nfs/dbraw/zinc/69/13/20/1111691320.db2.gz VQRIYCVPAZUJBU-MKQDKFQKSA-N 2 0 370.310 4.041 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479063415 1111939017 /nfs/dbraw/zinc/93/90/17/1111939017.db2.gz FEDHKGLHFUSRRO-QHCPKHFHSA-N 2 0 374.532 4.491 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479364413 1112007251 /nfs/dbraw/zinc/00/72/51/1112007251.db2.gz RVYYQXGAYCQUJK-GHTZIAJQSA-N 2 0 354.542 4.350 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000479465601 1112034607 /nfs/dbraw/zinc/03/46/07/1112034607.db2.gz KYAJUDQNPHRNPM-OPAMFIHVSA-N 2 0 356.485 4.494 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(F)cc3)C2)[C@H](C)C1 ZINC000479492966 1112045782 /nfs/dbraw/zinc/04/57/82/1112045782.db2.gz XVPMDDDAEUZGEF-YKWDRNOUSA-N 2 0 362.533 4.188 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(F)c3)C2)[C@H](C)C1 ZINC000479526125 1112052951 /nfs/dbraw/zinc/05/29/51/1112052951.db2.gz LAAQEFCAVKYUJD-IYERYRBDSA-N 2 0 362.533 4.188 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000479526660 1112053185 /nfs/dbraw/zinc/05/31/85/1112053185.db2.gz JYIVSAQYOGPONY-JOCHJYFZSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000479529913 1112053721 /nfs/dbraw/zinc/05/37/21/1112053721.db2.gz RSAHSJMNBPWPQB-DYJCROTPSA-N 2 0 367.512 4.357 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000479739084 1112126332 /nfs/dbraw/zinc/12/63/32/1112126332.db2.gz FXSDFXVEPCGBNN-IAGOWNOFSA-N 2 0 360.521 4.481 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000479872170 1112171314 /nfs/dbraw/zinc/17/13/14/1112171314.db2.gz HIVWGHGDCGTGNS-ROUUACIJSA-N 2 0 360.546 4.132 20 0 FIADRP COCc1csc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000667590021 1112231804 /nfs/dbraw/zinc/23/18/04/1112231804.db2.gz JCZJSKVLEHRFMV-UHFFFAOYSA-N 2 0 358.551 4.239 20 0 FIADRP FC(F)c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cn1 ZINC000898518116 1112289786 /nfs/dbraw/zinc/28/97/86/1112289786.db2.gz YUDOUSIPEFABKK-HSALFYBXSA-N 2 0 371.475 4.410 20 0 FIADRP COc1ccc(C2([NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000480204657 1112331643 /nfs/dbraw/zinc/33/16/43/1112331643.db2.gz ZLXSDZRDIQMDFP-ICSRJNTNSA-N 2 0 350.506 4.185 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000480241361 1112345851 /nfs/dbraw/zinc/34/58/51/1112345851.db2.gz MVPITPLIZVICAJ-AQNXPRMDSA-N 2 0 352.522 4.455 20 0 FIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000480252434 1112350843 /nfs/dbraw/zinc/35/08/43/1112350843.db2.gz UWUIBEWPSDQYEC-HKUYNNGSSA-N 2 0 371.491 4.076 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000480691060 1112547551 /nfs/dbraw/zinc/54/75/51/1112547551.db2.gz AACFXLOMMOLILF-QFIPXVFZSA-N 2 0 366.553 4.027 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](CC)CC3)cc2)s1 ZINC000480733487 1112569288 /nfs/dbraw/zinc/56/92/88/1112569288.db2.gz UKFPCSUFZADXLO-SFHVURJKSA-N 2 0 371.594 4.299 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCOc3ccccc32)cc1 ZINC000480726230 1112573188 /nfs/dbraw/zinc/57/31/88/1112573188.db2.gz GMFZWOSDHYFJOD-QFIPXVFZSA-N 2 0 368.521 4.411 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000480751132 1112577876 /nfs/dbraw/zinc/57/78/76/1112577876.db2.gz UYKMPLCWHJMWAH-SFLYRZDNSA-N 2 0 363.549 4.013 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480744279 1112582908 /nfs/dbraw/zinc/58/29/08/1112582908.db2.gz YFLYOXDUVBMKPJ-WMHQRMGPSA-N 2 0 357.325 4.366 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000481333330 1112903768 /nfs/dbraw/zinc/90/37/68/1112903768.db2.gz SKHUQKFBBCQUAQ-MJGOQNOKSA-N 2 0 356.485 4.397 20 0 FIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CCCO2 ZINC000481343369 1112907106 /nfs/dbraw/zinc/90/71/06/1112907106.db2.gz WCWVDTQJJIMZAF-JOCHJYFZSA-N 2 0 368.521 4.247 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3cccc(Br)c3C2)C1 ZINC000555536836 1112913713 /nfs/dbraw/zinc/91/37/13/1112913713.db2.gz ABJGDEPZEZCZIM-RDJZCZTQSA-N 2 0 365.359 4.016 20 0 FIADRP COc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)cc1Br ZINC000481446522 1112945489 /nfs/dbraw/zinc/94/54/89/1112945489.db2.gz QYLWKSLGYKFOSP-CYBMUJFWSA-N 2 0 367.331 4.125 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000481449394 1112947310 /nfs/dbraw/zinc/94/73/10/1112947310.db2.gz WXMUZUKTWSEGEB-QGZVFWFLSA-N 2 0 372.557 4.228 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000481540684 1112973023 /nfs/dbraw/zinc/97/30/23/1112973023.db2.gz HFKHFTAVUCXZBI-FQEVSTJZSA-N 2 0 374.532 4.435 20 0 FIADRP CCCCCCOC(=O)CCCCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168366016 1112979310 /nfs/dbraw/zinc/97/93/10/1112979310.db2.gz IHGSKVPAKHRVDP-UHFFFAOYSA-N 2 0 352.563 4.134 20 0 FIADRP CC1(C)CC[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c2ccccc21 ZINC000481659992 1113016010 /nfs/dbraw/zinc/01/60/10/1113016010.db2.gz QWBOAQLKUFWIJT-FKBYEOEOSA-N 2 0 356.554 4.157 20 0 FIADRP C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1cc[nH+]c2cc(OC(F)(F)F)ccc21 ZINC000899877860 1113040804 /nfs/dbraw/zinc/04/08/04/1113040804.db2.gz JXZQXCSZNDSYBO-UONOGXRCSA-N 2 0 365.399 4.196 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(F)c1 ZINC000481710376 1113050476 /nfs/dbraw/zinc/05/04/76/1113050476.db2.gz BQLDMIQDZXXXRO-HNNXBMFYSA-N 2 0 362.514 4.459 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCCO3)cc1 ZINC000482127663 1113184175 /nfs/dbraw/zinc/18/41/75/1113184175.db2.gz ORJIPHNLNIBYTG-VGOFRKELSA-N 2 0 350.506 4.108 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCCO2 ZINC000162902270 1113207094 /nfs/dbraw/zinc/20/70/94/1113207094.db2.gz WNPBAHCUBWGSGK-QFIPXVFZSA-N 2 0 366.505 4.295 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000482370480 1113235504 /nfs/dbraw/zinc/23/55/04/1113235504.db2.gz QQYBJWHJPVKHAK-SFHVURJKSA-N 2 0 354.542 4.180 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482445260 1113258993 /nfs/dbraw/zinc/25/89/93/1113258993.db2.gz ISDJNYYEPXTVJU-JTHBVZDNSA-N 2 0 364.533 4.363 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482458897 1113267285 /nfs/dbraw/zinc/26/72/85/1113267285.db2.gz AZMGNYNJFGKUGV-BEFAXECRSA-N 2 0 372.384 4.308 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482503525 1113279527 /nfs/dbraw/zinc/27/95/27/1113279527.db2.gz LPLFPMLNICVYNR-FXAWDEMLSA-N 2 0 371.594 4.142 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000482519351 1113282699 /nfs/dbraw/zinc/28/26/99/1113282699.db2.gz NHNAGLWEJVAHSI-DNVCBOLYSA-N 2 0 372.384 4.308 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cc(C[NH+](C)C)ccc2C)cc1)C1CC1 ZINC000482599983 1113304676 /nfs/dbraw/zinc/30/46/76/1113304676.db2.gz XCYPCCSCGUHHMH-UHFFFAOYSA-N 2 0 365.521 4.293 20 0 FIADRP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482638266 1113316733 /nfs/dbraw/zinc/31/67/33/1113316733.db2.gz ZPZLQYNQPXRBIB-XXBNENTESA-N 2 0 367.537 4.156 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cc(F)cc(F)c1 ZINC000482868918 1113388458 /nfs/dbraw/zinc/38/84/58/1113388458.db2.gz MGEFKFRBSAWIHZ-MRXNPFEDSA-N 2 0 360.448 4.290 20 0 FIADRP Cc1ccncc1C[NH+](C)Cc1ccccc1C[N@@H+](C)Cc1cnccc1C ZINC000483042208 1113429676 /nfs/dbraw/zinc/42/96/76/1113429676.db2.gz BUDIDORJEWSUJE-UHFFFAOYSA-N 2 0 374.532 4.357 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3c(s2)CCC3)[C@H](C)C1 ZINC000483140253 1113451996 /nfs/dbraw/zinc/45/19/96/1113451996.db2.gz PSAYFFUNYDGQKV-NUJGCVRESA-N 2 0 350.572 4.024 20 0 FIADRP Cc1ccccc1[C@@H](C)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000483217464 1113467381 /nfs/dbraw/zinc/46/73/81/1113467381.db2.gz NARVESHVJJIGKT-HXUWFJFHSA-N 2 0 357.586 4.184 20 0 FIADRP COc1ccccc1/C=C\C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486461857 1113572466 /nfs/dbraw/zinc/57/24/66/1113572466.db2.gz PQAOILFBWFSTDI-COQOWEQBSA-N 2 0 350.506 4.209 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486487859 1113579568 /nfs/dbraw/zinc/57/95/68/1113579568.db2.gz KNNYKMKWXKOREK-VQIMIIECSA-N 2 0 360.448 4.288 20 0 FIADRP C[NH+](CCC(F)(F)F)Cc1cccc(C[N@H+](C)CCC(F)(F)F)c1 ZINC000486978017 1113689538 /nfs/dbraw/zinc/68/95/38/1113689538.db2.gz RHKSQQBOTJJFEV-UHFFFAOYSA-N 2 0 356.354 4.455 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2 ZINC000488117327 1113859456 /nfs/dbraw/zinc/85/94/56/1113859456.db2.gz YEJCEYWWTCUQKI-XYEHWOGUSA-N 2 0 354.538 4.108 20 0 FIADRP Brc1ccccc1[C@H]1CCCN1C1CC[NH+](CC2CC2)CC1 ZINC001168374353 1113876251 /nfs/dbraw/zinc/87/62/51/1113876251.db2.gz ZQVPBOHWEVDAOW-LJQANCHMSA-N 2 0 363.343 4.460 20 0 FIADRP Cc1cc2oc(=O)cc(CN3CC[C@@H](C[NH+]4CCCC4)C3)c2cc1C(C)C ZINC000150766343 1114112175 /nfs/dbraw/zinc/11/21/75/1114112175.db2.gz ZEIGGPBBMNYTCA-SFHVURJKSA-N 2 0 368.521 4.143 20 0 FIADRP Cc1cccc(C[NH+](C)Cc2cccc(C[N@@H+](C)Cc3cccc(C)n3)c2)n1 ZINC000489637416 1114148582 /nfs/dbraw/zinc/14/85/82/1114148582.db2.gz WYPMGRGWBUPGLM-UHFFFAOYSA-N 2 0 374.532 4.357 20 0 FIADRP C[C@@H]1[C@H](NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000489912907 1114191918 /nfs/dbraw/zinc/19/19/18/1114191918.db2.gz XLDZSBFDLPZACK-AUSIDOKSSA-N 2 0 355.570 4.036 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000490126970 1114221375 /nfs/dbraw/zinc/22/13/75/1114221375.db2.gz ZDLITESZQZTMJA-JOCHJYFZSA-N 2 0 371.956 4.045 20 0 FIADRP CSCc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000586795511 1114394929 /nfs/dbraw/zinc/39/49/29/1114394929.db2.gz FSXDZJKWCKTRLN-KRWDZBQOSA-N 2 0 358.551 4.341 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H](N[C@@H]2CCCC[C@H]2[NH3+])CCC3)cc1 ZINC000571073957 1114431382 /nfs/dbraw/zinc/43/13/82/1114431382.db2.gz NZWIEJNZVSLQIS-ZACQAIPSSA-N 2 0 357.523 4.056 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccn1 ZINC000571466598 1114466158 /nfs/dbraw/zinc/46/61/58/1114466158.db2.gz BTYAFUDKVIUIDA-ZWKOTPCHSA-N 2 0 353.510 4.315 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000571445724 1114471196 /nfs/dbraw/zinc/47/11/96/1114471196.db2.gz NLRGDIFIVOILIH-UHFFFAOYSA-N 2 0 368.521 4.096 20 0 FIADRP CC(C)CN1c2ccccc2[C@@H]2C[N@H+](C3CC[NH+](CC4CC4)CC3)CC[C@@H]21 ZINC001168381570 1114512552 /nfs/dbraw/zinc/51/25/52/1114512552.db2.gz YAQZTYXOMKDGTQ-UPVQGACJSA-N 2 0 367.581 4.195 20 0 FIADRP CCOC(=O)CC(C)(C)CC[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000588204760 1114555155 /nfs/dbraw/zinc/55/51/55/1114555155.db2.gz JFZOWBDTEBTYQO-NGRWLJPCSA-N 2 0 374.569 4.102 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3nn(C)c4ccccc34)cc2)C1 ZINC000589641096 1114819195 /nfs/dbraw/zinc/81/91/95/1114819195.db2.gz RZZOOLBKQJYONE-SFHVURJKSA-N 2 0 362.521 4.095 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641810 1114820443 /nfs/dbraw/zinc/82/04/43/1114820443.db2.gz RVEIIZLGRUVTAL-ROUUACIJSA-N 2 0 362.521 4.331 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OCc2ccncc2)C1 ZINC000589836046 1114847185 /nfs/dbraw/zinc/84/71/85/1114847185.db2.gz FJKRKWFRKHJQJK-HXUWFJFHSA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000589837697 1114848124 /nfs/dbraw/zinc/84/81/24/1114848124.db2.gz YUZLRIGIONTQGV-IAGOWNOFSA-N 2 0 372.475 4.475 20 0 FIADRP CC(CC[NH+]1CCC(OC(C)C)CC1)CC[NH+]1CCC(OC(C)C)CC1 ZINC000573572596 1115143097 /nfs/dbraw/zinc/14/30/97/1115143097.db2.gz ZYBRVPHTAFWJCK-UHFFFAOYSA-N 2 0 368.606 4.182 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC(O)(c3ccccc3)CC2)CC1 ZINC000760909931 1115171936 /nfs/dbraw/zinc/17/19/36/1115171936.db2.gz TWPMYSOORWFSMM-LDOASJGRSA-N 2 0 370.581 4.450 20 0 FIADRP COc1cccc(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)c1OC1CCCC1 ZINC000573793194 1115181418 /nfs/dbraw/zinc/18/14/18/1115181418.db2.gz WUCNMNOENGXXAW-WOJBJXKFSA-N 2 0 352.478 4.251 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000574136243 1115291982 /nfs/dbraw/zinc/29/19/82/1115291982.db2.gz ZCJNSRGAUNPGOQ-OAQYLSRUSA-N 2 0 357.929 4.340 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168402430 1115322067 /nfs/dbraw/zinc/32/20/67/1115322067.db2.gz ZIQKPVDPHUIVSK-QHCPKHFHSA-N 2 0 352.497 4.185 20 0 FIADRP CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001168404739 1115448457 /nfs/dbraw/zinc/44/84/57/1115448457.db2.gz VHMZOYWQRUYZAY-DEOSSOPVSA-N 2 0 366.549 4.446 20 0 FIADRP CSC1(C[NH2+]Cc2ccc(-c3scnc3C)cc2)CC[NH+](C)CC1 ZINC000594944981 1115501881 /nfs/dbraw/zinc/50/18/81/1115501881.db2.gz UNALCTOORPJNAQ-UHFFFAOYSA-N 2 0 361.580 4.036 20 0 FIADRP [NH3+]C1(Cc2cccc(Cl)c2)CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415528 1115826668 /nfs/dbraw/zinc/82/66/68/1115826668.db2.gz CPDSNUFVXZFEFR-OAQYLSRUSA-N 2 0 372.915 4.372 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000606409620 1115943372 /nfs/dbraw/zinc/94/33/72/1115943372.db2.gz OJXPODKUDWALCP-JOCHJYFZSA-N 2 0 371.569 4.009 20 0 FIADRP Fc1cccc(C2(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)CC2)c1 ZINC000606914844 1115983118 /nfs/dbraw/zinc/98/31/18/1115983118.db2.gz SMTZUPFIGXXMDU-UHFFFAOYSA-N 2 0 368.496 4.122 20 0 FIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000607279431 1116014733 /nfs/dbraw/zinc/01/47/33/1116014733.db2.gz WCWIBVQGGQTPHU-HDICACEKSA-N 2 0 357.542 4.262 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)cc2)cc1 ZINC000608748931 1116125806 /nfs/dbraw/zinc/12/58/06/1116125806.db2.gz KKCDUILOCCQFIR-UHFFFAOYSA-N 2 0 364.533 4.430 20 0 FIADRP C[C@@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500124697 1116150769 /nfs/dbraw/zinc/15/07/69/1116150769.db2.gz NSNYGCLCRVTKBK-RDJZCZTQSA-N 2 0 354.460 4.473 20 0 FIADRP C[NH+](C)[C@H]1CCc2cc(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)ccc21 ZINC000456309147 1116177927 /nfs/dbraw/zinc/17/79/27/1116177927.db2.gz JLKKGWVCRXHMKW-QFIPXVFZSA-N 2 0 363.505 4.084 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)cc1 ZINC000456341766 1116179756 /nfs/dbraw/zinc/17/97/56/1116179756.db2.gz YOTQFTMRFCXOJX-QFIPXVFZSA-N 2 0 365.521 4.330 20 0 FIADRP Cc1cccn2c(C[NH+]3CCC(CC[N@H+]4CCCC[C@@H]4C)CC3)cnc12 ZINC000539825393 1116383963 /nfs/dbraw/zinc/38/39/63/1116383963.db2.gz RIGJBXUSJNORQH-IBGZPJMESA-N 2 0 354.542 4.119 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000462689167 1116393314 /nfs/dbraw/zinc/39/33/14/1116393314.db2.gz VBAMNLAIPITMMW-QGZVFWFLSA-N 2 0 374.960 4.436 20 0 FIADRP COc1ccc2cc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000539895370 1117738952 /nfs/dbraw/zinc/73/89/52/1117738952.db2.gz CSQNUOJRLZVMPQ-OFNKIYASSA-N 2 0 350.506 4.297 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(Br)cc2Cl)CC1 ZINC000462752156 1117752082 /nfs/dbraw/zinc/75/20/82/1117752082.db2.gz CPYFCCFUEBNJJT-UHFFFAOYSA-N 2 0 359.739 4.314 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(C3CCCC3)cc2)CC1 ZINC000462783468 1117765609 /nfs/dbraw/zinc/76/56/09/1117765609.db2.gz PDUHEJFDBSNCTO-XZOQPEGZSA-N 2 0 356.554 4.202 20 0 FIADRP C[C@H](O)C[C@H](C)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462801398 1117785245 /nfs/dbraw/zinc/78/52/45/1117785245.db2.gz GXRHXQJEKXCZDI-BBTUJRGHSA-N 2 0 350.522 4.128 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC000462903495 1117849454 /nfs/dbraw/zinc/84/94/54/1117849454.db2.gz ALORXNWDSNNTTB-XMMPIXPASA-N 2 0 364.533 4.201 20 0 FIADRP CCC1(C[NH2+][C@H](C)c2cn(C)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000540142124 1117893847 /nfs/dbraw/zinc/89/38/47/1117893847.db2.gz PEUCMFRINLSREI-GOSISDBHSA-N 2 0 354.542 4.072 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000540142682 1117895003 /nfs/dbraw/zinc/89/50/03/1117895003.db2.gz LEFUHDDZUFIZPK-SFHVURJKSA-N 2 0 355.526 4.071 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000540144549 1117895972 /nfs/dbraw/zinc/89/59/72/1117895972.db2.gz ZMFBSSMJKAGGSS-ZJOUEHCJSA-N 2 0 354.542 4.415 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Br)c1 ZINC000540137173 1117900996 /nfs/dbraw/zinc/90/09/96/1117900996.db2.gz NBKWUTKVXYWAGS-OAHLLOKOSA-N 2 0 374.326 4.411 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000540160361 1117903730 /nfs/dbraw/zinc/90/37/30/1117903730.db2.gz CTFZGLIRYTXFBB-BULFRSBZSA-N 2 0 358.570 4.403 20 0 FIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000540173122 1117913349 /nfs/dbraw/zinc/91/33/49/1117913349.db2.gz CVEPVEROSQGXDF-ZACQAIPSSA-N 2 0 370.484 4.136 20 0 FIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000540173120 1117913615 /nfs/dbraw/zinc/91/36/15/1117913615.db2.gz CVEPVEROSQGXDF-IXDOHACOSA-N 2 0 370.484 4.136 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(OCC(F)F)c1 ZINC000540176634 1117916505 /nfs/dbraw/zinc/91/65/05/1117916505.db2.gz UJBNWNPVRJSSTO-DYESRHJHSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1F ZINC000540192765 1117933747 /nfs/dbraw/zinc/93/37/47/1117933747.db2.gz QSYVXJZMIHNPFI-IBGZPJMESA-N 2 0 355.501 4.079 20 0 FIADRP CC1CC[NH+](CCC[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000463140768 1117980378 /nfs/dbraw/zinc/98/03/78/1117980378.db2.gz ICXUEPZACXKEIS-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1 ZINC000463136516 1117984879 /nfs/dbraw/zinc/98/48/79/1117984879.db2.gz KKLSOFYAZZKSBP-JTOYRKQZSA-N 2 0 371.613 4.387 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000540419302 1118045767 /nfs/dbraw/zinc/04/57/67/1118045767.db2.gz WFINIWQLHAMGEQ-PBFPGSCMSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@H](CC[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)[NH+]1CCCCC1 ZINC000463274580 1118074998 /nfs/dbraw/zinc/07/49/98/1118074998.db2.gz RHZFWEYHZGWREP-GOSISDBHSA-N 2 0 363.977 4.159 20 0 FIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCC4CCOCC4)CC[C@H]32)cc1 ZINC000463293166 1118077374 /nfs/dbraw/zinc/07/73/74/1118077374.db2.gz DVKSUPSKBMTOBP-XZOQPEGZSA-N 2 0 356.554 4.180 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCCNc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463288279 1118084561 /nfs/dbraw/zinc/08/45/61/1118084561.db2.gz ZZCLWWUFOSUNBD-AVRDEDQJSA-N 2 0 355.501 4.270 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCc3ccc(F)cc31)c1ccccc1O2 ZINC000540494726 1118092396 /nfs/dbraw/zinc/09/23/96/1118092396.db2.gz ISXDTFSKBMWCTP-LEWJYISDSA-N 2 0 366.480 4.391 20 0 FIADRP CCc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C(C)C)cc1 ZINC000540988761 1118339518 /nfs/dbraw/zinc/33/95/18/1118339518.db2.gz OKZBKGBZNQCNEC-ZEQRLZLVSA-N 2 0 366.549 4.303 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)cc1F ZINC000540989949 1118340839 /nfs/dbraw/zinc/34/08/39/1118340839.db2.gz ALMLWZRMPZHMAE-VQIMIIECSA-N 2 0 356.913 4.003 20 0 FIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000540992168 1118341920 /nfs/dbraw/zinc/34/19/20/1118341920.db2.gz VTPMGSYITYDTFY-KNQAVFIVSA-N 2 0 352.522 4.111 20 0 FIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000540992369 1118342057 /nfs/dbraw/zinc/34/20/57/1118342057.db2.gz VTPMGSYITYDTFY-SIKLNZKXSA-N 2 0 352.522 4.111 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)N(C)[C@@H](C)c2ccccc2)CC1 ZINC000541084246 1118376822 /nfs/dbraw/zinc/37/68/22/1118376822.db2.gz MJEYDKXDGZGJHY-FQEVSTJZSA-N 2 0 373.585 4.040 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)(N2CCCCC2)CC1 ZINC000464080164 1118434607 /nfs/dbraw/zinc/43/46/07/1118434607.db2.gz XRKKKNNWTGDYBM-FGZHOGPDSA-N 2 0 369.597 4.109 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2C[C@@H](c3ccccc3)C2(C)C)(N2CCCCC2)CC1 ZINC000464080165 1118435112 /nfs/dbraw/zinc/43/51/12/1118435112.db2.gz XRKKKNNWTGDYBM-VXKWHMMOSA-N 2 0 369.597 4.109 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541600542 1118574336 /nfs/dbraw/zinc/57/43/36/1118574336.db2.gz LDPYXOJBWWSPAO-FXAWDEMLSA-N 2 0 372.553 4.385 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541600544 1118574618 /nfs/dbraw/zinc/57/46/18/1118574618.db2.gz LDPYXOJBWWSPAO-XLIONFOSSA-N 2 0 372.553 4.385 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(CN3CCOCC3)c2)C2CCC2)o1 ZINC000541745294 1118630089 /nfs/dbraw/zinc/63/00/89/1118630089.db2.gz YQEDAHDASAMRIC-QFIPXVFZSA-N 2 0 354.494 4.051 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)C(C)(C)c1ccccc1 ZINC000541915166 1118706633 /nfs/dbraw/zinc/70/66/33/1118706633.db2.gz BAVGBTAOJLQHMC-CVDCTZTESA-N 2 0 366.549 4.099 20 0 FIADRP C[N@H+](CCCOc1ccc(F)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464839303 1118708995 /nfs/dbraw/zinc/70/89/95/1118708995.db2.gz QLQDZHUMIVTMIC-FQEVSTJZSA-N 2 0 356.485 4.049 20 0 FIADRP C[N@H+](CCOc1ccc(Cl)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831351 1118715728 /nfs/dbraw/zinc/71/57/28/1118715728.db2.gz ACKVFBHQBXBGMZ-LJQANCHMSA-N 2 0 358.913 4.173 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000173300626 1119031160 /nfs/dbraw/zinc/03/11/60/1119031160.db2.gz FAZOLHJRQDOBOQ-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173947110 1119081878 /nfs/dbraw/zinc/08/18/78/1119081878.db2.gz SEKXYGBBLKNUPG-HNNXBMFYSA-N 2 0 354.897 4.117 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000542465095 1119287744 /nfs/dbraw/zinc/28/77/44/1119287744.db2.gz SRAQIXGOTTZZLL-QVKFZJNVSA-N 2 0 350.441 4.298 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)ccc1SC(F)F ZINC000152467651 1119322982 /nfs/dbraw/zinc/32/29/82/1119322982.db2.gz LJSOIKOKYZOFKG-CHWSQXEVSA-N 2 0 356.482 4.145 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1cccc(OCc2ccccc2)c1 ZINC000311523622 1119378439 /nfs/dbraw/zinc/37/84/39/1119378439.db2.gz PVANYEVAEPVTDF-MSYCTHLASA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311633983 1119383069 /nfs/dbraw/zinc/38/30/69/1119383069.db2.gz JRNBNYBUULODQP-JQVVWYNYSA-N 2 0 352.522 4.126 20 0 FIADRP CC(C)Oc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311704804 1119385288 /nfs/dbraw/zinc/38/52/88/1119385288.db2.gz VAQGWMPFZFZQKZ-DENIHFKCSA-N 2 0 352.522 4.474 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCc3cc(Br)cc(C)c32)C1 ZINC000493916680 1119506008 /nfs/dbraw/zinc/50/60/08/1119506008.db2.gz MCLNFWTYHCWWTE-RHSMWYFYSA-N 2 0 351.332 4.066 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000493897790 1119507639 /nfs/dbraw/zinc/50/76/39/1119507639.db2.gz RCTNSQKUMWXOQU-UHFFFAOYSA-N 2 0 365.359 4.407 20 0 FIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000493969526 1119518530 /nfs/dbraw/zinc/51/85/30/1119518530.db2.gz NXUZTIPENWWKRO-AUSIDOKSSA-N 2 0 352.522 4.264 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000493978389 1119522896 /nfs/dbraw/zinc/52/28/96/1119522896.db2.gz SCVLUNVIKASOER-CVDCTZTESA-N 2 0 368.521 4.027 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183183311 1119567609 /nfs/dbraw/zinc/56/76/09/1119567609.db2.gz OBDOUBSSFBSIHD-CMKODMSKSA-N 2 0 360.542 4.015 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000186137119 1119707495 /nfs/dbraw/zinc/70/74/95/1119707495.db2.gz RUWQXFOMIBDJAF-INIZCTEOSA-N 2 0 374.550 4.328 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1 ZINC000186849361 1119753089 /nfs/dbraw/zinc/75/30/89/1119753089.db2.gz BSXBAOOFYJQIOK-INIZCTEOSA-N 2 0 369.475 4.137 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)C[N@@H+]1Cc1ccccc1 ZINC000494612394 1119995835 /nfs/dbraw/zinc/99/58/35/1119995835.db2.gz NCIDTDILVVJBHU-OKKOYFSCSA-N 2 0 368.565 4.224 20 0 FIADRP C[C@@H]1COCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000192466854 1120063058 /nfs/dbraw/zinc/06/30/58/1120063058.db2.gz HWEPLVXNWGXFMH-NTKDMRAZSA-N 2 0 364.533 4.464 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000192787713 1120083051 /nfs/dbraw/zinc/08/30/51/1120083051.db2.gz NDGCGIJJQSCITA-IBGZPJMESA-N 2 0 363.615 4.254 20 0 FIADRP COc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000195132579 1120119392 /nfs/dbraw/zinc/11/93/92/1120119392.db2.gz TYQIFNHIGDIPTK-QUCCMNQESA-N 2 0 368.521 4.185 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCc3ccc(Br)cc32)cc1 ZINC000193971256 1120222591 /nfs/dbraw/zinc/22/25/91/1120222591.db2.gz KQVFIEJNHXRPFL-IBGZPJMESA-N 2 0 359.311 4.288 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000494879722 1120354693 /nfs/dbraw/zinc/35/46/93/1120354693.db2.gz QPWUYJIFMSYSNO-KNQAVFIVSA-N 2 0 356.485 4.145 20 0 FIADRP CC1CC[NH+](C[C@H]2CCCN(Cc3cnc(-c4ccco4)s3)C2)CC1 ZINC000494999526 1120418783 /nfs/dbraw/zinc/41/87/83/1120418783.db2.gz UVCOCGZXFFFYEY-QGZVFWFLSA-N 2 0 359.539 4.347 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)C2CCC2)cc1 ZINC000250099356 1120475352 /nfs/dbraw/zinc/47/53/52/1120475352.db2.gz REHGVGJTALBYSB-DNVJHFABSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495410137 1120787953 /nfs/dbraw/zinc/78/79/53/1120787953.db2.gz TYPRIYGSCDIKHJ-IRLDBZIGSA-N 3 0 369.597 4.284 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1N(C)C ZINC000495415300 1120793010 /nfs/dbraw/zinc/79/30/10/1120793010.db2.gz OURXFFLZHVTRKJ-ZJOUEHCJSA-N 2 0 351.538 4.314 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2ccnc2)cc1 ZINC000495431941 1120817264 /nfs/dbraw/zinc/81/72/64/1120817264.db2.gz GALCVQMOGDVRFX-SXWKCWPCSA-N 2 0 374.532 4.434 20 0 FIADRP C[N@@H+](Cc1cc(Cl)cc(Br)c1F)CC1CC[NH+](C)CC1 ZINC001234973264 1120827693 /nfs/dbraw/zinc/82/76/93/1120827693.db2.gz GXDIGWSOAZWPFR-UHFFFAOYSA-N 2 0 363.702 4.015 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cc(F)ccc1F ZINC000495548491 1120882272 /nfs/dbraw/zinc/88/22/72/1120882272.db2.gz QKTSKVNBZAVJOM-ZACQAIPSSA-N 2 0 374.475 4.425 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CC[C@H]3SCCS[C@H]23)c1 ZINC000762612125 1120938384 /nfs/dbraw/zinc/93/83/84/1120938384.db2.gz FRMDZLQEVBBUNM-VAMGGRTRSA-N 2 0 362.608 4.142 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000237075041 1120973022 /nfs/dbraw/zinc/97/30/22/1120973022.db2.gz NVKHEKJEOARNTI-NRFANRHFSA-N 2 0 374.532 4.030 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000237146043 1120973862 /nfs/dbraw/zinc/97/38/62/1120973862.db2.gz KRTWHBPBNPCPSU-OALUTQOASA-N 2 0 352.522 4.148 20 0 FIADRP O[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000089553935 1121002788 /nfs/dbraw/zinc/00/27/88/1121002788.db2.gz KMTZVPXVEFIQSI-LJQANCHMSA-N 2 0 370.459 4.126 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(-c2ccccc2)s1 ZINC000542666115 1121024690 /nfs/dbraw/zinc/02/46/90/1121024690.db2.gz JKNXKKLZWXGSFE-SFHVURJKSA-N 2 0 371.594 4.339 20 0 FIADRP C[C@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC001649048813 1121316592 /nfs/dbraw/zinc/31/65/92/1121316592.db2.gz ZZQYNTSRPSDYTG-FPOVZHCZSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000061000082 1121503341 /nfs/dbraw/zinc/50/33/41/1121503341.db2.gz VBODDWZGDPLHLE-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)ccc1OCc1ccccc1 ZINC000062427122 1121540997 /nfs/dbraw/zinc/54/09/97/1121540997.db2.gz RRGYTBIPYGUMIN-NRFANRHFSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc2ccccc2o1 ZINC000124775801 1121718754 /nfs/dbraw/zinc/71/87/54/1121718754.db2.gz GTRMGMCQNIRFQP-GOSISDBHSA-N 2 0 355.526 4.034 20 0 FIADRP CCCC[N@H+](C)CC1CCN([C@H](C)c2nnc(-c3cccs3)o2)CC1 ZINC000066960618 1121762569 /nfs/dbraw/zinc/76/25/69/1121762569.db2.gz RHWHVXQJPMJFBC-OAHLLOKOSA-N 2 0 362.543 4.303 20 0 FIADRP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1OCc1ccccc1 ZINC000067507252 1121780037 /nfs/dbraw/zinc/78/00/37/1121780037.db2.gz DZXKHAYRWGGXQZ-OAQYLSRUSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)OCCO2 ZINC000125484086 1121784567 /nfs/dbraw/zinc/78/45/67/1121784567.db2.gz PENMSWXEEKZCPR-INIZCTEOSA-N 2 0 372.534 4.082 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2COc3ccc(F)cc32)CC1 ZINC000671761001 1121793866 /nfs/dbraw/zinc/79/38/66/1121793866.db2.gz XYWLULCRBNWRBP-GZNCHQMQSA-N 2 0 354.469 4.292 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](CCCOC)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000671764654 1121798051 /nfs/dbraw/zinc/79/80/51/1121798051.db2.gz POEHMTIZTAIABC-POAQFYNOSA-N 2 0 352.950 4.170 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCc2ccccc2F)cc1)C[NH+]1CCCC1 ZINC000916836563 1121877331 /nfs/dbraw/zinc/87/73/31/1121877331.db2.gz LTSQOFZDRHZFMJ-SFHVURJKSA-N 2 0 356.485 4.226 20 0 FIADRP Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126725298 1121980549 /nfs/dbraw/zinc/98/05/49/1121980549.db2.gz OJPJVKVBXNXVGM-ROUUACIJSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cc(F)ccc3F)cc2)C1 ZINC000917007717 1121999248 /nfs/dbraw/zinc/99/92/48/1121999248.db2.gz AUISTQCXZGVBRZ-OPAMFIHVSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2cc(F)ccc2F)cc1 ZINC000917008178 1122000409 /nfs/dbraw/zinc/00/04/09/1122000409.db2.gz GNSWOZCQQZCBSB-OPAMFIHVSA-N 2 0 374.475 4.162 20 0 FIADRP CC(C)C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000127409796 1122091211 /nfs/dbraw/zinc/09/12/11/1122091211.db2.gz ISXCCJJQYQGGIC-QFBILLFUSA-N 2 0 371.491 4.018 20 0 FIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cn1 ZINC000497806250 1122420382 /nfs/dbraw/zinc/42/03/82/1122420382.db2.gz AZBFZKYBWLJOHQ-FQEVSTJZSA-N 2 0 361.530 4.481 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497860461 1122444499 /nfs/dbraw/zinc/44/44/99/1122444499.db2.gz UMSLSDRQYWQCQC-XMSQKQJNSA-N 2 0 371.569 4.383 20 0 FIADRP FC(F)(F)c1cc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc(C(F)(F)F)c1 ZINC000129473627 1122610363 /nfs/dbraw/zinc/61/03/63/1122610363.db2.gz CWUGMMVQUPMBBT-LLVKDONJSA-N 2 0 366.349 4.298 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556228604 1122745589 /nfs/dbraw/zinc/74/55/89/1122745589.db2.gz ASYFKCKQUKBQFH-BAGYTPMASA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)C1 ZINC000556232750 1122749947 /nfs/dbraw/zinc/74/99/47/1122749947.db2.gz IKJVKUBWHWFKNB-HNAYVOBHSA-N 2 0 369.475 4.276 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccco1)c1ccc(Br)cc1 ZINC000498444002 1122805048 /nfs/dbraw/zinc/80/50/48/1122805048.db2.gz OCQNIYUXEOZXBD-KRWDZBQOSA-N 2 0 351.288 4.063 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000556590119 1122984240 /nfs/dbraw/zinc/98/42/40/1122984240.db2.gz ZESYGHSVCZZDCS-JOCHJYFZSA-N 2 0 359.602 4.298 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCCNc4ccccc43)cc2)CC1 ZINC000556610814 1123004357 /nfs/dbraw/zinc/00/43/57/1123004357.db2.gz IRACCOLWYRYSCR-HSZRJFAPSA-N 2 0 365.521 4.196 20 0 FIADRP CCc1noc(C2CCC([NH2+][C@@H]3CCCC[C@H]3C[NH+](CC)CC)CC2)n1 ZINC000498920940 1123078008 /nfs/dbraw/zinc/07/80/08/1123078008.db2.gz WYPAMCAGUKCEAZ-VLOYRQLPSA-N 2 0 362.562 4.148 20 0 FIADRP CC(C)(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cc2ccccc2o1 ZINC000498942659 1123094101 /nfs/dbraw/zinc/09/41/01/1123094101.db2.gz MWIDGRKIZOCQBH-RXVVDRJESA-N 2 0 358.526 4.347 20 0 FIADRP COc1cccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499142779 1123285360 /nfs/dbraw/zinc/28/53/60/1123285360.db2.gz QGMCQVMNGJLIRS-WBDAEOGXSA-N 2 0 364.533 4.413 20 0 FIADRP Cc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4C[C@@H]([NH+](C)C)CC[C@@H]43)s2)cc1 ZINC000557013920 1123308616 /nfs/dbraw/zinc/30/86/16/1123308616.db2.gz KZRICRPFQJQPRW-SESVDKBCSA-N 2 0 370.562 4.407 20 0 FIADRP Cc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4C[C@H]([NH+](C)C)CC[C@@H]43)s2)cc1 ZINC000557013835 1123308775 /nfs/dbraw/zinc/30/87/75/1123308775.db2.gz KZRICRPFQJQPRW-HLAWJBBLSA-N 2 0 370.562 4.407 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133105823 1123420763 /nfs/dbraw/zinc/42/07/63/1123420763.db2.gz YOYGSVIHMVHQFK-VQTJNVASSA-N 2 0 374.569 4.407 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133105425 1123420789 /nfs/dbraw/zinc/42/07/89/1123420789.db2.gz YOYGSVIHMVHQFK-PMACEKPBSA-N 2 0 374.569 4.407 20 0 FIADRP CCC1CCC([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC000236663518 1123545261 /nfs/dbraw/zinc/54/52/61/1123545261.db2.gz PFEKDDHFLPKWQV-UHFFFAOYSA-N 2 0 374.569 4.235 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000237346423 1123621051 /nfs/dbraw/zinc/62/10/51/1123621051.db2.gz PQNNNDCDCJPTPN-GOSISDBHSA-N 2 0 365.521 4.482 20 0 FIADRP C[NH+](C)CCC1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000615464168 1124017411 /nfs/dbraw/zinc/01/74/11/1124017411.db2.gz NMCMVRLKGCMSQN-UHFFFAOYSA-N 2 0 366.549 4.456 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)cc2)[C@@H](C)C1 ZINC000245463963 1124041892 /nfs/dbraw/zinc/04/18/92/1124041892.db2.gz PCBORRLRTYOSJR-QKLQHJQFSA-N 2 0 350.572 4.196 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cccc(CO)c1 ZINC000245550402 1124117941 /nfs/dbraw/zinc/11/79/41/1124117941.db2.gz HQXBFIHIFAUJTK-RBUKOAKNSA-N 2 0 352.522 4.404 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cccc(CO)c1 ZINC000245550405 1124117981 /nfs/dbraw/zinc/11/79/81/1124117981.db2.gz HQXBFIHIFAUJTK-RTBURBONSA-N 2 0 352.522 4.404 20 0 FIADRP CC1(C)CC(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC(C)(C)[NH2+]1 ZINC000245672091 1124183471 /nfs/dbraw/zinc/18/34/71/1124183471.db2.gz HNTJXIHOOPRJLA-ZKTXZKFHSA-N 3 0 355.570 4.081 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245787508 1124249361 /nfs/dbraw/zinc/24/93/61/1124249361.db2.gz ZTFCWXHYBCZSPS-ADHNFCLRSA-N 3 0 357.586 4.282 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245787511 1124249428 /nfs/dbraw/zinc/24/94/28/1124249428.db2.gz ZTFCWXHYBCZSPS-SNJCGAMXSA-N 3 0 357.586 4.282 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000108428239 1124316675 /nfs/dbraw/zinc/31/66/75/1124316675.db2.gz JYJRFIURESUACV-QGZVFWFLSA-N 2 0 371.912 4.024 20 0 FIADRP FC(F)Oc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000060468629 1124566271 /nfs/dbraw/zinc/56/62/71/1124566271.db2.gz DDXBKNVWZSAMJH-UHFFFAOYSA-N 2 0 352.469 4.376 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)c1 ZINC000246962806 1124576795 /nfs/dbraw/zinc/57/67/95/1124576795.db2.gz IRJBCWFVMJQBFL-XXBNENTESA-N 2 0 367.537 4.261 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1F ZINC000248433918 1124768040 /nfs/dbraw/zinc/76/80/40/1124768040.db2.gz DMBYCOZJHSQBGW-SIKLNZKXSA-N 2 0 356.485 4.023 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(Cl)c1 ZINC000248437064 1124768407 /nfs/dbraw/zinc/76/84/07/1124768407.db2.gz GTAHHHLIVBMCPU-IERDGZPVSA-N 2 0 358.913 4.148 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248456012 1124772566 /nfs/dbraw/zinc/77/25/66/1124772566.db2.gz RVSIXBIHWINTOM-DENIHFKCSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc2ccccc2c1 ZINC000248459158 1124773238 /nfs/dbraw/zinc/77/32/38/1124773238.db2.gz VMMHKDSPCDHYHF-HOYKHHGWSA-N 2 0 360.501 4.257 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc2ccccc2s1 ZINC000249210561 1124850373 /nfs/dbraw/zinc/85/03/73/1124850373.db2.gz XUCAOQDJHDBBGP-OXJNMPFZSA-N 2 0 366.530 4.319 20 0 FIADRP C[C@H](c1cccc(O)c1)[N@H+](C)C/C=C/C[NH+](C)[C@@H](C)c1cccc(O)c1 ZINC000111239037 1124881918 /nfs/dbraw/zinc/88/19/18/1124881918.db2.gz CIQQRCAGPRWCLO-FBLDJFESSA-N 2 0 354.494 4.340 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cnn1-c1ccccc1 ZINC000765953880 1124981229 /nfs/dbraw/zinc/98/12/29/1124981229.db2.gz JKDGXHNYZRLGKD-LJQANCHMSA-N 2 0 354.542 4.488 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1nc2ccccc2n1C ZINC000091267608 1125061152 /nfs/dbraw/zinc/06/11/52/1125061152.db2.gz QOFIAMUODCUDII-GOSISDBHSA-N 2 0 362.521 4.410 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C(C)C)cc1 ZINC000091287593 1125063329 /nfs/dbraw/zinc/06/33/29/1125063329.db2.gz NRIDZXGDGNRFQB-QFIPXVFZSA-N 2 0 356.510 4.123 20 0 FIADRP O=C(CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1)OCc1ccccc1 ZINC000182279571 1125319338 /nfs/dbraw/zinc/31/93/38/1125319338.db2.gz YFUZBDUNRLNXNE-UHFFFAOYSA-N 2 0 372.553 4.287 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCN[C@@H]1CC[NH+](Cc2ccccc2)C2(CC2)C1 ZINC000563120075 568224862 /nfs/dbraw/zinc/22/48/62/568224862.db2.gz QNZOPSGHSADHDO-RBBKRZOGSA-N 2 0 355.570 4.038 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2cc(C)c(OCc3ccccn3)c(C)c2)CC1 ZINC000563131734 568264898 /nfs/dbraw/zinc/26/48/98/568264898.db2.gz MSTOCGPQILHWJU-UHFFFAOYSA-N 2 0 367.537 4.099 20 0 FIADRP CC[C@@H](C[N@H+](Cc1nccn1CC)[C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000563136707 568270188 /nfs/dbraw/zinc/27/01/88/568270188.db2.gz NHZVWTYOCFQUEL-FPOVZHCZSA-N 2 0 366.553 4.041 20 0 FIADRP C[C@@H]1C[N@H+](CCCNc2cc[nH+]c3cc(C(F)(F)F)ccc23)CCCO1 ZINC000432876921 568478483 /nfs/dbraw/zinc/47/84/83/568478483.db2.gz HQXJVOCOEPCXSB-CQSZACIVSA-N 2 0 367.415 4.166 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1C[NH+]1CCCCC1 ZINC000182838040 1125647844 /nfs/dbraw/zinc/64/78/44/1125647844.db2.gz IZKZVPDTSPNNJY-LJQANCHMSA-N 3 0 373.585 4.064 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2ccc(C)nc2)ccc1OC ZINC000182946986 1125696973 /nfs/dbraw/zinc/69/69/73/1125696973.db2.gz SIQQZAASTYOBQA-SFHVURJKSA-N 2 0 355.526 4.134 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000619822289 1125709838 /nfs/dbraw/zinc/70/98/38/1125709838.db2.gz KGBMONAHSDRMMU-UXHICEINSA-N 2 0 358.526 4.021 20 0 FIADRP Brc1ccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)s1 ZINC000643548326 1079680962 /nfs/dbraw/zinc/68/09/62/1079680962.db2.gz NWNINSVZBIBDBG-DOMZBBRYSA-N 2 0 355.345 4.226 20 0 FIADRP COCc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC ZINC000183187213 1125773136 /nfs/dbraw/zinc/77/31/36/1125773136.db2.gz WYVYEGCWLRLGKD-YQVWRLOYSA-N 2 0 360.542 4.145 20 0 FIADRP COc1cccc2c1CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC000683159352 1079747082 /nfs/dbraw/zinc/74/70/82/1079747082.db2.gz MQFHOZHGQVSVGN-RBBKRZOGSA-N 2 0 364.533 4.054 20 0 FIADRP CC[N@H+](C[C@H](C[NH+](C)Cc1ccccc1)c1ccccc1)C[C@H]1CCOC1 ZINC001167063838 1079896771 /nfs/dbraw/zinc/89/67/71/1079896771.db2.gz VBPGXGIKWPGCJQ-VWNXMTODSA-N 2 0 366.549 4.261 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001625795723 1079911245 /nfs/dbraw/zinc/91/12/45/1079911245.db2.gz BBEBEFSKODCHGY-BGYRXZFFSA-N 2 0 373.585 4.016 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)Nc2ccccc2C)CC1)CC(C)C ZINC000537998790 1080092916 /nfs/dbraw/zinc/09/29/16/1080092916.db2.gz UIKDXDVIMQOXFK-UHFFFAOYSA-N 2 0 373.585 4.404 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274808427 1080161791 /nfs/dbraw/zinc/16/17/91/1080161791.db2.gz XGECVZSNQFFGFO-QVGHQYEOSA-N 2 0 364.533 4.407 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CC1CCC(c2ccccc2)CC1 ZINC000547743964 1080373400 /nfs/dbraw/zinc/37/34/00/1080373400.db2.gz DBHUTXHPHSIVKV-KGLRWFKISA-N 2 0 356.554 4.144 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000180094114 1080439800 /nfs/dbraw/zinc/43/98/00/1080439800.db2.gz DUQIIYWMMSKEQM-QZTJIDSGSA-N 2 0 356.485 4.033 20 0 FIADRP c1cc(Oc2ccccc2)oc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000180439273 1080500011 /nfs/dbraw/zinc/50/00/11/1080500011.db2.gz ZGQIUSPZXCVRPR-UHFFFAOYSA-N 2 0 370.493 4.149 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(C(C)(C)C)cc1 ZINC000180641763 1080532038 /nfs/dbraw/zinc/53/20/38/1080532038.db2.gz QYFMMWWUCQWJLZ-MBSDFSHPSA-N 2 0 366.549 4.402 20 0 FIADRP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c(C)n1 ZINC001648795330 1080792246 /nfs/dbraw/zinc/79/22/46/1080792246.db2.gz NCCIUBWPTJAJAM-SFHVURJKSA-N 2 0 367.537 4.371 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2cccc3ccccc32)CC1 ZINC000510225155 1080812029 /nfs/dbraw/zinc/81/20/29/1080812029.db2.gz WLZPONGPZBKNAS-UHFFFAOYSA-N 2 0 367.537 4.222 20 0 FIADRP c1ccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000236654123 1080884908 /nfs/dbraw/zinc/88/49/08/1080884908.db2.gz DGGPFUWEAJDUKC-GMAHTHKFSA-N 2 0 350.506 4.055 20 0 FIADRP C[C@@H]([NH2+]CCc1cc(F)c(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830573 1080944363 /nfs/dbraw/zinc/94/43/63/1080944363.db2.gz POBKGUAXAYGCOT-QAPCUYQASA-N 2 0 362.439 4.147 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCc3c2cc(F)cc3F)cc1 ZINC000121263100 1080946787 /nfs/dbraw/zinc/94/67/87/1080946787.db2.gz LQYWAVOOYIJKPM-OAQYLSRUSA-N 2 0 360.448 4.072 20 0 FIADRP CC(C)(C)C1CCC([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000397504129 1081012847 /nfs/dbraw/zinc/01/28/47/1081012847.db2.gz HGUDNWIGCHECIZ-UHFFFAOYSA-N 2 0 358.570 4.208 20 0 FIADRP Cc1cc(N2CCCC[C@@H]2C)ccc1NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655751865 1081169912 /nfs/dbraw/zinc/16/99/12/1081169912.db2.gz KVNJRRMHTIBUAE-GHTZIAJQSA-N 2 0 357.542 4.039 20 0 FIADRP Cc1cc(N2CCCC[C@@H]2C)ccc1NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655751867 1081170158 /nfs/dbraw/zinc/17/01/58/1081170158.db2.gz KVNJRRMHTIBUAE-RXVVDRJESA-N 2 0 357.542 4.039 20 0 FIADRP CCC1(C[NH2+]Cc2cc3n(n2)CCCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000655753374 1081171010 /nfs/dbraw/zinc/17/10/10/1081171010.db2.gz ZDXUTCNUVBLDND-UHFFFAOYSA-N 2 0 366.553 4.001 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000655805595 1081213972 /nfs/dbraw/zinc/21/39/72/1081213972.db2.gz PTVAVMNYTNDBQV-MOXGXCLJSA-N 2 0 360.448 4.307 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000655806446 1081214777 /nfs/dbraw/zinc/21/47/77/1081214777.db2.gz WEBLYRYIRQFMNA-XKQJLSEDSA-N 2 0 359.514 4.256 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC001648814947 1081225909 /nfs/dbraw/zinc/22/59/09/1081225909.db2.gz VYTLJEHLRXYRGT-OAQYLSRUSA-N 2 0 374.569 4.379 20 0 FIADRP Cc1cccc(C[NH2+][C@H](Cn2ccnc2)C(C)(C)C)c1Br ZINC001648886850 1081346565 /nfs/dbraw/zinc/34/65/65/1081346565.db2.gz PKSVGPSDMCNVNS-OAHLLOKOSA-N 2 0 350.304 4.159 20 0 FIADRP c1nc(C2CC2)c(C[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000683774704 1081539550 /nfs/dbraw/zinc/53/95/50/1081539550.db2.gz IVKPMDJKVPSACU-ZCNNSNEGSA-N 2 0 367.562 4.411 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000312698441 1081595265 /nfs/dbraw/zinc/59/52/65/1081595265.db2.gz RFMYCAXVHFILTL-CTNGQTDRSA-N 2 0 368.521 4.267 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000312698458 1081595352 /nfs/dbraw/zinc/59/53/52/1081595352.db2.gz RFMYCAXVHFILTL-PZJWPPBQSA-N 2 0 368.521 4.267 20 0 FIADRP Clc1c(Br)cccc1C[NH+]1CCC2(CC[NH2+]CC2)CC1 ZINC000706484289 1081793153 /nfs/dbraw/zinc/79/31/53/1081793153.db2.gz VRSOTLBTDCETOV-UHFFFAOYSA-N 2 0 357.723 4.068 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)CC[NH+](C)CC1 ZINC000558507158 1081889165 /nfs/dbraw/zinc/88/91/65/1081889165.db2.gz HQAAYEFGYZFPFP-CYBMUJFWSA-N 2 0 362.461 4.063 20 0 FIADRP Cc1ccc(C[C@H]2CCC[N@@H+]2Cc2cccc(CN3CCOCC3)c2)cc1 ZINC001167386992 1081910038 /nfs/dbraw/zinc/91/00/38/1081910038.db2.gz MTTZASCAFRANJI-XMMPIXPASA-N 2 0 364.533 4.034 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc4ccccc4[nH]3)CC2)cc1 ZINC000683927137 1081928409 /nfs/dbraw/zinc/92/84/09/1081928409.db2.gz RXWCCMJFBCNJMS-UHFFFAOYSA-N 2 0 363.505 4.178 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000580501588 1081985251 /nfs/dbraw/zinc/98/52/51/1081985251.db2.gz LYLXFPRDHJTMJB-DENIHFKCSA-N 2 0 352.522 4.132 20 0 FIADRP c1ccc(C2(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)CCOCC2)cc1 ZINC000153579770 1082032961 /nfs/dbraw/zinc/03/29/61/1082032961.db2.gz ZJHNRIDRDOEMGI-UHFFFAOYSA-N 2 0 356.554 4.122 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312974731 1082109188 /nfs/dbraw/zinc/10/91/88/1082109188.db2.gz KSVRTPXZODJCHA-SVMVAKDDSA-N 2 0 365.521 4.206 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000077417525 1082145170 /nfs/dbraw/zinc/14/51/70/1082145170.db2.gz ANGKWCPAKGPMTA-IBGZPJMESA-N 2 0 374.960 4.022 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000580834759 1082180427 /nfs/dbraw/zinc/18/04/27/1082180427.db2.gz YWHCROUGLMQYPI-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000580909613 1082217713 /nfs/dbraw/zinc/21/77/13/1082217713.db2.gz ASSGVENGGZELMO-DENIHFKCSA-N 2 0 355.570 4.209 20 0 FIADRP CCCOc1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1OCC ZINC000581100614 1082313209 /nfs/dbraw/zinc/31/32/09/1082313209.db2.gz WBEMAOAJCVORKP-FQEVSTJZSA-N 2 0 360.542 4.038 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548157571 1082420138 /nfs/dbraw/zinc/42/01/38/1082420138.db2.gz PBBBBICGJHWWHK-QAPCUYQASA-N 2 0 362.439 4.147 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000430581506 1082519438 /nfs/dbraw/zinc/51/94/38/1082519438.db2.gz OQWCGICURZOUTO-ABSDTBQOSA-N 2 0 351.494 4.059 20 0 FIADRP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]Cc2ccncc2OCC[NH+](C)C)C1 ZINC000581570560 1082669955 /nfs/dbraw/zinc/66/99/55/1082669955.db2.gz BCWBRBAGQHQLHQ-BWAGFHJFSA-N 2 0 367.537 4.084 20 0 FIADRP Clc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000656684988 1082715926 /nfs/dbraw/zinc/71/59/26/1082715926.db2.gz ZODXHIZKABPNKZ-NRFANRHFSA-N 2 0 355.913 4.224 20 0 FIADRP Fc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)cc1 ZINC000656784359 1082768805 /nfs/dbraw/zinc/76/88/05/1082768805.db2.gz CPTFGGAWLLLILN-QGZVFWFLSA-N 2 0 359.514 4.161 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cncc(Br)c1 ZINC000581678618 1082794896 /nfs/dbraw/zinc/79/48/96/1082794896.db2.gz VCEHMDLUNXBOEM-HUUCEWRRSA-N 2 0 354.336 4.007 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cnc(C)s3)CC2)cc1 ZINC000090406347 1082909356 /nfs/dbraw/zinc/90/93/56/1082909356.db2.gz GMHXBMGVMLWHDL-HNNXBMFYSA-N 2 0 359.539 4.023 20 0 FIADRP CSC1(C[NH2+]Cc2ccccc2OCc2ccccc2)CC[NH+](C)CC1 ZINC000581853498 1082931674 /nfs/dbraw/zinc/93/16/74/1082931674.db2.gz HFYFVBFGEIMNDO-UHFFFAOYSA-N 2 0 370.562 4.183 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccccc2OC(F)F)CC1 ZINC000471764513 1082961149 /nfs/dbraw/zinc/96/11/49/1082961149.db2.gz YHJOXLNJVLOMIF-VQIMIIECSA-N 2 0 366.496 4.463 20 0 FIADRP Clc1cccc(-c2n[nH]cc2C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000152678638 1082984200 /nfs/dbraw/zinc/98/42/00/1082984200.db2.gz PPLYXIZBKHUIAA-UHFFFAOYSA-N 2 0 358.917 4.038 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)CCO2 ZINC000178221894 1082988653 /nfs/dbraw/zinc/98/86/53/1082988653.db2.gz HWWINECOMPODEY-MRXNPFEDSA-N 2 0 356.535 4.246 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000090418764 1083004392 /nfs/dbraw/zinc/00/43/92/1083004392.db2.gz HJUSRXBBAXTJER-KRWDZBQOSA-N 2 0 373.566 4.173 20 0 FIADRP C[N@H+](CCSCc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000430766895 1083160052 /nfs/dbraw/zinc/16/00/52/1083160052.db2.gz ICXATPIJNJNSLB-UHFFFAOYSA-N 2 0 355.551 4.163 20 0 FIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000510686180 1083238385 /nfs/dbraw/zinc/23/83/85/1083238385.db2.gz UOEKMHJPBBWAJD-UNMCSNQZSA-N 2 0 361.549 4.097 20 0 FIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1Cl ZINC000510739277 1083288649 /nfs/dbraw/zinc/28/86/49/1083288649.db2.gz XBLLKBYCOVIBGQ-RCCFBDPRSA-N 2 0 350.934 4.412 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]CCCCNc1ccccn1)CC2 ZINC000510753302 1083291521 /nfs/dbraw/zinc/29/15/21/1083291521.db2.gz MKFVAANAZWMOIR-QGZVFWFLSA-N 2 0 360.299 4.313 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)CCc2c(F)cccc2F)[C@@H](C)C1 ZINC000510755983 1083293948 /nfs/dbraw/zinc/29/39/48/1083293948.db2.gz YBCJJTCTYQCYMR-FVJLSDCUSA-N 2 0 368.512 4.013 20 0 FIADRP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000658266636 1083379775 /nfs/dbraw/zinc/37/97/75/1083379775.db2.gz XTVJQAHFXZJLPJ-LSJNQWAISA-N 2 0 352.469 4.246 20 0 FIADRP CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000658288437 1083394079 /nfs/dbraw/zinc/39/40/79/1083394079.db2.gz PHUYPAQOMKQNKC-TZYHBYERSA-N 2 0 370.537 4.036 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(O)c1 ZINC000658320434 1083408526 /nfs/dbraw/zinc/40/85/26/1083408526.db2.gz YDENUTMZUMBHEX-GHTZIAJQSA-N 2 0 350.506 4.345 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cnn1-c1ccc(F)cc1 ZINC000658357091 1083428761 /nfs/dbraw/zinc/42/87/61/1083428761.db2.gz QUDWLBAJMYCAAX-INIZCTEOSA-N 2 0 370.516 4.092 20 0 FIADRP C[N@@H+]1CCC[C@H](CNc2cc[nH+]c3c(O)cccc23)[C@@H]1c1cccs1 ZINC000684575263 1083457671 /nfs/dbraw/zinc/45/76/71/1083457671.db2.gz GHFPTTIELDHMRQ-JLTOFOAXSA-N 2 0 353.491 4.497 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000192818084 1083513388 /nfs/dbraw/zinc/51/33/88/1083513388.db2.gz AFPDVHQWVQENHK-JOCHJYFZSA-N 2 0 353.510 4.054 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)c1 ZINC000535685218 1083577411 /nfs/dbraw/zinc/57/74/11/1083577411.db2.gz GXRAMVPIHRSQJW-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000535777578 1083652377 /nfs/dbraw/zinc/65/23/77/1083652377.db2.gz MWYHGGHRHLGTAW-OIBXWCBGSA-N 2 0 363.549 4.122 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000181345849 1083878446 /nfs/dbraw/zinc/87/84/46/1083878446.db2.gz PYIXNXQDQKGJMU-KRWDZBQOSA-N 2 0 371.525 4.050 20 0 FIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000511010134 1084140485 /nfs/dbraw/zinc/14/04/85/1084140485.db2.gz IBTUFOLOQOMIGY-HNNXBMFYSA-N 2 0 354.460 4.491 20 0 FIADRP CCn1nc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c2ccccc21 ZINC000472056159 1084194847 /nfs/dbraw/zinc/19/48/47/1084194847.db2.gz RXOHKMOHHDPTCO-UHFFFAOYSA-N 2 0 368.550 4.120 20 0 FIADRP COc1cccc(SCC[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001167506051 1084205765 /nfs/dbraw/zinc/20/57/65/1084205765.db2.gz XMODYLRFPMIAGV-HXUWFJFHSA-N 2 0 370.562 4.241 20 0 FIADRP Cc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2cnn(C)c2)c1 ZINC000548980577 1084297375 /nfs/dbraw/zinc/29/73/75/1084297375.db2.gz GRJZJKLAPJAUGY-OAQYLSRUSA-N 2 0 374.532 4.007 20 0 FIADRP C[C@H]1C[C@@H](N(C)Cc2sccc2NC(=O)OC(C)(C)C)CC[N@@H+]1C ZINC000892104696 1084299713 /nfs/dbraw/zinc/29/97/13/1084299713.db2.gz DPNJHZGKJYVWFZ-KBPBESRZSA-N 2 0 353.532 4.010 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000657311608 1084428703 /nfs/dbraw/zinc/42/87/03/1084428703.db2.gz PHZHJBIQNJZSLO-QGZVFWFLSA-N 2 0 358.551 4.416 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)Nc1ccccc1 ZINC000511055543 1084453094 /nfs/dbraw/zinc/45/30/94/1084453094.db2.gz ALCZYZOYYOWKGF-LJQANCHMSA-N 2 0 365.521 4.035 20 0 FIADRP CC(C)n1ccnc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000657358657 1084717581 /nfs/dbraw/zinc/71/75/81/1084717581.db2.gz MBWCTVCANYJTDO-UHFFFAOYSA-N 2 0 368.569 4.289 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000582208815 1084762044 /nfs/dbraw/zinc/76/20/44/1084762044.db2.gz NVXSPBDMHRHVHW-LZJOCLMNSA-N 2 0 369.553 4.265 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CC2 ZINC000414189862 1084777630 /nfs/dbraw/zinc/77/76/30/1084777630.db2.gz RMFRYKLIBNTATR-KRWDZBQOSA-N 2 0 356.267 4.182 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+]Cc3cc4ccc(C)cc4[nH]3)CC2)oc1C ZINC000657371280 1084782776 /nfs/dbraw/zinc/78/27/76/1084782776.db2.gz PSQPVAVCDATCSW-UHFFFAOYSA-N 2 0 366.509 4.083 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cs1 ZINC000548712096 1084792691 /nfs/dbraw/zinc/79/26/91/1084792691.db2.gz SJZUKOCZNGLQHV-BAGYTPMASA-N 2 0 369.578 4.274 20 0 FIADRP Fc1cccc(CC[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC001167559094 1084818345 /nfs/dbraw/zinc/81/83/45/1084818345.db2.gz XGAOFVILMYMYET-QHCPKHFHSA-N 2 0 352.497 4.356 20 0 FIADRP c1n[nH]cc1[C@H]1CCCC[N@H+]1CCCCC[NH+]1CCCC[C@H]1c1cn[nH]c1 ZINC000158160388 1084928968 /nfs/dbraw/zinc/92/89/68/1084928968.db2.gz IBVHCQJHTOVXGA-OYRHEFFESA-N 2 0 370.545 4.057 20 0 FIADRP COCC[C@H](Cc1ccco1)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582486514 1085063250 /nfs/dbraw/zinc/06/32/50/1085063250.db2.gz MMTBVBQFADEVRA-RTWAWAEBSA-N 2 0 368.521 4.014 20 0 FIADRP C[C@H](C[NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(C(F)(F)F)cc1 ZINC000657447800 1085086601 /nfs/dbraw/zinc/08/66/01/1085086601.db2.gz SJJSFLVBGZCBCV-CQSZACIVSA-N 2 0 360.383 4.179 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(OC)c(OC)c(OC)c1 ZINC000652137273 1085182140 /nfs/dbraw/zinc/18/21/40/1085182140.db2.gz FFZXXEIQMPTXAF-IBGZPJMESA-N 2 0 372.509 4.015 20 0 FIADRP CC1=C[C@H](C)C[C@@H](C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)C1 ZINC000582577925 1085185762 /nfs/dbraw/zinc/18/57/62/1085185762.db2.gz FKVJNRAJCMCGMQ-SIKLNZKXSA-N 2 0 361.618 4.107 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCCCNC(=O)OC(C)(C)C)C[C@H]1C ZINC001167589958 1085248295 /nfs/dbraw/zinc/24/82/95/1085248295.db2.gz KZHNGQVLPGPAHZ-MOPGFXCFSA-N 2 0 369.594 4.266 20 0 FIADRP CC[NH+]1CCC(N2CCC[N@H+](C[C@@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000660833680 1085285515 /nfs/dbraw/zinc/28/55/15/1085285515.db2.gz HRAKZDKABSWOBO-FYYLOGMGSA-N 2 0 369.597 4.062 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000684954693 1085299453 /nfs/dbraw/zinc/29/94/53/1085299453.db2.gz CRLMXRLSXFZDRM-GCJKJVERSA-N 2 0 368.496 4.323 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCCc5cccnc54)[C@@H]3C2)cc1 ZINC000684960969 1085324665 /nfs/dbraw/zinc/32/46/65/1085324665.db2.gz DOCPKJVLMMAVQK-GSPCLOLRSA-N 2 0 361.533 4.349 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]CCCC[NH+]2CCC(C)CC2)c2ccccc21 ZINC000549526045 1085342128 /nfs/dbraw/zinc/34/21/28/1085342128.db2.gz HAJHQXMUHFJJNE-FCHUYYIVSA-N 2 0 372.553 4.270 20 0 FIADRP COc1ncc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000582681514 1085368047 /nfs/dbraw/zinc/36/80/47/1085368047.db2.gz YIWUAVMEGBNDOG-BQFCYCMXSA-N 2 0 373.928 4.305 20 0 FIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000657535349 1085443800 /nfs/dbraw/zinc/44/38/00/1085443800.db2.gz KYIFITFMRZTWES-VKAVYKQESA-N 2 0 362.945 4.224 20 0 FIADRP Cc1ccc2[nH]c(C[NH+]3CCC(C[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)cc2c1C ZINC000473132656 1085731769 /nfs/dbraw/zinc/73/17/69/1085731769.db2.gz NWQPBJMXNWHYGM-ROUUACIJSA-N 2 0 369.553 4.106 20 0 FIADRP CCn1nc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c2ccccc21 ZINC000473146864 1085827358 /nfs/dbraw/zinc/82/73/58/1085827358.db2.gz UPYOBXNOJVRTCO-UHFFFAOYSA-N 2 0 354.542 4.144 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccc(NC(C)=O)c1 ZINC000120451611 1085838089 /nfs/dbraw/zinc/83/80/89/1085838089.db2.gz WYVLYYGTEMRANL-QGZVFWFLSA-N 2 0 353.510 4.338 20 0 FIADRP Clc1scc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1Cl ZINC000432252469 1085963600 /nfs/dbraw/zinc/96/36/00/1085963600.db2.gz GLCDCGGLOJKZRO-UHFFFAOYSA-N 2 0 356.322 4.456 20 0 FIADRP FC(F)(F)C[C@H]1CC[N@H+](CCCC[NH+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000583063574 1086130812 /nfs/dbraw/zinc/13/08/12/1086130812.db2.gz AXECKMVWUJXTNF-OKILXGFUSA-N 2 0 360.386 4.315 20 0 FIADRP Cc1nccn1CC[N@H+](Cc1ccccc1Br)CC(C)C ZINC001167653857 1086241140 /nfs/dbraw/zinc/24/11/40/1086241140.db2.gz SYHXAHGGRPCJBK-UHFFFAOYSA-N 2 0 350.304 4.112 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662294418 1086398329 /nfs/dbraw/zinc/39/83/29/1086398329.db2.gz VXXXQKUTTHXZEF-WMLDXEAASA-N 2 0 374.916 4.163 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)o2)cc1 ZINC000662295988 1086401466 /nfs/dbraw/zinc/40/14/66/1086401466.db2.gz JPTDAFQCXQCXPM-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP c1c2ccccc2oc1C[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662326793 1086418564 /nfs/dbraw/zinc/41/85/64/1086418564.db2.gz CCROVWALCQHAQE-UHFFFAOYSA-N 2 0 364.493 4.003 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535987983 1086529127 /nfs/dbraw/zinc/52/91/27/1086529127.db2.gz PGCGMUFLPKVUBP-KXBFYZLASA-N 2 0 372.384 4.308 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(Br)cs1 ZINC000663465831 1086565299 /nfs/dbraw/zinc/56/52/99/1086565299.db2.gz LRVLCSPCXWZJRZ-JSGCOSHPSA-N 2 0 357.361 4.283 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(CN(C)C(=O)OC(C)(C)C)CC1 ZINC001167827432 1086625473 /nfs/dbraw/zinc/62/54/73/1086625473.db2.gz VVUHNZAQYKXXDY-SFHVURJKSA-N 2 0 369.594 4.076 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC24CC[NH2+]CC4)CCC3)cc1 ZINC000643534412 1086648719 /nfs/dbraw/zinc/64/87/19/1086648719.db2.gz UKPFAKCUNKQGCK-AEFFLSMTSA-N 2 0 353.535 4.228 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167834826 1086690083 /nfs/dbraw/zinc/69/00/83/1086690083.db2.gz NAYQAPAUOKBXST-RTBURBONSA-N 2 0 369.594 4.217 20 0 FIADRP COc1cccc(OC)c1C[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000512044820 1086699299 /nfs/dbraw/zinc/69/92/99/1086699299.db2.gz ICOXYVGPPOBXJR-AZUAARDMSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCc2c(Br)cccc2C1 ZINC001167836788 1086708696 /nfs/dbraw/zinc/70/86/96/1086708696.db2.gz HGPWOUREBQWXIQ-HNNXBMFYSA-N 2 0 353.348 4.318 20 0 FIADRP CSC1(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)CC[NH+](C)CC1 ZINC000569630496 1086724216 /nfs/dbraw/zinc/72/42/16/1086724216.db2.gz YGSVUWVUIDXSHQ-AEFFLSMTSA-N 2 0 352.975 4.393 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(F)c(-c4cccs4)c3)C2)C1 ZINC000650706067 1086754581 /nfs/dbraw/zinc/75/45/81/1086754581.db2.gz CRWIZOJVOJNHGT-SQGPQFPESA-N 2 0 374.525 4.273 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc4occc4c3)cc2)C[C@H](C)O1 ZINC000512089821 1086755552 /nfs/dbraw/zinc/75/55/52/1086755552.db2.gz SZDAUVXDTRZHAS-ROUUACIJSA-N 2 0 364.489 4.332 20 0 FIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000432428242 1086756730 /nfs/dbraw/zinc/75/67/30/1086756730.db2.gz JEVBUPPNNJDJQT-ZXDFIECXSA-N 2 0 358.570 4.470 20 0 FIADRP Fc1ccc(/C=C/C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1F ZINC000512135416 1086813615 /nfs/dbraw/zinc/81/36/15/1086813615.db2.gz JYGATWGJJDFPOJ-WWPOYFSUSA-N 2 0 356.460 4.132 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000650723010 1086822258 /nfs/dbraw/zinc/82/22/58/1086822258.db2.gz GFEKJMSDILSTOL-YZGWKJHDSA-N 2 0 374.525 4.415 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000650745690 1086928571 /nfs/dbraw/zinc/92/85/71/1086928571.db2.gz LVRJSFYBHZFNJA-GFCCVEGCSA-N 2 0 367.324 4.267 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650752466 1086951307 /nfs/dbraw/zinc/95/13/07/1086951307.db2.gz RDCMSRUAMLOMRG-OAHLLOKOSA-N 2 0 372.488 4.009 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Br)c(F)c1 ZINC000650754455 1086962043 /nfs/dbraw/zinc/96/20/43/1086962043.db2.gz JJILZXYPGQPGAA-JTQLQIEISA-N 2 0 355.226 4.037 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000650756475 1086968217 /nfs/dbraw/zinc/96/82/17/1086968217.db2.gz BPMXCBQJGFRZJV-LJQANCHMSA-N 2 0 359.311 4.409 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000089513153 1087394477 /nfs/dbraw/zinc/39/44/77/1087394477.db2.gz LDDCYMWESNFPRG-INIZCTEOSA-N 2 0 367.331 4.125 20 0 FIADRP C[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1nc(-c2ccccc2)no1 ZINC000090911596 1087410300 /nfs/dbraw/zinc/41/03/00/1087410300.db2.gz UPMZRVIACDMHOI-KRWDZBQOSA-N 2 0 368.525 4.227 20 0 FIADRP C[NH+](C)Cc1cccc(NC(=O)Nc2cccc(CC[N@H+](C)C3CC3)c2)c1 ZINC000091629698 1087432337 /nfs/dbraw/zinc/43/23/37/1087432337.db2.gz NHZSUINYRKBCRW-UHFFFAOYSA-N 2 0 366.509 4.029 20 0 FIADRP CN1CCC([N@@H+](Cc2ccccc2)C[C@H]2CCOc3ccccc32)CC1 ZINC000685467819 1087577541 /nfs/dbraw/zinc/57/75/41/1087577541.db2.gz BVBLFNYPEOYDEB-HXUWFJFHSA-N 2 0 350.506 4.149 20 0 FIADRP CCCOc1cccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000062426528 1087599158 /nfs/dbraw/zinc/59/91/58/1087599158.db2.gz QBRUVNXVZUWDLT-JOCHJYFZSA-N 2 0 352.522 4.477 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)cc2)cc1)C(C)C ZINC000511309366 1087630951 /nfs/dbraw/zinc/63/09/51/1087630951.db2.gz XVOWDUKDZUGUGM-UHFFFAOYSA-N 2 0 353.510 4.231 20 0 FIADRP Cc1nccn1CC[NH2+][C@@H](Cc1ccccc1C(F)(F)F)C(C)(C)C ZINC000685602035 1087638957 /nfs/dbraw/zinc/63/89/57/1087638957.db2.gz UYOZMMCAMSNDMV-KRWDZBQOSA-N 2 0 353.432 4.457 20 0 FIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Br)c(Cl)c1 ZINC000658028395 1087698866 /nfs/dbraw/zinc/69/88/66/1087698866.db2.gz DHQWBBNMSMDJSK-NDNKKMJESA-N 2 0 357.723 4.378 20 0 FIADRP CC(C)[C@@H](Cc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000658029154 1087698884 /nfs/dbraw/zinc/69/88/84/1087698884.db2.gz HCBPZHAAFRNVDM-XVLXNVKGSA-N 2 0 365.359 4.231 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCc2noc4ccccc24)C3)cc1 ZINC000658064670 1087705514 /nfs/dbraw/zinc/70/55/14/1087705514.db2.gz FZCDLLMTKDWROW-OWZKRDHZSA-N 2 0 361.489 4.156 20 0 FIADRP CC(C)[C@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658070838 1087710821 /nfs/dbraw/zinc/71/08/21/1087710821.db2.gz RUWWWDSOFKOGBW-DHIUTWEWSA-N 2 0 356.554 4.352 20 0 FIADRP c1cncc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CCCCC2)c1 ZINC000658070082 1087711358 /nfs/dbraw/zinc/71/13/58/1087711358.db2.gz KXMHYUTXDNFWOR-HSZRJFAPSA-N 2 0 371.569 4.184 20 0 FIADRP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658071256 1087711643 /nfs/dbraw/zinc/71/16/43/1087711643.db2.gz WQOMJHPIVHGUOT-HXUWFJFHSA-N 2 0 364.961 4.142 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccnc4ccccc34)CC2)C1 ZINC000658125360 1087732273 /nfs/dbraw/zinc/73/22/73/1087732273.db2.gz BFJJAIOGLJLVSH-GHTZIAJQSA-N 2 0 351.538 4.410 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658138003 1087741133 /nfs/dbraw/zinc/74/11/33/1087741133.db2.gz LNTGYYCPKXADNE-UWJYYQICSA-N 2 0 370.562 4.216 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(Cl)cc1 ZINC000658138840 1087744190 /nfs/dbraw/zinc/74/41/90/1087744190.db2.gz OMSFQUPWHMWBDE-FGZHOGPDSA-N 2 0 372.940 4.394 20 0 FIADRP CC(C)c1nc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cs1 ZINC000658163925 1087757418 /nfs/dbraw/zinc/75/74/18/1087757418.db2.gz BZXMSIFRCKIILI-MRXNPFEDSA-N 2 0 358.555 4.224 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCC(F)(F)CC1 ZINC000658163899 1087757782 /nfs/dbraw/zinc/75/77/82/1087757782.db2.gz BXTAEBIXAIOGKW-MRXNPFEDSA-N 2 0 351.485 4.097 20 0 FIADRP CCC[C@H](Cc1ccccc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165701 1087760563 /nfs/dbraw/zinc/76/05/63/1087760563.db2.gz KOGDTNOYEFABAN-HSZRJFAPSA-N 2 0 351.538 4.295 20 0 FIADRP c1ccc([C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccn2)cc1 ZINC000658166348 1087761608 /nfs/dbraw/zinc/76/16/08/1087761608.db2.gz NVOVUGXBQIQXSB-XMMPIXPASA-N 2 0 372.516 4.068 20 0 FIADRP Cc1ccccc1C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000658167755 1087764248 /nfs/dbraw/zinc/76/42/48/1087764248.db2.gz UCEVDZVJBBNKFV-XMMPIXPASA-N 2 0 363.549 4.213 20 0 FIADRP c1ccc2c(c1)SCC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167226 1087764532 /nfs/dbraw/zinc/76/45/32/1087764532.db2.gz QVDPRPMHBNIWPI-FQEVSTJZSA-N 2 0 353.535 4.120 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(F)c(F)c(F)c1 ZINC000658167766 1087764556 /nfs/dbraw/zinc/76/45/56/1087764556.db2.gz UGNFDNNANMGIBW-CQSZACIVSA-N 2 0 363.427 4.062 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)Cc2ccccc2-c2ccccc2)CC1 ZINC000472588063 1087870673 /nfs/dbraw/zinc/87/06/73/1087870673.db2.gz CGBYAVXNXCHJBF-UHFFFAOYSA-N 2 0 365.565 4.202 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[N@@H+]3CCC[C@@H](C)C3)C[C@H]2C1 ZINC000424269636 1087890785 /nfs/dbraw/zinc/89/07/85/1087890785.db2.gz PLAIFVIPFKORQO-KJWUJUMESA-N 2 0 356.554 4.212 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@H](Cc2ccncc2)c2cccs2)ccc1F ZINC000424309257 1087932173 /nfs/dbraw/zinc/93/21/73/1087932173.db2.gz ICVITTFSDVYYPX-HXUWFJFHSA-N 2 0 369.509 4.417 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544254 1088031654 /nfs/dbraw/zinc/03/16/54/1088031654.db2.gz YODNSZYZKYNGFE-WOJBJXKFSA-N 2 0 353.485 4.099 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Br)ccc2Cl)cc1 ZINC000414815412 1088242639 /nfs/dbraw/zinc/24/26/39/1088242639.db2.gz XMEVZXMOVXEEBW-LLVKDONJSA-N 2 0 353.691 4.412 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cn(C)nc2-c2ccccc2Cl)cc1 ZINC000414815892 1088248173 /nfs/dbraw/zinc/24/81/73/1088248173.db2.gz YSGQQCQVNZDOTC-AWEZNQCLSA-N 2 0 354.885 4.050 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414816759 1088269386 /nfs/dbraw/zinc/26/93/86/1088269386.db2.gz QLOLXIDDCSCIOC-SJORKVTESA-N 2 0 353.510 4.337 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000311427426 1088376895 /nfs/dbraw/zinc/37/68/95/1088376895.db2.gz GFMNDPZIAUVGNT-HKUYNNGSSA-N 2 0 356.485 4.397 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2ccc3c(c2)[C@H](C[NH3+])CCC3)c1 ZINC000659291258 1088426353 /nfs/dbraw/zinc/42/63/53/1088426353.db2.gz FPHJMHGUYZPMSQ-FQEVSTJZSA-N 2 0 365.521 4.159 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3c2cccc3F)C[C@@H](C)O1 ZINC000513867231 1088494182 /nfs/dbraw/zinc/49/41/82/1088494182.db2.gz CZLWHLRIIOQLIO-SEPYTNNBSA-N 2 0 368.496 4.212 20 0 FIADRP CCc1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@@H](N)c1ccc(C(C)C)cc1 ZINC000414843643 1088503042 /nfs/dbraw/zinc/50/30/42/1088503042.db2.gz JWXRMOFSRPIJGA-LAUBAEHRSA-N 2 0 367.537 4.379 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc21 ZINC000549145882 1089014954 /nfs/dbraw/zinc/01/49/54/1089014954.db2.gz IBSUDADSQDHTNY-RBUKOAKNSA-N 2 0 358.526 4.067 20 0 FIADRP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](CC2CCC(c3ccccc3)CC2)CC1 ZINC000189018409 1089033050 /nfs/dbraw/zinc/03/30/50/1089033050.db2.gz XGCXKOFLKQHLAS-HQNXYIODSA-N 2 0 369.597 4.062 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000415021934 1089061130 /nfs/dbraw/zinc/06/11/30/1089061130.db2.gz YZPOCQUMIBAOAQ-QGZVFWFLSA-N 2 0 368.550 4.267 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)cc1)c1ccccc1 ZINC000415050005 1089087923 /nfs/dbraw/zinc/08/79/23/1089087923.db2.gz IASZTMLJBNKFCK-SFHVURJKSA-N 2 0 352.400 4.198 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000415059370 1089094934 /nfs/dbraw/zinc/09/49/34/1089094934.db2.gz WTXIQLRFNYGQDB-IRLDBZIGSA-N 2 0 350.506 4.326 20 0 FIADRP c1ccc(COCc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)c2)cc1 ZINC000415085984 1089145078 /nfs/dbraw/zinc/14/50/78/1089145078.db2.gz UBOZNGKRWBTMJD-RBZQAINGSA-N 2 0 364.533 4.414 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC2CC[NH2+]CC2)c2cc(F)ccc2F)c1 ZINC000415085605 1089145385 /nfs/dbraw/zinc/14/53/85/1089145385.db2.gz SVSPFRIFQWERFL-HXUWFJFHSA-N 2 0 362.489 4.365 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@H]1CCC[NH2+]C1 ZINC000414860433 1089166395 /nfs/dbraw/zinc/16/63/95/1089166395.db2.gz VJRIYGAHWLMTMU-WBVHZDCISA-N 2 0 371.912 4.070 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]3CC[NH2+][C@H](C)C3)s2)cc1 ZINC000415107394 1089169142 /nfs/dbraw/zinc/16/91/42/1089169142.db2.gz NUZVEMYGDHHJEA-IJEWVQPXSA-N 2 0 359.539 4.166 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)C1 ZINC000415126541 1089178495 /nfs/dbraw/zinc/17/84/95/1089178495.db2.gz PMOUUAQJSGVSKE-UZLBHIALSA-N 2 0 374.525 4.273 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC([C@H]4C[C@H]([NH3+])CCO4)CC3)s2)cc1 ZINC000415127314 1089180718 /nfs/dbraw/zinc/18/07/18/1089180718.db2.gz QXJOAKCAPGGWQE-TZIWHRDSSA-N 2 0 370.562 4.442 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](CC3CCC(c4ccccc4)CC3)CC2)C1 ZINC000415121248 1089181926 /nfs/dbraw/zinc/18/19/26/1089181926.db2.gz HVRWTORUPAWDFC-CVACMQSGSA-N 2 0 356.554 4.179 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccc5c(c4)CCO5)C3)CC2)cc1 ZINC000580296229 1089185320 /nfs/dbraw/zinc/18/53/20/1089185320.db2.gz LBZPMLVVWSEDFB-UHFFFAOYSA-N 2 0 362.517 4.110 20 0 FIADRP Cc1cc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)c2cc(OC(F)F)ccc2[nH+]1 ZINC000549192963 1089185647 /nfs/dbraw/zinc/18/56/47/1089185647.db2.gz OOFBYRVOPCBCHC-HXUWFJFHSA-N 2 0 361.436 4.067 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)C1 ZINC000415129587 1089192574 /nfs/dbraw/zinc/19/25/74/1089192574.db2.gz VFXSBRGNRYBAOK-UYAOXDASSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000415130702 1089197142 /nfs/dbraw/zinc/19/71/42/1089197142.db2.gz RKNOUGRCDCXFGC-DHIUTWEWSA-N 2 0 350.506 4.072 20 0 FIADRP C[C@@H](Cn1cccn1)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549225484 1089283167 /nfs/dbraw/zinc/28/31/67/1089283167.db2.gz NDRWILFPEZIUJX-ZBUUHCTJSA-N 2 0 372.944 4.129 20 0 FIADRP C[C@H](Cn1cccn1)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549225482 1089283872 /nfs/dbraw/zinc/28/38/72/1089283872.db2.gz NDRWILFPEZIUJX-BDWVSVIHSA-N 2 0 372.944 4.129 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000435125089 1089306182 /nfs/dbraw/zinc/30/61/82/1089306182.db2.gz UVPKUSSOUXDQHK-QGZVFWFLSA-N 2 0 356.514 4.146 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1)CC1CC1 ZINC000435126180 1089307525 /nfs/dbraw/zinc/30/75/25/1089307525.db2.gz JZYSVKVGJOOTCA-UHFFFAOYSA-N 2 0 356.514 4.004 20 0 FIADRP Cc1nc2ccccn2c1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000514744537 1089420956 /nfs/dbraw/zinc/42/09/56/1089420956.db2.gz CNELJYDTHCIKEW-SFHVURJKSA-N 2 0 354.542 4.119 20 0 FIADRP c1ccc(CN(Cc2cccc(-c3ccccn3)c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000435389300 1089594946 /nfs/dbraw/zinc/59/49/46/1089594946.db2.gz JVKXZQTXYRKVIQ-QHCPKHFHSA-N 2 0 372.516 4.288 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)CC[NH+](C)CC1 ZINC000515190666 1089846855 /nfs/dbraw/zinc/84/68/55/1089846855.db2.gz MFVYTVFNLTWNIZ-CQSZACIVSA-N 2 0 358.498 4.074 20 0 FIADRP CN(c1ccccc1C[NH2+][C@H]1C[C@H](c2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000435790961 1089936180 /nfs/dbraw/zinc/93/61/80/1089936180.db2.gz LZLAKQWLWDCKDQ-HZCBDIJESA-N 2 0 363.549 4.253 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC(CC[NH3+])CC1 ZINC000515305885 1089946958 /nfs/dbraw/zinc/94/69/58/1089946958.db2.gz KMBYXGOTEKGJKP-KRWDZBQOSA-N 2 0 351.494 4.061 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)NCC1([NH+]2CCCCC2)CCCCC1 ZINC000415944791 1090021464 /nfs/dbraw/zinc/02/14/64/1090021464.db2.gz QCEBRRYWKZJHPK-UHFFFAOYSA-N 2 0 372.557 4.106 20 0 FIADRP CC(C)C[C@H](CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000415968594 1090050477 /nfs/dbraw/zinc/05/04/77/1090050477.db2.gz CPHPYCKSNUWDLJ-DYESRHJHSA-N 2 0 368.525 4.032 20 0 FIADRP CCC(CC)(CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000415979995 1090058996 /nfs/dbraw/zinc/05/89/96/1090058996.db2.gz RTSOSNWWPMAKDL-KRWDZBQOSA-N 2 0 368.525 4.176 20 0 FIADRP CCO[C@H]1C[C@H](Nc2ccc(N3CCC(C[NH+](C)C)CC3)cc2)C12CCC2 ZINC000179955862 1090135761 /nfs/dbraw/zinc/13/57/61/1090135761.db2.gz OYFMLYYHBBRZIH-VXKWHMMOSA-N 2 0 371.569 4.224 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312366431 1090626813 /nfs/dbraw/zinc/62/68/13/1090626813.db2.gz ADSRSPXZJDBOSG-MBSDFSHPSA-N 2 0 368.521 4.267 20 0 FIADRP CCCC1CCC([N@H+](CC(=O)NC2CC[NH+](C(C)C)CC2)C(C)C)CC1 ZINC000511599849 1090653349 /nfs/dbraw/zinc/65/33/49/1090653349.db2.gz SJUFCURWIDRUCV-UHFFFAOYSA-N 2 0 365.606 4.045 20 0 FIADRP Nc1ccc(F)cc1C[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000709268043 1090977785 /nfs/dbraw/zinc/97/77/85/1090977785.db2.gz XGLNOTKHVCFNRZ-UHFFFAOYSA-N 2 0 367.512 4.286 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]C2CCC([NH+]3CCCCC3)CC2)CC1 ZINC000092566969 1091010070 /nfs/dbraw/zinc/01/00/70/1091010070.db2.gz AGVLSQVPAVAIHL-UHFFFAOYSA-N 2 0 364.574 4.274 20 0 FIADRP CCn1cncc1C[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000418042485 1091036059 /nfs/dbraw/zinc/03/60/59/1091036059.db2.gz LSWJHIYQQQKOKC-ZJVRTDGDSA-N 2 0 372.944 4.260 20 0 FIADRP C[NH+]1CCC(CC[N@H+]2CC=C(c3ccc(Br)cc3)CC2)CC1 ZINC001207488894 1091038209 /nfs/dbraw/zinc/03/82/09/1091038209.db2.gz RYRXQZSMQODEHH-UHFFFAOYSA-N 2 0 363.343 4.270 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2c(c1)ncn2[C@H]1CCC[NH2+]CC1 ZINC001167752156 1091159552 /nfs/dbraw/zinc/15/95/52/1091159552.db2.gz QKDVRLZJWULBAV-QUCCMNQESA-N 2 0 369.557 4.027 20 0 FIADRP O[C@H](C[NH+]1CCC(CCC[NH+]2CCCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000759848992 1091315778 /nfs/dbraw/zinc/31/57/78/1091315778.db2.gz MTPYSZQNQLRVRV-HXUWFJFHSA-N 2 0 368.924 4.101 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388542610 1091508692 /nfs/dbraw/zinc/50/86/92/1091508692.db2.gz RSXFTXKBFWWFQN-DENIHFKCSA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)[N@H+](CCc1nccs1)Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000093764363 1091514858 /nfs/dbraw/zinc/51/48/58/1091514858.db2.gz YWAIBXFKFCHNQE-UHFFFAOYSA-N 2 0 373.566 4.071 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312339 1092032117 /nfs/dbraw/zinc/03/21/17/1092032117.db2.gz CYTYUBXJWBYOPY-JZXOWHBKSA-N 2 0 369.553 4.220 20 0 FIADRP COc1ccc(C)cc1C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432673875 1092061263 /nfs/dbraw/zinc/06/12/63/1092061263.db2.gz YCHMJMQTOPPZDK-HXUWFJFHSA-N 2 0 356.535 4.209 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C\c3ccc(F)c(F)c3)cc2)CC1 ZINC000512374620 1092182263 /nfs/dbraw/zinc/18/22/63/1092182263.db2.gz HSHHUDAJOKXHNI-IHWYPQMZSA-N 2 0 372.459 4.241 20 0 FIADRP CC1CC[NH+](CCCNC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168011800 1092228202 /nfs/dbraw/zinc/22/82/02/1092228202.db2.gz SOLNAINOZJSUCL-NHCUHLMSSA-N 2 0 357.586 4.140 20 0 FIADRP CCCc1nc(C)c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428236208 1092305307 /nfs/dbraw/zinc/30/53/07/1092305307.db2.gz GOZYFIWTOFWOEB-XLIONFOSSA-N 2 0 355.526 4.420 20 0 FIADRP C[C@@H]1CC(NC(=[NH2+])c2ccc(F)c(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011992 1092314899 /nfs/dbraw/zinc/31/48/99/1092314899.db2.gz UUMDZNQBZNIULO-HUUCEWRRSA-N 2 0 357.448 4.321 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H](C[NH+](C)C)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012208 1092346731 /nfs/dbraw/zinc/34/67/31/1092346731.db2.gz XXOMYWSBHUWLKP-KZTDQWPFSA-N 2 0 365.565 4.321 20 0 FIADRP Oc1cccc2c1CC[C@H]2[NH2+]CCCCC[NH2+][C@H]1CCc2c1cccc2O ZINC000451179990 1092643374 /nfs/dbraw/zinc/64/33/74/1092643374.db2.gz SFXYOZXEOILGJT-OYRHEFFESA-N 2 0 366.505 4.122 20 0 FIADRP C[C@@H]1C[C@@H](NC[C@@H](c2ccccc2)[NH+](C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014109 1092675204 /nfs/dbraw/zinc/67/52/04/1092675204.db2.gz KABPCMNFRVRFFP-KZTDQWPFSA-N 2 0 365.565 4.321 20 0 FIADRP COc1c(F)cccc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001143533473 1092700047 /nfs/dbraw/zinc/70/00/47/1092700047.db2.gz CIGIWDCLJQWVRQ-PMACEKPBSA-N 2 0 368.496 4.178 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442782362 1092760403 /nfs/dbraw/zinc/76/04/03/1092760403.db2.gz PXBTWDHFFZQEPR-QNTHMWBDSA-N 2 0 373.544 4.381 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442788577 1092768010 /nfs/dbraw/zinc/76/80/10/1092768010.db2.gz CMMPWZSMFOKCOZ-NZSAHSFTSA-N 2 0 372.475 4.288 20 0 FIADRP COCCC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000442797924 1092771342 /nfs/dbraw/zinc/77/13/42/1092771342.db2.gz XJFBYITZPOCAJC-QFIPXVFZSA-N 2 0 371.500 4.195 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)CC2)c1 ZINC000442796136 1092771515 /nfs/dbraw/zinc/77/15/15/1092771515.db2.gz STCKCKLNWAKTCX-KRWDZBQOSA-N 2 0 365.546 4.198 20 0 FIADRP C[C@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000442825131 1092779381 /nfs/dbraw/zinc/77/93/81/1092779381.db2.gz IEHPVXNOPAMFRH-IHPCNDPISA-N 2 0 359.517 4.135 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CC(C)(C)c3cc(OC)ccc32)[C@H](C)C1 ZINC000474039342 1092838076 /nfs/dbraw/zinc/83/80/76/1092838076.db2.gz SUHTWKDLPUXYCF-WTNAPCKOSA-N 2 0 374.569 4.144 20 0 FIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000442921946 1092867600 /nfs/dbraw/zinc/86/76/00/1092867600.db2.gz OBERUUIHGYGXPN-MRXNPFEDSA-N 2 0 371.912 4.153 20 0 FIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(OC(F)(F)F)ccc1F)CC2 ZINC001143549813 1092886513 /nfs/dbraw/zinc/88/65/13/1092886513.db2.gz AURBNCCYCVMDST-UHFFFAOYSA-N 2 0 360.395 4.032 20 0 FIADRP C[N@H+](CCCCOc1ccccc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512565235 1092935335 /nfs/dbraw/zinc/93/53/35/1092935335.db2.gz OVROJGNNCLIXJP-SJPCQFCGSA-N 2 0 370.459 4.421 20 0 FIADRP C[C@@H](c1nc(-c2cccc(C[NH+]3CCCC3)c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443212204 1092985903 /nfs/dbraw/zinc/98/59/03/1092985903.db2.gz LVBVCOCTQQFJLW-ZACQAIPSSA-N 2 0 354.498 4.266 20 0 FIADRP COc1ccc([C@@H](C)NC2CC[NH+](Cc3ccccc3C)CC2)cc1O ZINC000521944565 1092991861 /nfs/dbraw/zinc/99/18/61/1092991861.db2.gz DZEWJMYUAISTMC-QGZVFWFLSA-N 2 0 354.494 4.024 20 0 FIADRP C[C@H](CC[N@@H+]1CCC[C@@]2(CCSC2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000451963981 1093161787 /nfs/dbraw/zinc/16/17/87/1093161787.db2.gz IJUJKIBKINCSLS-AQNXPRMDSA-N 2 0 368.656 4.203 20 0 FIADRP FC(F)(F)c1csc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000152191550 1093161984 /nfs/dbraw/zinc/16/19/84/1093161984.db2.gz NODZUMOFLWUIFZ-UHFFFAOYSA-N 2 0 361.477 4.091 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)N(O)C2(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168018836 1093173904 /nfs/dbraw/zinc/17/39/04/1093173904.db2.gz FLPXBCVMHYSHSA-PIKOESSRSA-N 2 0 359.558 4.038 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474073456 1093185997 /nfs/dbraw/zinc/18/59/97/1093185997.db2.gz MKRNHZXIAJPPCN-INIZCTEOSA-N 2 0 356.341 4.035 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474073457 1093186451 /nfs/dbraw/zinc/18/64/51/1093186451.db2.gz MKRNHZXIAJPPCN-MRXNPFEDSA-N 2 0 356.341 4.035 20 0 FIADRP C[C@H]1CC([NH2+]CCCCc2ccccn2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168020886 1093226158 /nfs/dbraw/zinc/22/61/58/1093226158.db2.gz OJNQUTXRXPPRID-PMACEKPBSA-N 2 0 351.538 4.436 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2ccc(F)c(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168021968 1093261154 /nfs/dbraw/zinc/26/11/54/1093261154.db2.gz RQSFYNODOZLZBX-LIWAJOSJSA-N 2 0 374.475 4.029 20 0 FIADRP C[C@@H]1CC([NH2+][C@@]23C[C@H]4C[C@@H](C2)C[C@](O)(C4)C3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168022429 1093302931 /nfs/dbraw/zinc/30/29/31/1093302931.db2.gz RXXKGJGQMPMEAZ-QFDBTTLJSA-N 2 0 368.565 4.101 20 0 FIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647788465 1093348379 /nfs/dbraw/zinc/34/83/79/1093348379.db2.gz JYRYOZPLWRTQBS-RBSFLKMASA-N 2 0 353.491 4.034 20 0 FIADRP CCN(CC)Cc1nc(C2([NH2+]C[C@@H]3C(C)=CCC[C@@H]3C)CCCC2)no1 ZINC000443639441 1093365308 /nfs/dbraw/zinc/36/53/08/1093365308.db2.gz GPOLBGNQUVWFAJ-ZWKOTPCHSA-N 2 0 360.546 4.263 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168024092 1093374501 /nfs/dbraw/zinc/37/45/01/1093374501.db2.gz ZTWIYEPESRZFPT-NSFFCOSOSA-N 2 0 372.553 4.140 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C1 ZINC000512826734 1093402802 /nfs/dbraw/zinc/40/28/02/1093402802.db2.gz ITZYPXUISLYVPG-ROUUACIJSA-N 2 0 374.960 4.373 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1)c1ccccc1 ZINC000474149745 1093465464 /nfs/dbraw/zinc/46/54/64/1093465464.db2.gz JREQVDQYHCEHOT-WPFOTENUSA-N 2 0 371.613 4.307 20 0 FIADRP C[NH+](Cc1cc(Br)ccc1C[N@@H+](C)C1CCC1)C1CCC1 ZINC000433251888 1093506411 /nfs/dbraw/zinc/50/64/11/1093506411.db2.gz JRBQHUUXXQRGOO-UHFFFAOYSA-N 2 0 351.332 4.418 20 0 FIADRP Fc1cc(Br)ccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500918035 1093513614 /nfs/dbraw/zinc/51/36/14/1093513614.db2.gz MGEISFAKYLWQTP-UHFFFAOYSA-N 2 0 357.311 4.334 20 0 FIADRP Fc1ccc(Br)cc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500919265 1093527396 /nfs/dbraw/zinc/52/73/96/1093527396.db2.gz OCSQTFZMVQPMFW-UHFFFAOYSA-N 2 0 357.311 4.334 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474274583 1093642947 /nfs/dbraw/zinc/64/29/47/1093642947.db2.gz HFSVTKMJOXAORU-UHFFFAOYSA-N 2 0 373.368 4.359 20 0 FIADRP CCOC(=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168032221 1093652455 /nfs/dbraw/zinc/65/24/55/1093652455.db2.gz GQDPZVMSRRGFPI-WQIFRTTPSA-N 2 0 372.553 4.140 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccco1 ZINC000513073787 1093777315 /nfs/dbraw/zinc/77/73/15/1093777315.db2.gz FTWYJEJJIBTFSP-HMXCVIKNSA-N 2 0 361.574 4.295 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000474479511 1093814437 /nfs/dbraw/zinc/81/44/37/1093814437.db2.gz RMNSUAZRLLOYPP-RBUKOAKNSA-N 2 0 362.558 4.298 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccccc1C ZINC000474478133 1093814984 /nfs/dbraw/zinc/81/49/84/1093814984.db2.gz KRPJCCGRWCUFHE-UHFFFAOYSA-N 2 0 362.521 4.312 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000474474551 1093820175 /nfs/dbraw/zinc/82/01/75/1093820175.db2.gz HFRCMLJDVXUSSZ-QRVBRYPASA-N 2 0 362.558 4.298 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OC ZINC000474484544 1093831103 /nfs/dbraw/zinc/83/11/03/1093831103.db2.gz KOEMSMHQCJYNPG-SJORKVTESA-N 2 0 356.510 4.047 20 0 FIADRP C[N@H+](CC/C=C\c1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513152692 1093911759 /nfs/dbraw/zinc/91/17/59/1093911759.db2.gz FWZRJXUJHCFINO-SWROQVPMSA-N 2 0 363.343 4.409 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cc1 ZINC000513372735 1094090436 /nfs/dbraw/zinc/09/04/36/1094090436.db2.gz QZDJQWMJHMPTMW-XQBPLPMBSA-N 2 0 371.569 4.006 20 0 FIADRP Cc1cccc2ncc(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)n21 ZINC000513493435 1094161369 /nfs/dbraw/zinc/16/13/69/1094161369.db2.gz ASEIVVIXIFAXBN-FPOVZHCZSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1ccc2ncc(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)n2c1 ZINC000513500301 1094172814 /nfs/dbraw/zinc/17/28/14/1094172814.db2.gz LTEXZIYGTUBQON-TZIWHRDSSA-N 2 0 362.521 4.033 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1OC ZINC000513499808 1094173030 /nfs/dbraw/zinc/17/30/30/1094173030.db2.gz IXZCODLMEVSWNO-GHTZIAJQSA-N 2 0 368.521 4.094 20 0 FIADRP C[N@H+](CCCN[C@@H](Cc1ccccn1)c1cccnc1)C1CCCCC1 ZINC000513501579 1094173845 /nfs/dbraw/zinc/17/38/45/1094173845.db2.gz UDQAIQUJJLWBNO-QFIPXVFZSA-N 2 0 352.526 4.005 20 0 FIADRP CC(=O)Nc1ccccc1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513501971 1094173880 /nfs/dbraw/zinc/17/38/80/1094173880.db2.gz WEFQSXYXOKQWTE-GHTZIAJQSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000513523828 1094196955 /nfs/dbraw/zinc/19/69/55/1094196955.db2.gz CLJKSDUQFJVJGA-SIKLNZKXSA-N 2 0 352.526 4.005 20 0 FIADRP C[C@H]1CC([NH2+]C[C@H]2CCc3ccccc3O2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168036736 1094298050 /nfs/dbraw/zinc/29/80/50/1094298050.db2.gz WSGFMFAQRJFOAW-SFYKDHMMSA-N 2 0 364.533 4.411 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)c(OC(F)F)c1 ZINC000513698099 1094361300 /nfs/dbraw/zinc/36/13/00/1094361300.db2.gz WMFWQPFZIYRRRB-KURKYZTESA-N 2 0 368.468 4.039 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000501013541 1094431341 /nfs/dbraw/zinc/43/13/41/1094431341.db2.gz ZVOSGDMIEPTRNM-OAQYLSRUSA-N 2 0 363.977 4.187 20 0 FIADRP C[N@@H+](Cc1ccc(F)c2cccnc12)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501051645 1094457693 /nfs/dbraw/zinc/45/76/93/1094457693.db2.gz ZGNNJUKMKXXIQC-UHFFFAOYSA-N 2 0 364.468 4.117 20 0 FIADRP CC(C)C[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1 ZINC000474797808 1094614403 /nfs/dbraw/zinc/61/44/03/1094614403.db2.gz ABALIQAGEVXYGA-MZYLBHOOSA-N 2 0 358.570 4.174 20 0 FIADRP CC(C)[C@@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1 ZINC000474799922 1094616644 /nfs/dbraw/zinc/61/66/44/1094616644.db2.gz JPWBTGJMUYKKQN-XMMPIXPASA-N 2 0 366.549 4.173 20 0 FIADRP Cc1ccc(CCC[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000474814008 1094658335 /nfs/dbraw/zinc/65/83/35/1094658335.db2.gz FNZVBZUIOSRJNS-RTBURBONSA-N 2 0 351.538 4.069 20 0 FIADRP CCOC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000474815324 1094660410 /nfs/dbraw/zinc/66/04/10/1094660410.db2.gz FHJAKBYWFABVLU-IRLDBZIGSA-N 2 0 356.510 4.206 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000501390754 1094675733 /nfs/dbraw/zinc/67/57/33/1094675733.db2.gz UFQLFUNHDBJLRW-RBBKRZOGSA-N 2 0 367.537 4.228 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000474876635 1094839375 /nfs/dbraw/zinc/83/93/75/1094839375.db2.gz DPIRSMLFCTXFEJ-GUDVDZBRSA-N 2 0 362.558 4.153 20 0 FIADRP Cc1nc([C@@H](C)[N@@H+]2CCC3(C2)CC[NH2+]CC3)oc1-c1ccc(Cl)cc1 ZINC000420308269 1094873202 /nfs/dbraw/zinc/87/32/02/1094873202.db2.gz NIMGCBOLAKKFLY-OAHLLOKOSA-N 2 0 359.901 4.440 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420373855 1094903653 /nfs/dbraw/zinc/90/36/53/1094903653.db2.gz GWYSQXIJHQUSCL-OCBCSQNSSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](CCCSc3ccccc3Cl)CC2)C1 ZINC000420383129 1094907304 /nfs/dbraw/zinc/90/73/04/1094907304.db2.gz FDCUYIIJKXPWCV-WMZOPIPTSA-N 2 0 368.974 4.041 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000474943871 1094938486 /nfs/dbraw/zinc/93/84/86/1094938486.db2.gz OEHLVGQEIDGUOR-HOIFWPIMSA-N 2 0 372.940 4.188 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)C1 ZINC000502278023 1095296507 /nfs/dbraw/zinc/29/65/07/1095296507.db2.gz SSTOXVIQWUTIBB-UGKGYDQZSA-N 2 0 356.554 4.357 20 0 FIADRP C[N@@H+](Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC1CC[NH+](C)CC1 ZINC000513741281 1095335776 /nfs/dbraw/zinc/33/57/76/1095335776.db2.gz JSLSUYJOQZUQCD-UHFFFAOYSA-N 2 0 368.365 4.498 20 0 FIADRP CC(C)Oc1ccccc1C[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000502328209 1095385919 /nfs/dbraw/zinc/38/59/19/1095385919.db2.gz UTBQPRQLGCMTTN-IBGZPJMESA-N 2 0 353.510 4.386 20 0 FIADRP C[C@@H]1CC([N@H+]2C[C@H]3c4ccccc4C(=O)[C@H]3C2)C[C@@H](C)N1Cc1ccccc1 ZINC001168048301 1095445841 /nfs/dbraw/zinc/44/58/41/1095445841.db2.gz VFTJWXUGZKUTJV-LFVIRAHLSA-N 2 0 374.528 4.340 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000421368495 1095565964 /nfs/dbraw/zinc/56/59/64/1095565964.db2.gz GFOKODZZVFFFPS-UHFFFAOYSA-N 2 0 368.569 4.191 20 0 FIADRP COc1ccc(Cl)cc1C[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000502880585 1095917119 /nfs/dbraw/zinc/91/71/19/1095917119.db2.gz QGNXQXUKYHZHSL-LPHOPBHVSA-N 2 0 350.934 4.087 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccncc1Cl ZINC000421828435 1095941163 /nfs/dbraw/zinc/94/11/63/1095941163.db2.gz CQWQDVCPBBUUBA-MRXNPFEDSA-N 2 0 359.901 4.060 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000421886030 1095975383 /nfs/dbraw/zinc/97/53/83/1095975383.db2.gz UYDGBOVRBMKDHG-PPUFBPAQSA-N 2 0 355.295 4.038 20 0 FIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cnn1-c1cccc(Cl)c1 ZINC000421883684 1095975439 /nfs/dbraw/zinc/97/54/39/1095975439.db2.gz TYOYHBCRKPXEFH-NNGSBXSVSA-N 2 0 360.933 4.358 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000421887513 1095976258 /nfs/dbraw/zinc/97/62/58/1095976258.db2.gz VYSLELCLUGDJFI-CBNMVNINSA-N 2 0 357.929 4.481 20 0 FIADRP C[C@H](C[NH+](C)CCCC[N@@H+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273115133 1096235898 /nfs/dbraw/zinc/23/58/98/1096235898.db2.gz QRYNBKVFABGOIR-IYBDPMFKSA-N 2 0 366.600 4.151 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000414658926 1096358626 /nfs/dbraw/zinc/35/86/26/1096358626.db2.gz KKLYISRCQMLKBZ-UHFFFAOYSA-N 2 0 355.507 4.378 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000414663884 1096375883 /nfs/dbraw/zinc/37/58/83/1096375883.db2.gz SEDVPKAIYSUEGC-RBUKOAKNSA-N 2 0 360.505 4.017 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422733117 1096465861 /nfs/dbraw/zinc/46/58/61/1096465861.db2.gz ATNQLPFCGUUVJE-QCSUPXKISA-N 2 0 367.356 4.105 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1OC1CCCC1 ZINC000422716389 1096469284 /nfs/dbraw/zinc/46/92/84/1096469284.db2.gz UEPRABOCBSWOJD-HSALFYBXSA-N 2 0 358.526 4.027 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCCSc1ccccc1Br ZINC000422759073 1096474870 /nfs/dbraw/zinc/47/48/70/1096474870.db2.gz OVAJGZATPZWIQC-DZGCQCFKSA-N 2 0 357.361 4.038 20 0 FIADRP Cc1ccc(C[C@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c2ccccn2)cc1 ZINC000422742740 1096478252 /nfs/dbraw/zinc/47/82/52/1096478252.db2.gz HAFDMQWEJAXGSK-MBSDFSHPSA-N 2 0 360.505 4.187 20 0 FIADRP CC(C)COc1ccccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422745013 1096479440 /nfs/dbraw/zinc/47/94/40/1096479440.db2.gz XAMQHATXHGSVHP-NZQKXSOJSA-N 2 0 366.505 4.067 20 0 FIADRP CC[C@@H]1C[C@H](C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000503591393 1096488049 /nfs/dbraw/zinc/48/80/49/1096488049.db2.gz HRQVRWZBSCYLIL-WIYYLYMNSA-N 2 0 356.510 4.206 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000422780070 1096489101 /nfs/dbraw/zinc/48/91/01/1096489101.db2.gz JSVUYTWCVOWAIT-UZLBHIALSA-N 2 0 364.892 4.220 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C(C)C)cc1 ZINC000422786469 1096491112 /nfs/dbraw/zinc/49/11/12/1096491112.db2.gz OXPSXOMLTIQWRH-MDNUFGMLSA-N 2 0 366.505 4.238 20 0 FIADRP CC[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1F ZINC000422762270 1096491184 /nfs/dbraw/zinc/49/11/84/1096491184.db2.gz MMFXIRYJIDTNLL-ZJOUEHCJSA-N 2 0 358.432 4.261 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H](Cc3ccccc3)[C@@H](C)[NH3+])s2)cs1 ZINC000422796991 1096493936 /nfs/dbraw/zinc/49/39/36/1096493936.db2.gz KUQUIIJKMMNFRF-KDOFPFPSSA-N 2 0 371.575 4.271 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422801660 1096494614 /nfs/dbraw/zinc/49/46/14/1096494614.db2.gz CIENTPLWLHIEPC-KCSJKLDESA-N 2 0 356.554 4.363 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000422813887 1096498621 /nfs/dbraw/zinc/49/86/21/1096498621.db2.gz YUXJCKNCBBWYPL-LADGPHEKSA-N 2 0 371.484 4.094 20 0 FIADRP COc1ccc2ccccc2c1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422813549 1096498628 /nfs/dbraw/zinc/49/86/28/1096498628.db2.gz ZNPNXIVIPIJCSO-ZJSXRUAMSA-N 2 0 374.484 4.194 20 0 FIADRP c1nc2ccccc2n1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422828249 1096500279 /nfs/dbraw/zinc/50/02/79/1096500279.db2.gz ODRSJNJTAHLAAZ-BHDDXSALSA-N 2 0 374.532 4.095 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000422825148 1096500349 /nfs/dbraw/zinc/50/03/49/1096500349.db2.gz JDLWIRLDHUATJE-BFUOFWGJSA-N 2 0 361.436 4.178 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000422825150 1096500877 /nfs/dbraw/zinc/50/08/77/1096500877.db2.gz JDLWIRLDHUATJE-ORAYPTAESA-N 2 0 361.436 4.178 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000422834880 1096501820 /nfs/dbraw/zinc/50/18/20/1096501820.db2.gz HXAHSAJEBVZWBY-MRXNPFEDSA-N 2 0 373.500 4.301 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)c(Cl)c1 ZINC000422832270 1096501894 /nfs/dbraw/zinc/50/18/94/1096501894.db2.gz FLSBEFUFSSFPCA-JCGIZDLHSA-N 2 0 371.352 4.018 20 0 FIADRP Cc1cccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422858895 1096506470 /nfs/dbraw/zinc/50/64/70/1096506470.db2.gz JFFXPWUVQSOMEJ-BHIFYINESA-N 2 0 366.505 4.034 20 0 FIADRP CSCc1cc(F)ccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422866577 1096507767 /nfs/dbraw/zinc/50/77/67/1096507767.db2.gz QSFYSTFSJCAPTQ-FPOVZHCZSA-N 2 0 372.509 4.034 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(OC(F)F)c1 ZINC000422876602 1096509855 /nfs/dbraw/zinc/50/98/55/1096509855.db2.gz GMTRUSIWBWJSRR-HLLQZAQXSA-N 2 0 374.431 4.195 20 0 FIADRP CC(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422891059 1096515037 /nfs/dbraw/zinc/51/50/37/1096515037.db2.gz UOVLJVKBDJUGOM-XPWALMASSA-N 2 0 370.581 4.369 20 0 FIADRP Cc1c2cc(F)ccc2oc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422897789 1096518171 /nfs/dbraw/zinc/51/81/71/1096518171.db2.gz CVHSUWPUTMVOFH-AVRDEDQJSA-N 2 0 366.436 4.226 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000422875523 1096518533 /nfs/dbraw/zinc/51/85/33/1096518533.db2.gz PAIUDNNLWYYYOG-SCLBCKFNSA-N 2 0 365.290 4.395 20 0 FIADRP [NH3+]CC1CCC([NH2+]Cc2ccccc2-c2ccc(Cn3cccn3)cc2)CC1 ZINC000422902909 1096520578 /nfs/dbraw/zinc/52/05/78/1096520578.db2.gz DYLHKOIQIRIQFI-UHFFFAOYSA-N 2 0 374.532 4.206 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000422911478 1096522235 /nfs/dbraw/zinc/52/22/35/1096522235.db2.gz SXZOBTWVOXELAR-CYBMUJFWSA-N 2 0 365.443 4.496 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000422912669 1096522989 /nfs/dbraw/zinc/52/29/89/1096522989.db2.gz WQHUKBUPGIGKBI-UWWQBHOKSA-N 2 0 371.550 4.174 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(C)cc1)c1ccc(F)cc1Cl ZINC000422892427 1096523927 /nfs/dbraw/zinc/52/39/27/1096523927.db2.gz YNPSYAORIQNLCH-PXNSSMCTSA-N 2 0 364.892 4.220 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414703557 1096524582 /nfs/dbraw/zinc/52/45/82/1096524582.db2.gz CKYXUSSDKBLLED-DYESRHJHSA-N 2 0 372.557 4.185 20 0 FIADRP Cc1sc(CC[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)nc1-c1ccccc1 ZINC000422924710 1096525738 /nfs/dbraw/zinc/52/57/38/1096525738.db2.gz BAIPCIPUKVKYFT-CQSZACIVSA-N 2 0 366.534 4.174 20 0 FIADRP c1ccc2c(c1)cccc2OCC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422933989 1096529062 /nfs/dbraw/zinc/52/90/62/1096529062.db2.gz BWKKJCWPGBZTIE-ZJSXRUAMSA-N 2 0 374.484 4.064 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000422936985 1096530077 /nfs/dbraw/zinc/53/00/77/1096530077.db2.gz IYFWFJOZVNGVLU-GFCCVEGCSA-N 2 0 350.293 4.495 20 0 FIADRP c1sc2ccccc2c1CC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422938456 1096530718 /nfs/dbraw/zinc/53/07/18/1096530718.db2.gz POXNKGCIXNLWSC-UGKGYDQZSA-N 2 0 364.514 4.289 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2cccc(Br)c2)CCC1 ZINC000422937948 1096530744 /nfs/dbraw/zinc/53/07/44/1096530744.db2.gz KDLWQNFQCQTJDF-AWEZNQCLSA-N 2 0 374.326 4.341 20 0 FIADRP CC[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc(F)ccc1F ZINC000422919200 1096532216 /nfs/dbraw/zinc/53/22/16/1096532216.db2.gz JWUNEFGMTGGITN-QKNQBKEWSA-N 2 0 358.432 4.261 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)cc1OC ZINC000422917719 1096532543 /nfs/dbraw/zinc/53/25/43/1096532543.db2.gz GQIFXPQOXWQMDR-XOBRGWDASA-N 2 0 362.901 4.164 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)cc1OC ZINC000422917718 1096532883 /nfs/dbraw/zinc/53/28/83/1096532883.db2.gz GQIFXPQOXWQMDR-VLIAUNLRSA-N 2 0 362.901 4.164 20 0 FIADRP Clc1cccc(CCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422945636 1096535814 /nfs/dbraw/zinc/53/58/14/1096535814.db2.gz NMINLQWPDDLVFN-TZIWHRDSSA-N 2 0 356.897 4.118 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422990329 1096540511 /nfs/dbraw/zinc/54/05/11/1096540511.db2.gz BQXSUENXLMXBDJ-DHIUTWEWSA-N 2 0 361.489 4.146 20 0 FIADRP c1ccc(-c2cccc(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)c2)nc1 ZINC000422993807 1096542598 /nfs/dbraw/zinc/54/25/98/1096542598.db2.gz GHQICHTXIPEQNP-LADGPHEKSA-N 2 0 371.484 4.094 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NC[C@H]1CCC[C@H]([NH3+])C1)C1CCCCC1 ZINC000414710534 1096546072 /nfs/dbraw/zinc/54/60/72/1096546072.db2.gz LIYDLFVWBOQGGC-HKUYNNGSSA-N 2 0 372.557 4.090 20 0 FIADRP [NH3+]CC1CCC([NH2+]Cc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000423022054 1096551773 /nfs/dbraw/zinc/55/17/73/1096551773.db2.gz GYOMZEVIFHLFQP-UHFFFAOYSA-N 2 0 365.237 4.075 20 0 FIADRP Fc1ccc(C2(N[C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)c(F)c1 ZINC000423028196 1096554236 /nfs/dbraw/zinc/55/42/36/1096554236.db2.gz QJUARVSKATVBAF-PZJWPPBQSA-N 2 0 370.443 4.190 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423032916 1096555267 /nfs/dbraw/zinc/55/52/67/1096555267.db2.gz NNVPDLMERWYRLD-AWEZNQCLSA-N 2 0 358.357 4.065 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000423034227 1096556469 /nfs/dbraw/zinc/55/64/69/1096556469.db2.gz PPDUXJNMSKIYBD-QFBILLFUSA-N 2 0 367.320 4.426 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000423059263 1096560561 /nfs/dbraw/zinc/56/05/61/1096560561.db2.gz LJGNUPDIFYQYDW-ZDUSSCGKSA-N 2 0 363.427 4.250 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000423059262 1096560856 /nfs/dbraw/zinc/56/08/56/1096560856.db2.gz LJGNUPDIFYQYDW-CYBMUJFWSA-N 2 0 363.427 4.250 20 0 FIADRP Fc1cc(Br)cc([C@@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000423065926 1096562186 /nfs/dbraw/zinc/56/21/86/1096562186.db2.gz VQDWYVPNMBLMEH-UJJTZGENSA-N 2 0 367.306 4.302 20 0 FIADRP [NH3+]CC1CCC([NH2+][C@H](c2cc(F)cc(Br)c2)C2CC2)CC1 ZINC000423051243 1096565351 /nfs/dbraw/zinc/56/53/51/1096565351.db2.gz MTFPGYMZQKPJHC-XCKKERBNSA-N 2 0 355.295 4.146 20 0 FIADRP Brc1cccc(C[C@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000423054250 1096565999 /nfs/dbraw/zinc/56/59/99/1096565999.db2.gz UELRDBUYEBZHLQ-TUVJXNFZSA-N 2 0 363.343 4.033 20 0 FIADRP Fc1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423086985 1096569639 /nfs/dbraw/zinc/56/96/39/1096569639.db2.gz OMDJNTGSBWDJCY-DYJCROTPSA-N 2 0 366.480 4.307 20 0 FIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC000423123978 1096580107 /nfs/dbraw/zinc/58/01/07/1096580107.db2.gz NUAZONLUVXHSEW-CADBVGFASA-N 2 0 354.460 4.308 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cc1F ZINC000423109963 1096584295 /nfs/dbraw/zinc/58/42/95/1096584295.db2.gz OFQMBGSCGDXUCI-ZYHUDNBSSA-N 2 0 366.278 4.162 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000423142473 1096594720 /nfs/dbraw/zinc/59/47/20/1096594720.db2.gz VIIZDSXAZLAEQT-DDUZABMNSA-N 2 0 374.326 4.208 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423238399 1096618058 /nfs/dbraw/zinc/61/80/58/1096618058.db2.gz ADVKTGAMCYBZMH-OCCSQVGLSA-N 2 0 367.324 4.138 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]C[C@@H]2CCC[NH2+]C2)nc1 ZINC000423214066 1096619225 /nfs/dbraw/zinc/61/92/25/1096619225.db2.gz OJGNPGNQYFRWHF-KNQAVFIVSA-N 2 0 371.956 4.040 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423220623 1096620578 /nfs/dbraw/zinc/62/05/78/1096620578.db2.gz YNCPBKVCNXVMTH-QWRGUYRKSA-N 2 0 354.338 4.374 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc2cc(Br)ccc2o1 ZINC000423219789 1096621515 /nfs/dbraw/zinc/62/15/15/1096621515.db2.gz ULIROEOKMAHMLQ-RWMBFGLXSA-N 2 0 351.288 4.234 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC[C@H]3CCC[NH2+]C3)s2)cc1 ZINC000423258369 1096632643 /nfs/dbraw/zinc/63/26/43/1096632643.db2.gz LZBQWRRWGVHNPZ-GDBMZVCRSA-N 2 0 359.539 4.167 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cnn1-c1ccc(F)cc1 ZINC000423290910 1096636107 /nfs/dbraw/zinc/63/61/07/1096636107.db2.gz FWUIXTDDFFDNML-LSDHHAIUSA-N 2 0 352.457 4.190 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000423293159 1096637029 /nfs/dbraw/zinc/63/70/29/1096637029.db2.gz QASAPGUGVSJZCA-HZMBPMFUSA-N 2 0 351.313 4.307 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000423294528 1096643399 /nfs/dbraw/zinc/64/33/99/1096643399.db2.gz UQMHCAGTXVKGDF-KBPBESRZSA-N 2 0 352.400 4.498 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000423346792 1096646656 /nfs/dbraw/zinc/64/66/56/1096646656.db2.gz PQDYYGMSTJNKCT-GFCCVEGCSA-N 2 0 365.308 4.058 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cc1 ZINC000423341460 1096651293 /nfs/dbraw/zinc/65/12/93/1096651293.db2.gz UMUUJEXIACWEBD-IAGOWNOFSA-N 2 0 351.494 4.191 20 0 FIADRP Nc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423359229 1096656395 /nfs/dbraw/zinc/65/63/95/1096656395.db2.gz URWVPXAZXNVRFL-PIATZUFCSA-N 2 0 361.533 4.431 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC[NH2+]1 ZINC000423391518 1096664121 /nfs/dbraw/zinc/66/41/21/1096664121.db2.gz WXWWUABHVKGPEX-NDGTYSDOSA-N 2 0 362.315 4.038 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000423427726 1096673211 /nfs/dbraw/zinc/67/32/11/1096673211.db2.gz ISIRVUAJAIINPN-QZTJIDSGSA-N 2 0 366.509 4.081 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000423429776 1096682607 /nfs/dbraw/zinc/68/26/07/1096682607.db2.gz KOUVXEAOOWBLRV-PXAZEXFGSA-N 2 0 369.278 4.378 20 0 FIADRP c1ccc([C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccc3ccccc3n2)cc1 ZINC000423430733 1096683295 /nfs/dbraw/zinc/68/32/95/1096683295.db2.gz IGUABCYQSVQLDT-ZTCOLXNVSA-N 2 0 357.501 4.302 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000423459990 1096689248 /nfs/dbraw/zinc/68/92/48/1096689248.db2.gz APWLIRUCJPTCCI-ZLENFMNRSA-N 2 0 355.295 4.146 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccc(OC)cc2)cc1 ZINC000423471267 1096694338 /nfs/dbraw/zinc/69/43/38/1096694338.db2.gz DXWUSYAMGXWNNR-NFBKMPQASA-N 2 0 368.521 4.109 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000423480905 1096698620 /nfs/dbraw/zinc/69/86/20/1096698620.db2.gz WGCBTYMCNYDSCM-VBQJREDUSA-N 2 0 359.514 4.434 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)nc1 ZINC000423498126 1096699515 /nfs/dbraw/zinc/69/95/15/1096699515.db2.gz GMQLZBVSCQZKDV-COPCDDAFSA-N 2 0 371.956 4.168 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1F ZINC000423483780 1096703261 /nfs/dbraw/zinc/70/32/61/1096703261.db2.gz ZOIKYQYEGODDEH-DKSSEZFCSA-N 2 0 360.448 4.017 20 0 FIADRP COc1cc(OC)c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1Cl ZINC000423496700 1096708098 /nfs/dbraw/zinc/70/80/98/1096708098.db2.gz FKDMDSNMELJTKH-KDOFPFPSSA-N 2 0 362.901 4.488 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423534709 1096708606 /nfs/dbraw/zinc/70/86/06/1096708606.db2.gz ARMNHOQFLDUTLK-GOSISDBHSA-N 2 0 369.534 4.096 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423534717 1096708835 /nfs/dbraw/zinc/70/88/35/1096708835.db2.gz ARMNHOQFLDUTLK-SFHVURJKSA-N 2 0 369.534 4.096 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423524510 1096713262 /nfs/dbraw/zinc/71/32/62/1096713262.db2.gz XHLPQCNRVMYRKU-FXAWDEMLSA-N 2 0 356.510 4.013 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc2ccccc2c1OC(F)F ZINC000423547923 1096718341 /nfs/dbraw/zinc/71/83/41/1096718341.db2.gz QNNPPVQQLGFGHR-QMCVQRASSA-N 2 0 360.448 4.480 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccccc2Cl)cc1 ZINC000423549432 1096719069 /nfs/dbraw/zinc/71/90/69/1096719069.db2.gz RXKFNSYBXLVBNA-FBAVSBLXSA-N 2 0 370.924 4.416 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2ccccc2Cl)cc1 ZINC000423549433 1096719408 /nfs/dbraw/zinc/71/94/08/1096719408.db2.gz RXKFNSYBXLVBNA-FOUBCARRSA-N 2 0 370.924 4.416 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423551858 1096720216 /nfs/dbraw/zinc/72/02/16/1096720216.db2.gz UKWUEWYCHUQTEF-VYSRMENRSA-N 2 0 359.514 4.296 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1 ZINC000423579929 1096724974 /nfs/dbraw/zinc/72/49/74/1096724974.db2.gz XADRSGQWPNPJQE-GOSISDBHSA-N 2 0 369.578 4.053 20 0 FIADRP CCN(C(=O)[C@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1ccccc1 ZINC000515525042 1098664139 /nfs/dbraw/zinc/66/41/39/1098664139.db2.gz PUPZMPVMRRFFDJ-IBGZPJMESA-N 2 0 367.537 4.060 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCCOc3c(C(C)C)cccc32)CC[NH+](C)CC1 ZINC000515716977 1098868087 /nfs/dbraw/zinc/86/80/87/1098868087.db2.gz XNCCFGKGJABURO-LJQANCHMSA-N 2 0 362.583 4.441 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cc3c(cccc3F)[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000436298649 1098911261 /nfs/dbraw/zinc/91/12/61/1098911261.db2.gz ZLNCRFBCMIPSNA-SJLPKXTDSA-N 2 0 351.469 4.450 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436301832 1098916023 /nfs/dbraw/zinc/91/60/23/1098916023.db2.gz OTIHAPJGTIOWBH-IERDGZPVSA-N 2 0 351.469 4.307 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000515900791 1099020736 /nfs/dbraw/zinc/02/07/36/1099020736.db2.gz YVBVXXIVKHIQHY-GOTSBHOMSA-N 2 0 368.496 4.023 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(F)cc1OCC[NH+](C)C ZINC001211996094 1099229072 /nfs/dbraw/zinc/22/90/72/1099229072.db2.gz SUCOBEVBQBZNEO-UHFFFAOYSA-N 2 0 359.489 4.352 20 0 FIADRP Cc1cc(C)c(NC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)c(C)n1 ZINC000455478929 1099250304 /nfs/dbraw/zinc/25/03/04/1099250304.db2.gz NFWKCXLEFQSIAP-UHFFFAOYSA-N 2 0 366.509 4.041 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OCc1cccnc1 ZINC000067691375 1099488035 /nfs/dbraw/zinc/48/80/35/1099488035.db2.gz RQWZDIDIIZEQPM-HXUWFJFHSA-N 2 0 367.537 4.405 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000505925546 1099506411 /nfs/dbraw/zinc/50/64/11/1099506411.db2.gz USIZCAVTWHOTKN-NHCUHLMSSA-N 2 0 365.606 4.002 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cccc(Cl)c1F ZINC000161981105 1099562600 /nfs/dbraw/zinc/56/26/00/1099562600.db2.gz LGPCVFRFAONPCX-QGZVFWFLSA-N 2 0 365.880 4.055 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261638614 1099628787 /nfs/dbraw/zinc/62/87/87/1099628787.db2.gz DHKNSHNXTHPJBN-HSZRJFAPSA-N 2 0 360.505 4.018 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162265312 1099668585 /nfs/dbraw/zinc/66/85/85/1099668585.db2.gz OUTSXDCCGQOMGR-CVEARBPZSA-N 2 0 360.473 4.187 20 0 FIADRP C[C@H]1c2cccn2CC[NH+]1CCCCCC[N@@H+]1CCn2cccc2[C@@H]1C ZINC000729815061 1099697403 /nfs/dbraw/zinc/69/74/03/1099697403.db2.gz NAWFDWDRBUZKDE-PMACEKPBSA-N 2 0 354.542 4.303 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)cc1O ZINC000437350646 1099820413 /nfs/dbraw/zinc/82/04/13/1099820413.db2.gz WHSKDSNIMSRXHC-YLJYHZDGSA-N 2 0 360.542 4.109 20 0 FIADRP CCOCc1ccccc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508694343 1099826553 /nfs/dbraw/zinc/82/65/53/1099826553.db2.gz CPYNMDKYTMWMRC-KNQAVFIVSA-N 2 0 352.522 4.223 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000162552615 1099841655 /nfs/dbraw/zinc/84/16/55/1099841655.db2.gz DWIWNOHYXPZIEG-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713928 1099886495 /nfs/dbraw/zinc/88/64/95/1099886495.db2.gz AQHMRHPIGYHDDE-FXAWDEMLSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(SC2CCCC2)cc1 ZINC000162583070 1099899117 /nfs/dbraw/zinc/89/91/17/1099899117.db2.gz WUPLRFVNVAVUDT-GOSISDBHSA-N 2 0 361.599 4.009 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709832 1099899888 /nfs/dbraw/zinc/89/98/88/1099899888.db2.gz JWNLOLYUTWNSMH-GDKQOWJMSA-N 2 0 364.533 4.407 20 0 FIADRP CO[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000508721163 1099939064 /nfs/dbraw/zinc/93/90/64/1099939064.db2.gz UANVVRIKQWTLBG-PIPMEXSNSA-N 2 0 356.485 4.013 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722913 1099943590 /nfs/dbraw/zinc/94/35/90/1099943590.db2.gz YXOWVJJDWMAJFH-QPPBQGQZSA-N 3 0 371.613 4.245 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000467360074 1100104175 /nfs/dbraw/zinc/10/41/75/1100104175.db2.gz WFCXVVUHIAEVHO-FHGIMWBPSA-N 2 0 356.554 4.082 20 0 FIADRP c1ccc(OC2CCCC2)c(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459398344 1100106055 /nfs/dbraw/zinc/10/60/55/1100106055.db2.gz XWJVOAZBOYJOHR-UHFFFAOYSA-N 2 0 351.494 4.162 20 0 FIADRP FC(F)(F)c1cccc(CCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459393550 1100116637 /nfs/dbraw/zinc/11/66/37/1100116637.db2.gz YOUPZJGXIJKWMD-UHFFFAOYSA-N 2 0 363.427 4.292 20 0 FIADRP CC(C)(C)[C@H](COc1ccccc1F)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459437789 1100149055 /nfs/dbraw/zinc/14/90/55/1100149055.db2.gz ZALQBZONWZAYFZ-NRFANRHFSA-N 2 0 371.500 4.273 20 0 FIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1Cl ZINC000459419908 1100150760 /nfs/dbraw/zinc/15/07/60/1100150760.db2.gz XTXDIGPXACXHQF-UHFFFAOYSA-N 2 0 361.892 4.410 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1CN(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536672218 1100156200 /nfs/dbraw/zinc/15/62/00/1100156200.db2.gz OPWLQBANNBBACN-NRFANRHFSA-N 2 0 368.569 4.209 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2c(O)cccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000517187776 1100159837 /nfs/dbraw/zinc/15/98/37/1100159837.db2.gz YKJJSRKGZYWFHP-LRXVAGHRSA-N 2 0 350.506 4.270 20 0 FIADRP COc1ccccc1/C=C/CN(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536673995 1100160408 /nfs/dbraw/zinc/16/04/08/1100160408.db2.gz IZXRIRAWACNKRJ-NBILRRPASA-N 2 0 350.506 4.162 20 0 FIADRP COc1ccccc1/C=C\CN(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536673996 1100160847 /nfs/dbraw/zinc/16/08/47/1100160847.db2.gz IZXRIRAWACNKRJ-PRUHCIRGSA-N 2 0 350.506 4.162 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2cn(C3CCCC3)nc2-c2ccccn2)C1 ZINC000459427047 1100163183 /nfs/dbraw/zinc/16/31/83/1100163183.db2.gz OBLHRMUEBMNHRW-QUCCMNQESA-N 2 0 367.541 4.023 20 0 FIADRP CO[C@@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459447350 1100182573 /nfs/dbraw/zinc/18/25/73/1100182573.db2.gz QJKGZTUBIWMIKR-MGPUTAFESA-N 2 0 359.901 4.070 20 0 FIADRP CCO[C@@H]1C[C@@H]([NH2+]C2CCC(C[NH+](C)C)CC2)[C@H]1Sc1ccccc1 ZINC000459454487 1100194711 /nfs/dbraw/zinc/19/47/11/1100194711.db2.gz UERUTKRWCISZLQ-OYOWGXFISA-N 2 0 362.583 4.035 20 0 FIADRP c1nc2cc(C[NH+]3CCC4(CC[N@@H+](Cc5ccccc5)C4)CC3)ccc2[nH]1 ZINC000536708708 1100226859 /nfs/dbraw/zinc/22/68/59/1100226859.db2.gz OURCXRXVOJBGNQ-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP C[C@H](C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1)C[NH+]1CCCC1 ZINC000425913812 1100240298 /nfs/dbraw/zinc/24/02/98/1100240298.db2.gz GFTQQPWQDUOWGO-UTKZUKDTSA-N 2 0 357.929 4.340 20 0 FIADRP COc1cc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)ccc1C ZINC000517275159 1100240428 /nfs/dbraw/zinc/24/04/28/1100240428.db2.gz VWPZHAHNLAVBSV-UHFFFAOYSA-N 2 0 353.510 4.137 20 0 FIADRP C[C@@H](C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1)C[NH+]1CCCC1 ZINC000425913811 1100240551 /nfs/dbraw/zinc/24/05/51/1100240551.db2.gz GFTQQPWQDUOWGO-LAUBAEHRSA-N 2 0 357.929 4.340 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2csc3ccccc23)[C@H](C)C1 ZINC000536849948 1100363262 /nfs/dbraw/zinc/36/32/62/1100363262.db2.gz DRGOABVKVLOKPN-YLJYHZDGSA-N 2 0 360.567 4.170 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000536876137 1100397340 /nfs/dbraw/zinc/39/73/40/1100397340.db2.gz LGUGFNDEQPRUMF-WMZHIEFXSA-N 2 0 352.522 4.128 20 0 FIADRP COCC[NH+]1CCC(N[C@@H](c2ccsc2)c2ccc(Cl)cc2)CC1 ZINC000536876965 1100399922 /nfs/dbraw/zinc/39/99/22/1100399922.db2.gz MGFQHWRRTDZKKP-LJQANCHMSA-N 2 0 364.942 4.191 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OC ZINC000459658290 1100405741 /nfs/dbraw/zinc/40/57/41/1100405741.db2.gz KEOZYSLJKIOUSE-UHFFFAOYSA-N 2 0 359.857 4.075 20 0 FIADRP CC(C)(C)c1nn(Cc2ccccc2)cc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459662175 1100410152 /nfs/dbraw/zinc/41/01/52/1100410152.db2.gz SPAQEEPNFXHDHC-UHFFFAOYSA-N 2 0 373.504 4.166 20 0 FIADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414932711 1100695332 /nfs/dbraw/zinc/69/53/32/1100695332.db2.gz DESFIFFQVGKRAE-KSSFIOAISA-N 2 0 360.933 4.046 20 0 FIADRP [NH3+]C[C@H](NC1CC[NH+](CCc2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414948989 1100911642 /nfs/dbraw/zinc/91/16/42/1100911642.db2.gz ZEKBGCQBGFTHCV-VWLOTQADSA-N 2 0 373.544 4.136 20 0 FIADRP FC(F)(F)c1cc(Br)ccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414973342 1101060641 /nfs/dbraw/zinc/06/06/41/1101060641.db2.gz ZHRFCZBIEKEAMI-CYBMUJFWSA-N 2 0 365.237 4.090 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439143901 1101199058 /nfs/dbraw/zinc/19/90/58/1101199058.db2.gz TUZHBTKWYDFZNP-ZENOOKHLSA-N 2 0 357.361 4.424 20 0 FIADRP Brc1ccccc1C1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000426325185 1101259395 /nfs/dbraw/zinc/25/93/95/1101259395.db2.gz UMODVYFKWBLHCM-HOTGVXAUSA-N 2 0 363.343 4.087 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1OCCc2sccc21 ZINC000426355033 1101351503 /nfs/dbraw/zinc/35/15/03/1101351503.db2.gz XKWGKCOEHUQONI-WCIYBSDLSA-N 2 0 370.562 4.251 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000459741297 1101366881 /nfs/dbraw/zinc/36/68/81/1101366881.db2.gz VGSFALYDSREOSR-KRWDZBQOSA-N 2 0 373.928 4.136 20 0 FIADRP Fc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000537000350 1101387887 /nfs/dbraw/zinc/38/78/87/1101387887.db2.gz BKSROJDXAQVPRI-CVDCTZTESA-N 2 0 352.497 4.431 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013765 1101394506 /nfs/dbraw/zinc/39/45/06/1101394506.db2.gz QODUNEOYGMFSCH-YTFSRNRJSA-N 2 0 374.544 4.415 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190272 1101524347 /nfs/dbraw/zinc/52/43/47/1101524347.db2.gz YVYNWLTWZUIEAF-OAOOKAIFSA-N 2 0 362.517 4.498 20 0 FIADRP CCc1ccccc1C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537197903 1101533108 /nfs/dbraw/zinc/53/31/08/1101533108.db2.gz KUKIKQUTAXVZTC-OAQYLSRUSA-N 2 0 350.506 4.327 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000518760769 1101533726 /nfs/dbraw/zinc/53/37/26/1101533726.db2.gz XHUKDOBIPBGHGX-QFIPXVFZSA-N 2 0 352.522 4.396 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cn(C)nc2C(C)(C)C)CC1)CC1CC1 ZINC000537201163 1101535643 /nfs/dbraw/zinc/53/56/43/1101535643.db2.gz UCQSKEWCZUHVGE-UHFFFAOYSA-N 2 0 360.590 4.052 20 0 FIADRP C[N@H+](CCCCCc1cc(-c2cccc(F)c2)no1)CC1CC[NH2+]CC1 ZINC000178968450 1101539974 /nfs/dbraw/zinc/53/99/74/1101539974.db2.gz OJUWJJDPSKAZSR-UHFFFAOYSA-N 2 0 359.489 4.125 20 0 FIADRP c1nc2ccccc2n1-c1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000518782076 1101581317 /nfs/dbraw/zinc/58/13/17/1101581317.db2.gz KCNIMDIWEACGPZ-UHFFFAOYSA-N 2 0 360.505 4.132 20 0 FIADRP c1cnn(CCCCC[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000475748179 1101587556 /nfs/dbraw/zinc/58/75/56/1101587556.db2.gz MKUGIIBOZJABQA-QHCPKHFHSA-N 2 0 366.553 4.042 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536849911 1101994827 /nfs/dbraw/zinc/99/48/27/1101994827.db2.gz CBZLDBKSNAQGEO-FHWLQOOXSA-N 2 0 371.352 4.412 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2C(C)C)CC1 ZINC000519223330 1102020850 /nfs/dbraw/zinc/02/08/50/1102020850.db2.gz ZWMZYBRGQXXGQS-GOSISDBHSA-N 2 0 359.558 4.191 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cc(C)cc(C)c2)CC1 ZINC000519225111 1102021137 /nfs/dbraw/zinc/02/11/37/1102021137.db2.gz SSMDPNDFNXVWNC-IBGZPJMESA-N 2 0 359.558 4.074 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1OC(F)F ZINC000120972911 1102292253 /nfs/dbraw/zinc/29/22/53/1102292253.db2.gz UIZANEFSBREMLM-LBPRGKRZSA-N 2 0 370.390 4.479 20 0 FIADRP c1ccc(COCc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)c2)cc1 ZINC000415085991 1102323267 /nfs/dbraw/zinc/32/32/67/1102323267.db2.gz UBOZNGKRWBTMJD-WXFUMESZSA-N 2 0 364.533 4.414 20 0 FIADRP FC(F)(F)c1cccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968630 1102326413 /nfs/dbraw/zinc/32/64/13/1102326413.db2.gz UJXZDHWHDKNIHV-YQQQUEKLSA-N 2 0 352.444 4.243 20 0 FIADRP C[NH+](C)C[C@H](N[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000550796790 1102326547 /nfs/dbraw/zinc/32/65/47/1102326547.db2.gz AWLORWWHQVORBF-FDFHNCONSA-N 2 0 371.956 4.368 20 0 FIADRP C[C@@H]1C[C@@H](NC[C@H](c2ccco2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000532441723 1102329759 /nfs/dbraw/zinc/32/97/59/1102329759.db2.gz FHAKPWRZKLRPMI-BAGYTPMASA-N 2 0 367.537 4.059 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]3CCC[NH2+]C3)s2)cc1 ZINC000415097796 1102354645 /nfs/dbraw/zinc/35/46/45/1102354645.db2.gz DNJJYUMAVSDDOL-GRDNDAEWSA-N 2 0 359.539 4.166 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000121274941 1102361809 /nfs/dbraw/zinc/36/18/09/1102361809.db2.gz JCHPKVKXGRVKNY-RTBURBONSA-N 2 0 363.615 4.111 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3CCC[NH2+][C@H]3c3ccccc3)n2)cc1 ZINC001211850193 1102377528 /nfs/dbraw/zinc/37/75/28/1102377528.db2.gz WLWLCGIDCKPFRT-UXHICEINSA-N 2 0 362.477 4.007 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCCN(C)C2)CCC3)cc1 ZINC000532507025 1102434777 /nfs/dbraw/zinc/43/47/77/1102434777.db2.gz LAKPLADTRYVWQC-FUHWJXTLSA-N 2 0 355.551 4.427 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000121817781 1102477483 /nfs/dbraw/zinc/47/74/83/1102477483.db2.gz WFUQZTNGPKTYJD-QFIPXVFZSA-N 2 0 350.506 4.240 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000121906976 1102482694 /nfs/dbraw/zinc/48/26/94/1102482694.db2.gz RUFVWCVFWIMFPT-JOCHJYFZSA-N 2 0 373.585 4.031 20 0 FIADRP CCCOc1c(Cl)cc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1OCC ZINC000506849392 1102541127 /nfs/dbraw/zinc/54/11/27/1102541127.db2.gz ACXOYNAKVMSURL-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP COc1cccc(CC(C)(C)C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167975199 1102588174 /nfs/dbraw/zinc/58/81/74/1102588174.db2.gz LSIMSNNMVTVBQN-SEJPIABJSA-N 2 0 356.554 4.259 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Br)cc3Cl)CC2)CC[N@@H+]1C ZINC000550883084 1102655192 /nfs/dbraw/zinc/65/51/92/1102655192.db2.gz RTCGIYPVRHRIOI-TZMCWYRMSA-N 2 0 371.750 4.206 20 0 FIADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885779 1102656573 /nfs/dbraw/zinc/65/65/73/1102656573.db2.gz JIWFAVASLGRRDV-KCZVDYSFSA-N 2 0 370.581 4.330 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)ccn1 ZINC000550886003 1102658286 /nfs/dbraw/zinc/65/82/86/1102658286.db2.gz AWFJFXYFTZUTET-MSOLQXFVSA-N 2 0 353.510 4.315 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)cc1 ZINC000550886168 1102658853 /nfs/dbraw/zinc/65/88/53/1102658853.db2.gz DULXXGIHWOIAPA-QHCPKHFHSA-N 2 0 368.521 4.280 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257334 1102676335 /nfs/dbraw/zinc/67/63/35/1102676335.db2.gz LDTMPTKLHDWHAW-DNVJHFABSA-N 2 0 364.533 4.243 20 0 FIADRP c1nn(Cc2ccccc2)cc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000537650402 1102691365 /nfs/dbraw/zinc/69/13/65/1102691365.db2.gz BXZNBHNGQJIRMT-UHFFFAOYSA-N 2 0 366.553 4.019 20 0 FIADRP Cc1nc2ccccc2nc1C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000550964208 1102731469 /nfs/dbraw/zinc/73/14/69/1102731469.db2.gz SWPDQIZUVIDJTA-UHFFFAOYSA-N 2 0 374.532 4.282 20 0 FIADRP COc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1OC ZINC000551007863 1102759326 /nfs/dbraw/zinc/75/93/26/1102759326.db2.gz SDUIRPOQLQZBRG-RTWAWAEBSA-N 2 0 368.521 4.062 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)nc3scc(C4CC4)n23)CC1 ZINC000459305769 1102768904 /nfs/dbraw/zinc/76/89/04/1102768904.db2.gz QDWXXXIDVLJIMT-UHFFFAOYSA-N 2 0 360.571 4.135 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000551004570 1102773049 /nfs/dbraw/zinc/77/30/49/1102773049.db2.gz BZGGFRQNIAGNPE-RPWUZVMVSA-N 2 0 365.565 4.454 20 0 FIADRP C[C@@H](NC1CC[NH+](C[C@H]2CCCO2)CC1)c1cc(Cl)ccc1Cl ZINC000655755968 1102774635 /nfs/dbraw/zinc/77/46/35/1102774635.db2.gz JUXIFKXEJXLNKI-CZUORRHYSA-N 2 0 357.325 4.287 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)[C@@]1(C)CCCO1 ZINC000551030140 1102808845 /nfs/dbraw/zinc/80/88/45/1102808845.db2.gz XYCVWGVCRQWSGD-OXQOHEQNSA-N 2 0 350.934 4.099 20 0 FIADRP Cc1ccc(-c2cccc(C[N@H+]3CCO[C@@H]4C[C@@H]([NH+](C)C)CC[C@@H]43)c2)cc1 ZINC000537692732 1102852212 /nfs/dbraw/zinc/85/22/12/1102852212.db2.gz MGKFADMEAGMBQX-KMDXXIMOSA-N 2 0 364.533 4.346 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123202593 1102880997 /nfs/dbraw/zinc/88/09/97/1102880997.db2.gz XVFPJOWSGBXKHD-SFHVURJKSA-N 2 0 373.585 4.192 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1cnc(C2CC2)nc1)C1CCCCC1 ZINC000459368992 1102941855 /nfs/dbraw/zinc/94/18/55/1102941855.db2.gz GMPAJNUQCFQKJV-UHFFFAOYSA-N 2 0 364.537 4.408 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc(Cl)cs3)cc2)CC1 ZINC000551227202 1102983912 /nfs/dbraw/zinc/98/39/12/1102983912.db2.gz KZVBEEODILCZFA-UHFFFAOYSA-N 2 0 350.915 4.164 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3nc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000426808529 1103004746 /nfs/dbraw/zinc/00/47/46/1103004746.db2.gz RWYGXRZPKPORJB-CALCHBBNSA-N 2 0 373.566 4.008 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000551264679 1103024731 /nfs/dbraw/zinc/02/47/31/1103024731.db2.gz LDHYVSSCXFFFRH-SFHVURJKSA-N 2 0 360.546 4.133 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CC[C@@H]3C3CCC3)C3(C2)CCOCC3)cc1 ZINC000551265620 1103025445 /nfs/dbraw/zinc/02/54/45/1103025445.db2.gz WZSJKWBFFVXCFF-YTFSRNRJSA-N 2 0 368.565 4.084 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCCCN2C2CC2)CC1 ZINC000551278107 1103037374 /nfs/dbraw/zinc/03/73/74/1103037374.db2.gz LQDIUFMTIJIFOF-YDPRHXJPSA-N 2 0 355.570 4.036 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000729682780 1103050205 /nfs/dbraw/zinc/05/02/05/1103050205.db2.gz KSQZGAGSNLUAEZ-QFIPXVFZSA-N 2 0 352.522 4.476 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)ccc1O ZINC000459382718 1103105173 /nfs/dbraw/zinc/10/51/73/1103105173.db2.gz WXHIJUKBVBUZOO-GOSISDBHSA-N 2 0 368.521 4.313 20 0 FIADRP c1ccc(Sc2ccc(C[NH2+]CCCC[NH+]3CCOCC3)cc2)cc1 ZINC000532804398 1103221836 /nfs/dbraw/zinc/22/18/36/1103221836.db2.gz DGSARLBRGLZKSV-UHFFFAOYSA-N 2 0 356.535 4.040 20 0 FIADRP C[N@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccc(-n2ccnc2)cc1 ZINC000507313852 1103286925 /nfs/dbraw/zinc/28/69/25/1103286925.db2.gz FPDIBKDZKJJHCP-UHFFFAOYSA-N 2 0 371.488 4.327 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000507464021 1103409953 /nfs/dbraw/zinc/40/99/53/1103409953.db2.gz WAZISVKBHFEFDX-FHWLQOOXSA-N 2 0 367.537 4.104 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000551749673 1103603278 /nfs/dbraw/zinc/60/32/78/1103603278.db2.gz GCTPSFDARJORMT-MRXNPFEDSA-N 2 0 365.949 4.028 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)CCS2 ZINC000427542102 1103635975 /nfs/dbraw/zinc/63/59/75/1103635975.db2.gz VBSVYMCDFFWFOV-QWFCFKBJSA-N 2 0 362.583 4.319 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000551790577 1103663854 /nfs/dbraw/zinc/66/38/54/1103663854.db2.gz CQJVYHWXZICHQU-OFAXGOBFSA-N 2 0 374.569 4.284 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000188037512 1103784021 /nfs/dbraw/zinc/78/40/21/1103784021.db2.gz CWFHNLLFRMTANF-AUSIDOKSSA-N 2 0 356.554 4.317 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(-c3ccccc3)nc3ccccn32)[C@@H](C)C1 ZINC000440688624 1103889709 /nfs/dbraw/zinc/88/97/09/1103889709.db2.gz GSRRJAVXKIBUAJ-AZUAARDMSA-N 2 0 362.521 4.163 20 0 FIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)Nc2ccc(C[NH3+])cc2)c1 ZINC000415983055 1103977691 /nfs/dbraw/zinc/97/76/91/1103977691.db2.gz YUYYPQUNPRVNMP-UHFFFAOYSA-N 2 0 368.525 4.089 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O2 ZINC000538293224 1104109655 /nfs/dbraw/zinc/10/96/55/1104109655.db2.gz JDIURYJKZLMPLX-HXUWFJFHSA-N 2 0 372.459 4.085 20 0 FIADRP COCCC1(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CCCC1 ZINC000538295089 1104111925 /nfs/dbraw/zinc/11/19/25/1104111925.db2.gz YCEAYLCXRDVVBC-FQEVSTJZSA-N 2 0 372.553 4.161 20 0 FIADRP COc1ccccc1/C=C\C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000520210391 1104177199 /nfs/dbraw/zinc/17/71/99/1104177199.db2.gz LUYLQKOQQNQXOK-LCYFTJDESA-N 2 0 350.506 4.484 20 0 FIADRP C[C@H](C[NH2+]Cc1cccc(OCc2ccccc2F)c1)C[NH+]1CCCC1 ZINC000520211545 1104178656 /nfs/dbraw/zinc/17/86/56/1104178656.db2.gz XXOCKNJOHBPZOH-GOSISDBHSA-N 2 0 356.485 4.226 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2ccc3[nH]cnc3c2)CC1 ZINC000520228819 1104189547 /nfs/dbraw/zinc/18/95/47/1104189547.db2.gz LWORIQRRAZWKPQ-UHFFFAOYSA-N 2 0 368.912 4.218 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)C2CCCCC2)cc1)C(C)C ZINC000520367398 1104294258 /nfs/dbraw/zinc/29/42/58/1104294258.db2.gz UHLUMVMHXOBZJB-UHFFFAOYSA-N 2 0 373.585 4.253 20 0 FIADRP FC(F)(F)c1ccccc1OCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441413466 1104339286 /nfs/dbraw/zinc/33/92/86/1104339286.db2.gz XOLSBLCUIFUXEX-QAPCUYQASA-N 2 0 368.443 4.033 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441404536 1104344987 /nfs/dbraw/zinc/34/49/87/1104344987.db2.gz SWRMFXUHNWBXTA-QFBILLFUSA-N 2 0 368.443 4.076 20 0 FIADRP COc1cccc([C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001168002132 1104969643 /nfs/dbraw/zinc/96/96/43/1104969643.db2.gz NARYMBSKLRNZMT-IZCSPVGOSA-N 2 0 354.538 4.280 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000152375576 1105062162 /nfs/dbraw/zinc/06/21/62/1105062162.db2.gz PYOHKYIQFNZOEA-KBPBESRZSA-N 2 0 358.473 4.476 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C[C@@H](C)O1 ZINC000579545948 1105075449 /nfs/dbraw/zinc/07/54/49/1105075449.db2.gz KJYMRRHKUYUDRM-YPBQMLHOSA-N 2 0 356.554 4.223 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C[C@H](C)O1 ZINC000579545947 1105075589 /nfs/dbraw/zinc/07/55/89/1105075589.db2.gz KJYMRRHKUYUDRM-XSQFVWFVSA-N 2 0 356.554 4.223 20 0 FIADRP Cc1cccnc1CCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168006573 1105112280 /nfs/dbraw/zinc/11/22/80/1105112280.db2.gz NQEQHMNVJHTFME-WOJBJXKFSA-N 2 0 351.538 4.354 20 0 FIADRP C[C@@H]1C[C@@H](NC(=[NH2+])c2cc(F)cc(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007284 1105130690 /nfs/dbraw/zinc/13/06/90/1105130690.db2.gz ADZCJJOZQJXOHV-YVWYUNDQSA-N 2 0 357.448 4.321 20 0 FIADRP COc1cccc(OCC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168007398 1105132693 /nfs/dbraw/zinc/13/26/93/1105132693.db2.gz AMEKNBQKESNUFG-OALUTQOASA-N 2 0 368.521 4.105 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000507934436 1105270658 /nfs/dbraw/zinc/27/06/58/1105270658.db2.gz HCWHQACTFNVKCC-VCAKUFKGSA-N 2 0 366.590 4.235 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000507939346 1105271924 /nfs/dbraw/zinc/27/19/24/1105271924.db2.gz PSSWWHWIOBQBQB-UHFFFAOYSA-N 2 0 372.553 4.273 20 0 FIADRP FC(F)(F)C1CCN(C2CC([NH2+]C[C@H]3C[C@H]3c3ccccc3)C2)CC1 ZINC000475351726 1106741603 /nfs/dbraw/zinc/74/16/03/1106741603.db2.gz AVTIMELVHMTOBU-HJZRJOMTSA-N 2 0 352.444 4.185 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@@H](C)O1 ZINC000451171861 1106958792 /nfs/dbraw/zinc/95/87/92/1106958792.db2.gz ULFIRVXSCDESCE-MPIDBENGSA-N 2 0 362.945 4.409 20 0 FIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H]3CSCCc4ccccc43)C2)cc1 ZINC000530364373 1106985683 /nfs/dbraw/zinc/98/56/83/1106985683.db2.gz IQRMUUYLMKXDGV-SIKLNZKXSA-N 2 0 352.547 4.129 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CCC([NH+]4CCCC4)CC3)c2cc1OCC ZINC000301509643 1107053746 /nfs/dbraw/zinc/05/37/46/1107053746.db2.gz IBDKYEXSZILMAG-UHFFFAOYSA-N 2 0 369.509 4.097 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530544687 1107127945 /nfs/dbraw/zinc/12/79/45/1107127945.db2.gz UQUPTBAOKNHDNC-KAGYGMCKSA-N 2 0 350.506 4.319 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1OCc1cccs1 ZINC000530674600 1107245533 /nfs/dbraw/zinc/24/55/33/1107245533.db2.gz CFISXURXCNQSPW-ROUUACIJSA-N 2 0 374.550 4.298 20 0 FIADRP C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2cc(Br)ccc2o1 ZINC000193508108 1107906890 /nfs/dbraw/zinc/90/68/90/1107906890.db2.gz JQPIQWRNBCELHW-OLZOCXBDSA-N 2 0 363.299 4.330 20 0 FIADRP COc1ccc(CN2CCC[C@@H]([N@H+](C)Cc3ccc(OC)cc3)CC2)cc1 ZINC000444655848 1108049931 /nfs/dbraw/zinc/04/99/31/1108049931.db2.gz BDLSWMLWDAVVOA-OAQYLSRUSA-N 2 0 368.521 4.190 20 0 FIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c1 ZINC000531688942 1108056078 /nfs/dbraw/zinc/05/60/78/1108056078.db2.gz MOVFMOQHVCZWNU-UFYCRDLUSA-N 2 0 352.522 4.455 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccc(-c3cccs3)cc2)CCN1C1CC[NH+](C)CC1 ZINC000444680501 1108084713 /nfs/dbraw/zinc/08/47/13/1108084713.db2.gz FVYRNIVYDUWCQI-GOSISDBHSA-N 2 0 369.578 4.015 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453069156 1108120287 /nfs/dbraw/zinc/12/02/87/1108120287.db2.gz YNSZJQSPODDLIX-OAQYLSRUSA-N 2 0 363.977 4.189 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)cs1 ZINC000453071149 1108121854 /nfs/dbraw/zinc/12/18/54/1108121854.db2.gz CVARKYKNBJJPMX-NJDAHSKKSA-N 2 0 355.551 4.027 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453171635 1108246634 /nfs/dbraw/zinc/24/66/34/1108246634.db2.gz MNZCYZXXGGYSMO-ZJMJOCHXSA-N 2 0 367.537 4.428 20 0 FIADRP FC(F)(F)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000453229986 1108303231 /nfs/dbraw/zinc/30/32/31/1108303231.db2.gz PLUJAIGXIQFFIN-JIARVOFWSA-N 2 0 352.444 4.360 20 0 FIADRP Cc1cccnc1CCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000453303184 1108389810 /nfs/dbraw/zinc/38/98/10/1108389810.db2.gz BMZLHIGGTYNBEX-UHFFFAOYSA-N 2 0 351.538 4.355 20 0 FIADRP C[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc2ccccc21 ZINC000531965230 1108460932 /nfs/dbraw/zinc/46/09/32/1108460932.db2.gz ASLPAPCLUWEXFR-CPJSRVTESA-N 2 0 373.544 4.479 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCCOc2cc(Br)ccc21)C1CC1 ZINC000453389409 1108476917 /nfs/dbraw/zinc/47/69/17/1108476917.db2.gz CHUUDVNLRZFJNW-QGZVFWFLSA-N 2 0 367.331 4.127 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2ccc(F)c3Br)CC1 ZINC000453378006 1108498187 /nfs/dbraw/zinc/49/81/87/1108498187.db2.gz YJQUADCMJHXJFQ-PPUFBPAQSA-N 2 0 355.295 4.038 20 0 FIADRP Cc1ncccc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000237594458 1108611700 /nfs/dbraw/zinc/61/17/00/1108611700.db2.gz UZKRFTQEGQBLNQ-UHFFFAOYSA-N 2 0 351.538 4.215 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(-c3ccccc3F)nc2C)c1 ZINC000655729619 1108790403 /nfs/dbraw/zinc/79/04/03/1108790403.db2.gz MEAYGEMXOQUGOU-UHFFFAOYSA-N 2 0 366.484 4.061 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446752991 1109329841 /nfs/dbraw/zinc/32/98/41/1109329841.db2.gz QTLHBFPSRNNMMB-HSZRJFAPSA-N 2 0 357.586 4.234 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000525307372 1109333811 /nfs/dbraw/zinc/33/38/11/1109333811.db2.gz BYXJPNFTSPFNNN-IBGZPJMESA-N 2 0 352.522 4.478 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)C2CCCC2)cc1 ZINC000446935834 1109394839 /nfs/dbraw/zinc/39/48/39/1109394839.db2.gz IDIFMYFMXKPRML-XPWALMASSA-N 2 0 356.554 4.194 20 0 FIADRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Br)cc1Cl ZINC000446938955 1109395365 /nfs/dbraw/zinc/39/53/65/1109395365.db2.gz YQIZHXZRLMUOFC-MRXNPFEDSA-N 2 0 357.723 4.405 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cccc(C[NH+](C)C)c2)cc1 ZINC000525490153 1109400742 /nfs/dbraw/zinc/40/07/42/1109400742.db2.gz GXNCYBSPTXDQNF-GOSISDBHSA-N 2 0 365.521 4.375 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000525869924 1109546989 /nfs/dbraw/zinc/54/69/89/1109546989.db2.gz XCVPVLJGVWQTQO-HLIPFELVSA-N 2 0 352.950 4.170 20 0 FIADRP CCC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccsc1 ZINC000525954720 1109562896 /nfs/dbraw/zinc/56/28/96/1109562896.db2.gz YIWTUCVIMYCVIN-LEWJYISDSA-N 2 0 357.567 4.168 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000447538260 1109571668 /nfs/dbraw/zinc/57/16/68/1109571668.db2.gz BFRAGCCVUFDADE-QHCPKHFHSA-N 2 0 370.512 4.200 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccc(F)cc2)cc1 ZINC000447559853 1109581606 /nfs/dbraw/zinc/58/16/06/1109581606.db2.gz UNJHPMQZVRDFDU-QHCPKHFHSA-N 2 0 368.496 4.388 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccc(F)cc2)cc1 ZINC000447559851 1109581760 /nfs/dbraw/zinc/58/17/60/1109581760.db2.gz UNJHPMQZVRDFDU-HSZRJFAPSA-N 2 0 368.496 4.388 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1F ZINC000447565607 1109584282 /nfs/dbraw/zinc/58/42/82/1109584282.db2.gz MIIWESJVOBWSBE-PZJWPPBQSA-N 2 0 360.517 4.325 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c2ccccc21 ZINC000447582091 1109585449 /nfs/dbraw/zinc/58/54/49/1109585449.db2.gz XWGUKZSINZXSSW-CWBXHPNXSA-N 2 0 356.554 4.229 20 0 FIADRP COC(=O)c1coc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000447587044 1109588058 /nfs/dbraw/zinc/58/80/58/1109588058.db2.gz PYENBPMAUKTDRD-LNLFQRSKSA-N 2 0 370.493 4.018 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Br)ccc1F ZINC000447576782 1109593186 /nfs/dbraw/zinc/59/31/86/1109593186.db2.gz CHBJCWFBYLTJHA-LBPRGKRZSA-N 2 0 355.295 4.113 20 0 FIADRP Fc1cccc(NCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000447601988 1109599054 /nfs/dbraw/zinc/59/90/54/1109599054.db2.gz RZJKEOXMVDOTMJ-NUNAXRQHSA-N 2 0 367.512 4.413 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc21 ZINC000447609740 1109601916 /nfs/dbraw/zinc/60/19/16/1109601916.db2.gz YYLYZDCQRNIAQI-QDSKXPNFSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000508605156 1109605553 /nfs/dbraw/zinc/60/55/53/1109605553.db2.gz RXVRMVURJYRYFV-CEXWTWQISA-N 2 0 357.542 4.118 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccnn3-c3ccccc3)cc2)CC1 ZINC000447932127 1109681179 /nfs/dbraw/zinc/68/11/79/1109681179.db2.gz QYKNXLMKNUCNJL-UHFFFAOYSA-N 2 0 374.532 4.394 20 0 FIADRP COC[C@@H](C)C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000527116291 1109698792 /nfs/dbraw/zinc/69/87/92/1109698792.db2.gz NVKYSEGCUYGJEO-IBGZPJMESA-N 2 0 352.522 4.322 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)C2CCCC2)cc1 ZINC000527360638 1109749404 /nfs/dbraw/zinc/74/94/04/1109749404.db2.gz PRFPTYZFOJGQAL-QHCPKHFHSA-N 2 0 367.537 4.352 20 0 FIADRP CCN(Cc1ccnn1-c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000448330830 1109773819 /nfs/dbraw/zinc/77/38/19/1109773819.db2.gz FUHSYQZULUUVCE-QFIPXVFZSA-N 2 0 374.532 4.216 20 0 FIADRP Brc1sccc1CNCc1ccc(C[NH+]2CCCC2)cc1 ZINC000527631424 1109790398 /nfs/dbraw/zinc/79/03/98/1109790398.db2.gz IGCJEZPAOKLNRV-UHFFFAOYSA-N 2 0 365.340 4.396 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527640607 1109792420 /nfs/dbraw/zinc/79/24/20/1109792420.db2.gz NFRMZBWEYVBEBW-DHIUTWEWSA-N 2 0 357.586 4.110 20 0 FIADRP c1ccc([C@@H]2CCC[C@@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)CC2)cc1 ZINC000527662124 1109797221 /nfs/dbraw/zinc/79/72/21/1109797221.db2.gz MVXXFNZMVJASSO-KSEOMHKRSA-N 2 0 356.554 4.193 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527672571 1109800304 /nfs/dbraw/zinc/80/03/04/1109800304.db2.gz AWJJYVFHJDWKCA-YXPKMTABSA-N 2 0 356.554 4.070 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2ccncc2Cl)CC1 ZINC000527656373 1109803445 /nfs/dbraw/zinc/80/34/45/1109803445.db2.gz DHLITRBCOCAWKT-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC000527694287 1109806247 /nfs/dbraw/zinc/80/62/47/1109806247.db2.gz YIGGFBFGENVYTO-GOSISDBHSA-N 2 0 371.956 4.123 20 0 FIADRP CC[N@H+](C)Cc1cccc(CN[C@H](C)c2cc(-c3ccccc3)n(C)n2)c1 ZINC000527857396 1109840288 /nfs/dbraw/zinc/84/02/88/1109840288.db2.gz AUVZNBVTRAZGSC-GOSISDBHSA-N 2 0 362.521 4.390 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cn1 ZINC000528044866 1109897739 /nfs/dbraw/zinc/89/77/39/1109897739.db2.gz VZSDJAAORDKGNB-ODOSVJCGSA-N 2 0 365.521 4.042 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000449127394 1109981243 /nfs/dbraw/zinc/98/12/43/1109981243.db2.gz OZYAUHHULPSPCQ-UHFFFAOYSA-N 2 0 374.569 4.030 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(-n3cncn3)cc2)CC1 ZINC000449132703 1109982261 /nfs/dbraw/zinc/98/22/61/1109982261.db2.gz VUPGSWRGFYQFKA-UHFFFAOYSA-N 2 0 369.557 4.036 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H](NCc2cc3ccccc3cc2OC)[C@H](C)C1 ZINC000449139405 1109983863 /nfs/dbraw/zinc/98/38/63/1109983863.db2.gz KYPIRVMERINKIL-GCJKJVERSA-N 2 0 370.537 4.075 20 0 FIADRP CSC1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCOCC1 ZINC000449174880 1109988934 /nfs/dbraw/zinc/98/89/34/1109988934.db2.gz NLHWKJUDSMDFOS-UHFFFAOYSA-N 2 0 356.620 4.167 20 0 FIADRP Cc1noc(C)c1[C@@H](C)C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449186260 1109994596 /nfs/dbraw/zinc/99/45/96/1109994596.db2.gz JCUWQISXVOUBRM-IRXDYDNUSA-N 2 0 355.526 4.080 20 0 FIADRP COCC[C@@H](NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccco1 ZINC000449229889 1110003653 /nfs/dbraw/zinc/00/36/53/1110003653.db2.gz FTXWZGUJXFTFOP-WIYYLYMNSA-N 2 0 356.510 4.042 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000449305233 1110022509 /nfs/dbraw/zinc/02/25/09/1110022509.db2.gz FJKOQXMIAPSDPB-PKOBYXMFSA-N 2 0 350.497 4.497 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCCC2(F)F)CC1 ZINC000449373742 1110045782 /nfs/dbraw/zinc/04/57/82/1110045782.db2.gz CMWDPBONJXGDRH-MJGOQNOKSA-N 2 0 350.497 4.497 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCCCC1(F)F)C1CC[NH+](C)CC1 ZINC000449377310 1110051212 /nfs/dbraw/zinc/05/12/12/1110051212.db2.gz OQKHTAFNOXOGIW-GOSISDBHSA-N 2 0 365.512 4.132 20 0 FIADRP Cc1noc(C)c1C[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413877 1110056020 /nfs/dbraw/zinc/05/60/20/1110056020.db2.gz KMEOUSCMYXOVCF-JOCHJYFZSA-N 2 0 367.537 4.414 20 0 FIADRP Cc1cccnc1CCC[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449486298 1110089848 /nfs/dbraw/zinc/08/98/48/1110089848.db2.gz RTDXLYGCNVTGMZ-FQEVSTJZSA-N 2 0 351.538 4.008 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000449542304 1110100734 /nfs/dbraw/zinc/10/07/34/1110100734.db2.gz QEPOCGOZVGMBBX-FCHUYYIVSA-N 2 0 367.537 4.050 20 0 FIADRP Cc1cc(OCCC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1Cl ZINC000449561485 1110110736 /nfs/dbraw/zinc/11/07/36/1110110736.db2.gz VPNZGKZFYFWUIN-CSNJMZFVSA-N 2 0 350.934 4.411 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccnc1C(F)(F)F ZINC000528810704 1110119776 /nfs/dbraw/zinc/11/97/76/1110119776.db2.gz HFUXWOULAFCOBV-UHFFFAOYSA-N 2 0 351.416 4.184 20 0 FIADRP Fc1ccccc1CC(Cc1ccccc1F)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000461798068 1111359694 /nfs/dbraw/zinc/35/96/94/1111359694.db2.gz SZRQNIHBGAKDCO-QGZVFWFLSA-N 2 0 370.487 4.193 20 0 FIADRP CCN1CCC([NH2+][C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000461800376 1111368258 /nfs/dbraw/zinc/36/82/58/1111368258.db2.gz BEXXKPUQRFRGML-GOSISDBHSA-N 2 0 368.521 4.409 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000539064235 1111406020 /nfs/dbraw/zinc/40/60/20/1111406020.db2.gz DRAVPKNTBDOGNV-QHAWAJNXSA-N 2 0 362.945 4.075 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)CCC2 ZINC000539064980 1111408593 /nfs/dbraw/zinc/40/85/93/1111408593.db2.gz OEAQQYBAUQYWOU-JOCHJYFZSA-N 2 0 367.537 4.313 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCOC1CCCCCC1)c1ccccc1O2 ZINC000539396074 1111541728 /nfs/dbraw/zinc/54/17/28/1111541728.db2.gz SJPRQYSKYPUGLL-NRFANRHFSA-N 2 0 372.553 4.304 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CCC[NH2+]CC2)nc1 ZINC000643521939 1111548262 /nfs/dbraw/zinc/54/82/62/1111548262.db2.gz FROJZWGDKZWEFL-IFMALSPDSA-N 2 0 371.956 4.183 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)c(C)c1OC ZINC000552048311 1111557741 /nfs/dbraw/zinc/55/77/41/1111557741.db2.gz OHYOVEYQXXKSNZ-QGZVFWFLSA-N 2 0 374.569 4.187 20 0 FIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000552087478 1111569837 /nfs/dbraw/zinc/56/98/37/1111569837.db2.gz JHRIZYDTVDCJJE-UEVCKROQSA-N 2 0 356.554 4.334 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000477868255 1111582785 /nfs/dbraw/zinc/58/27/85/1111582785.db2.gz WQSSNYLFULWKJB-WIYYLYMNSA-N 2 0 360.542 4.160 20 0 FIADRP Clc1cc2[nH]cc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c2c(Cl)c1 ZINC000477867464 1111583663 /nfs/dbraw/zinc/58/36/63/1111583663.db2.gz UCWSHUSEOJQNHC-HUUCEWRRSA-N 2 0 352.309 4.234 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]2CCC[C@H]21 ZINC000552259548 1111638880 /nfs/dbraw/zinc/63/88/80/1111638880.db2.gz KSQCGVLKMKLHLB-FGTMMUONSA-N 2 0 361.942 4.426 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H]2CCC[C@H]21 ZINC000552258326 1111639034 /nfs/dbraw/zinc/63/90/34/1111639034.db2.gz DMMDQSWACMCYPH-XFUTXVRSSA-N 2 0 352.444 4.414 20 0 FIADRP Brc1ccccc1[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643535279 1111768973 /nfs/dbraw/zinc/76/89/73/1111768973.db2.gz LFXQEWWMLXJDMH-RBUKOAKNSA-N 2 0 371.322 4.270 20 0 FIADRP CCC(CC)(CN[C@H]1CCCc2nn(C)cc21)[NH2+][C@H](C)c1ccccc1 ZINC000479057300 1111938304 /nfs/dbraw/zinc/93/83/04/1111938304.db2.gz HUSJKUJEQAKIGJ-XLIONFOSSA-N 2 0 354.542 4.297 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)Cc2ccc(Br)cc2)CC1 ZINC000479246536 1111973389 /nfs/dbraw/zinc/97/33/89/1111973389.db2.gz DVECTOSGDBPJCP-HNNXBMFYSA-N 2 0 353.348 4.092 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479338328 1111999246 /nfs/dbraw/zinc/99/92/46/1111999246.db2.gz VUWSXEBYVIQHJT-JOCHJYFZSA-N 2 0 360.505 4.101 20 0 FIADRP CCC1(C[NH2+][C@H]2CCCc3nn(C)cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000479394571 1112011550 /nfs/dbraw/zinc/01/15/50/1112011550.db2.gz RUCUXBVHLSKLTN-NRFANRHFSA-N 2 0 366.553 4.080 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479460997 1112031984 /nfs/dbraw/zinc/03/19/84/1112031984.db2.gz AGNNTGHITLJLQP-RXVVDRJESA-N 2 0 354.469 4.151 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H](C[C@@H]3CCOC3)c3ccccc3)C2)cc1 ZINC000479462539 1112032721 /nfs/dbraw/zinc/03/27/21/1112032721.db2.gz GHJDIKSZNREOAQ-WMTXJRDZSA-N 2 0 364.533 4.266 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000479491493 1112045027 /nfs/dbraw/zinc/04/50/27/1112045027.db2.gz SMFYNUATDXAAAA-ZHRRBRCNSA-N 2 0 356.485 4.494 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000667502209 1112048873 /nfs/dbraw/zinc/04/88/73/1112048873.db2.gz XSWMZQDFUMROHD-UHFFFAOYSA-N 2 0 355.551 4.426 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(F)c3)C2)[C@@H](C)C1 ZINC000479526123 1112053218 /nfs/dbraw/zinc/05/32/18/1112053218.db2.gz LAAQEFCAVKYUJD-GWWHBBDRSA-N 2 0 362.533 4.188 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000479562134 1112073145 /nfs/dbraw/zinc/07/31/45/1112073145.db2.gz XMTGSUPYWHQEJO-UHFFFAOYSA-N 2 0 369.347 4.059 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1nnn(-c2ccc(C)cc2)c1C ZINC000479764508 1112135265 /nfs/dbraw/zinc/13/52/65/1112135265.db2.gz GWMLICSZNQWQBS-ZWKOTPCHSA-N 2 0 357.546 4.045 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccccc1CN1CCOCC1)c1ccccc1 ZINC000479899731 1112181123 /nfs/dbraw/zinc/18/11/23/1112181123.db2.gz ROGZYQFXTHAWAC-HSZRJFAPSA-N 2 0 352.522 4.396 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCO[C@H](C(F)(F)F)C3)c2)CC1 ZINC000554072893 1112183358 /nfs/dbraw/zinc/18/33/58/1112183358.db2.gz UWSWXKUVPZIUBN-OALUTQOASA-N 2 0 370.459 4.118 20 0 FIADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000554087067 1112198078 /nfs/dbraw/zinc/19/80/78/1112198078.db2.gz UJDROACQUPLQJW-BHDDXSALSA-N 2 0 358.570 4.330 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000480012156 1112236515 /nfs/dbraw/zinc/23/65/15/1112236515.db2.gz HMNLIWLNGNMBAV-OAHLLOKOSA-N 2 0 360.546 4.176 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCC[NH+](C)Cc1ccccc1 ZINC000480148048 1112302486 /nfs/dbraw/zinc/30/24/86/1112302486.db2.gz PQIWXWQFOQNZJG-QPPBQGQZSA-N 2 0 365.565 4.009 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccccc1 ZINC000554349836 1112311057 /nfs/dbraw/zinc/31/10/57/1112311057.db2.gz QKUMFHNCOSVRLB-HSZRJFAPSA-N 2 0 352.522 4.396 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000480234550 1112344161 /nfs/dbraw/zinc/34/41/61/1112344161.db2.gz SCVHGKBTFZVFIX-GLDPYIMESA-N 2 0 364.533 4.381 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCc4cc(F)ccc43)cc2)C[C@H](C)O1 ZINC000480236374 1112344489 /nfs/dbraw/zinc/34/44/89/1112344489.db2.gz VCSLKJNQENBJMW-MFEFFIJZSA-N 2 0 368.496 4.212 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(Cl)cn3)CC2)cc1 ZINC000480257196 1112346948 /nfs/dbraw/zinc/34/69/48/1112346948.db2.gz ZFTNKTAEWNRYON-INIZCTEOSA-N 2 0 373.928 4.306 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCN(c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000480251955 1112351461 /nfs/dbraw/zinc/35/14/61/1112351461.db2.gz ULBNXIUUFRCQMJ-HXUWFJFHSA-N 2 0 374.532 4.098 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cn1 ZINC000480339175 1112387489 /nfs/dbraw/zinc/38/74/89/1112387489.db2.gz WCMYNHHRCYILLO-IXDOHACOSA-N 2 0 373.928 4.195 20 0 FIADRP c1ccc(C[NH+]2CCC(NC3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000554622126 1112422226 /nfs/dbraw/zinc/42/22/26/1112422226.db2.gz NRTUTXMZCXIHJZ-UHFFFAOYSA-N 2 0 355.570 4.038 20 0 FIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000480474045 1112443761 /nfs/dbraw/zinc/44/37/61/1112443761.db2.gz LKURBKZURQKVQZ-UHFFFAOYSA-N 2 0 350.506 4.328 20 0 FIADRP c1c(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000030907139 1112463993 /nfs/dbraw/zinc/46/39/93/1112463993.db2.gz AGNSIILHOTZOEA-LJQANCHMSA-N 2 0 372.516 4.113 20 0 FIADRP CCC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000480539666 1112467544 /nfs/dbraw/zinc/46/75/44/1112467544.db2.gz VOQBMVMJJVOTSD-LJQANCHMSA-N 2 0 371.491 4.162 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(-n2cccn2)cc1 ZINC000480601518 1112491679 /nfs/dbraw/zinc/49/16/79/1112491679.db2.gz ASUGGLMZDSGXPU-AQNXPRMDSA-N 2 0 354.542 4.281 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480614270 1112502174 /nfs/dbraw/zinc/50/21/74/1112502174.db2.gz SEHHHYKAUJSEJH-VQTJNVASSA-N 2 0 367.537 4.156 20 0 FIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)Nc2cccc(C[NH3+])c2)c1 ZINC000667726127 1112550228 /nfs/dbraw/zinc/55/02/28/1112550228.db2.gz LFURHJHAGQXPPJ-UHFFFAOYSA-N 2 0 368.525 4.089 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(Cl)cc1 ZINC000480721493 1112562498 /nfs/dbraw/zinc/56/24/98/1112562498.db2.gz MVMHLHILNUPIIZ-HXUWFJFHSA-N 2 0 372.944 4.118 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC000480711599 1112564776 /nfs/dbraw/zinc/56/47/76/1112564776.db2.gz HGKHVCJGSOGOLP-JOCHJYFZSA-N 2 0 368.521 4.193 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3OC)cc1 ZINC000480730240 1112575213 /nfs/dbraw/zinc/57/52/13/1112575213.db2.gz ONUOQMDCBMSACT-JOCHJYFZSA-N 2 0 368.521 4.193 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000554993510 1112604707 /nfs/dbraw/zinc/60/47/07/1112604707.db2.gz BZVQMSKNBJWLDF-PZJWPPBQSA-N 2 0 351.538 4.310 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C[C@H](C)O1 ZINC000480832547 1112631980 /nfs/dbraw/zinc/63/19/80/1112631980.db2.gz KDTYQFKZPXUHBQ-YYDVJCTNSA-N 2 0 370.512 4.394 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1OC(F)F ZINC000480900109 1112663001 /nfs/dbraw/zinc/66/30/01/1112663001.db2.gz MHFOJOFTQUHWMC-CABCVRRESA-N 2 0 356.457 4.069 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)C1 ZINC000481308040 1112882003 /nfs/dbraw/zinc/88/20/03/1112882003.db2.gz AFOPMMRLTRKIRB-PGRDOPGGSA-N 2 0 356.485 4.050 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2c(s1)CCCC2 ZINC000481322269 1112903893 /nfs/dbraw/zinc/90/38/93/1112903893.db2.gz ZORBEVNFOXDGGY-MRXNPFEDSA-N 2 0 358.551 4.418 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2ccccc2n1 ZINC000481724326 1113055962 /nfs/dbraw/zinc/05/59/62/1113055962.db2.gz HCDHCLYXIZTPKB-XXBNENTESA-N 2 0 359.517 4.278 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccccc3OC)CC2)cc1 ZINC000481739388 1113063064 /nfs/dbraw/zinc/06/30/64/1113063064.db2.gz GASWRBXJDQWVCK-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000481947471 1113142351 /nfs/dbraw/zinc/14/23/51/1113142351.db2.gz XHKRNLWKQMZHSM-LJQANCHMSA-N 2 0 358.551 4.369 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000482134094 1113179315 /nfs/dbraw/zinc/17/93/15/1113179315.db2.gz FLXFUKWLUVSYMY-WOJBJXKFSA-N 2 0 370.541 4.159 20 0 FIADRP C[C@H]([NH2+]CCCc1ccc2c(c1)CCO2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000482220802 1113202636 /nfs/dbraw/zinc/20/26/36/1113202636.db2.gz NPJLHWSDVKZDCZ-CVDCTZTESA-N 2 0 364.533 4.054 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)cc1 ZINC000482357226 1113231992 /nfs/dbraw/zinc/23/19/92/1113231992.db2.gz XMXZWLRTDYDOMW-SFHVURJKSA-N 2 0 363.615 4.111 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482458899 1113267243 /nfs/dbraw/zinc/26/72/43/1113267243.db2.gz AZMGNYNJFGKUGV-HNAYVOBHSA-N 2 0 372.384 4.308 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000482497522 1113276213 /nfs/dbraw/zinc/27/62/13/1113276213.db2.gz AJVKXTHCVGZBSF-FXAWDEMLSA-N 2 0 351.966 4.044 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000482494436 1113278286 /nfs/dbraw/zinc/27/82/86/1113278286.db2.gz CQPOAMJNMXIYHO-NHCUHLMSSA-N 2 0 365.565 4.278 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482514665 1113284778 /nfs/dbraw/zinc/28/47/78/1113284778.db2.gz ZVLIWTUODPERRR-DNVCBOLYSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc2c(c1)OCO2 ZINC000482557445 1113295038 /nfs/dbraw/zinc/29/50/38/1113295038.db2.gz OHPMLICFTRJSHU-SFHVURJKSA-N 2 0 366.505 4.498 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2CC[NH+](C)CC2)CCC3)cc1 ZINC000482553995 1113297884 /nfs/dbraw/zinc/29/78/84/1113297884.db2.gz HMPJTUOUWSAANS-GOSISDBHSA-N 2 0 355.551 4.427 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000482871472 1113385231 /nfs/dbraw/zinc/38/52/31/1113385231.db2.gz XFOGPSVBWJMVRE-QHCPKHFHSA-N 2 0 368.569 4.196 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(-c2ccccc2)cc1 ZINC000482875433 1113386728 /nfs/dbraw/zinc/38/67/28/1113386728.db2.gz LWLGAGSLTNHIFF-XXBNENTESA-N 2 0 352.522 4.241 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-c2cccs2)cc1 ZINC000482898714 1113395004 /nfs/dbraw/zinc/39/50/04/1113395004.db2.gz ZLAPUQWUVSUCBJ-YLJYHZDGSA-N 2 0 358.551 4.303 20 0 FIADRP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1 ZINC000668169757 1113403800 /nfs/dbraw/zinc/40/38/00/1113403800.db2.gz ZAOZLJYGCFNBIO-FQEVSTJZSA-N 2 0 355.551 4.282 20 0 FIADRP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1 ZINC000668169758 1113403853 /nfs/dbraw/zinc/40/38/53/1113403853.db2.gz ZAOZLJYGCFNBIO-HXUWFJFHSA-N 2 0 355.551 4.282 20 0 FIADRP Cc1ccccc1[C@H](C)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000483217463 1113467271 /nfs/dbraw/zinc/46/72/71/1113467271.db2.gz NARVESHVJJIGKT-FQEVSTJZSA-N 2 0 357.586 4.184 20 0 FIADRP Cn1ccnc1C[C@@H]1CCC[N@H+](CCc2cc(Cl)ccc2Cl)C1 ZINC000488135389 1113860825 /nfs/dbraw/zinc/86/08/25/1113860825.db2.gz DLCKVKNPBNOMCC-AWEZNQCLSA-N 2 0 352.309 4.224 20 0 FIADRP CCOc1cc2[nH+]ccc(NC3CC[NH+](C(C)(C)C)CC3)c2cc1OCC ZINC000488210235 1113881394 /nfs/dbraw/zinc/88/13/94/1113881394.db2.gz PWIHUQDAHATSCQ-UHFFFAOYSA-N 2 0 371.525 4.129 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(Cl)cc2C)CC1 ZINC000488266144 1113894011 /nfs/dbraw/zinc/89/40/11/1113894011.db2.gz IVGNRICFNPCHOJ-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CS[C@H](C(C)C)C3)CC2)cc1 ZINC000488415348 1113927342 /nfs/dbraw/zinc/92/73/42/1113927342.db2.gz AKJVBBFSWFQFQV-FPOVZHCZSA-N 2 0 362.583 4.027 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3nn(C)c4ccccc34)cc2)C1 ZINC000589641094 1114819015 /nfs/dbraw/zinc/81/90/15/1114819015.db2.gz RZZOOLBKQJYONE-GOSISDBHSA-N 2 0 362.521 4.095 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641809 1114820501 /nfs/dbraw/zinc/82/05/01/1114820501.db2.gz RVEIIZLGRUVTAL-QZTJIDSGSA-N 2 0 362.521 4.331 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(F)c(Br)c2)CC1 ZINC000589836180 1114847526 /nfs/dbraw/zinc/84/75/26/1114847526.db2.gz HXXPSSRMWBYHBU-UHFFFAOYSA-N 2 0 357.311 4.190 20 0 FIADRP C[NH+](C)CC1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000590125591 1114897566 /nfs/dbraw/zinc/89/75/66/1114897566.db2.gz BGTZNJLIWAWOQO-UHFFFAOYSA-N 2 0 352.522 4.066 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CCC2 ZINC000572946013 1114943226 /nfs/dbraw/zinc/94/32/26/1114943226.db2.gz UTLRSUFQZFLGPV-KRWDZBQOSA-N 2 0 355.448 4.334 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2ccc(Cl)cc2Cl)CC1 ZINC000590786579 1114974089 /nfs/dbraw/zinc/97/40/89/1114974089.db2.gz HXAQGWJJGLGOBI-UHFFFAOYSA-N 2 0 359.341 4.424 20 0 FIADRP Cc1ccc(-c2noc([C@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)n2)cc1F ZINC000590786655 1114974193 /nfs/dbraw/zinc/97/41/93/1114974193.db2.gz LHJOAUTYEUPBGD-INIZCTEOSA-N 2 0 374.504 4.297 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000573033615 1115001838 /nfs/dbraw/zinc/00/18/38/1115001838.db2.gz MQJGBKVYZYLHJO-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP CCc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1 ZINC000591714964 1115120274 /nfs/dbraw/zinc/12/02/74/1115120274.db2.gz SMEGKOQIVQAFBZ-SFHVURJKSA-N 2 0 369.528 4.381 20 0 FIADRP Fc1ccc(C2([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)CC2)cc1 ZINC000591723959 1115124549 /nfs/dbraw/zinc/12/45/49/1115124549.db2.gz QSCLTWAJGXCSEW-UHFFFAOYSA-N 2 0 354.469 4.079 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC000591712226 1115126343 /nfs/dbraw/zinc/12/63/43/1115126343.db2.gz MUEMVOIKAQMQAB-SFHVURJKSA-N 2 0 356.485 4.194 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000593972883 1115364568 /nfs/dbraw/zinc/36/45/68/1115364568.db2.gz NZKZJVLSHZQBOY-QFIPXVFZSA-N 2 0 371.569 4.009 20 0 FIADRP FC(F)(F)[C@@H]1CC[NH+](CCCCCC[N@H+]2CC[C@H](C(F)(F)F)C2)C1 ZINC000761049510 1115405502 /nfs/dbraw/zinc/40/55/02/1115405502.db2.gz HWYYWNKAPHDNIB-OKILXGFUSA-N 2 0 360.386 4.315 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H](CCC[NH3+])c2ccccc2)cc1)C(C)C ZINC000575045091 1115531055 /nfs/dbraw/zinc/53/10/55/1115531055.db2.gz PIIFHUPQAKEIDG-JOCHJYFZSA-N 2 0 367.537 4.127 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c1F ZINC000669679743 1115774389 /nfs/dbraw/zinc/77/43/89/1115774389.db2.gz VREAUEZJUMILFJ-KRWDZBQOSA-N 2 0 356.485 4.499 20 0 FIADRP FC1(F)CCC[C@H](C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000669685318 1115786963 /nfs/dbraw/zinc/78/69/63/1115786963.db2.gz SIJJQAWDJRAAEL-SFHVURJKSA-N 2 0 352.469 4.076 20 0 FIADRP COc1cc(OC)cc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000608061470 1116079678 /nfs/dbraw/zinc/07/96/78/1116079678.db2.gz DZYBTZVTNFSIIU-SJLPKXTDSA-N 2 0 370.493 4.068 20 0 FIADRP Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000608065169 1116080467 /nfs/dbraw/zinc/08/04/67/1116080467.db2.gz YHYQVGANAGMBAI-SFHVURJKSA-N 2 0 356.510 4.174 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CCCN3CCC[N@@H+](C)CC3)cc2)c1 ZINC000608056022 1116082114 /nfs/dbraw/zinc/08/21/14/1116082114.db2.gz WGFJXSCYUBUEFJ-UHFFFAOYSA-N 2 0 365.565 4.088 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000534332157 1116185765 /nfs/dbraw/zinc/18/57/65/1116185765.db2.gz PZJUGXQSZQCIEH-HSZRJFAPSA-N 2 0 374.569 4.188 20 0 FIADRP CCC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000534494178 1116207439 /nfs/dbraw/zinc/20/74/39/1116207439.db2.gz AMHYPZRVEASWJZ-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000534794988 1116237619 /nfs/dbraw/zinc/23/76/19/1116237619.db2.gz SRSPEYCNHFYERY-PIGZYNQJSA-N 2 0 369.734 4.164 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000534797997 1116238911 /nfs/dbraw/zinc/23/89/11/1116238911.db2.gz AWESDVQHXWQPED-VSKRKVRLSA-N 2 0 354.538 4.110 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509440 1116313882 /nfs/dbraw/zinc/31/38/82/1116313882.db2.gz SHXQKIBYBULFRR-MEDUHNTESA-N 2 0 357.723 4.021 20 0 FIADRP Cc1cc(Br)ccc1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000539817117 1116384314 /nfs/dbraw/zinc/38/43/14/1116384314.db2.gz AMYRANRGEFAJKN-GOSISDBHSA-N 2 0 351.332 4.208 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)[C@@H](C)C1 ZINC000539819627 1116385236 /nfs/dbraw/zinc/38/52/36/1116385236.db2.gz NXXBEJFDHWZQLB-RXVVDRJESA-N 2 0 353.510 4.344 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000539898424 1117740202 /nfs/dbraw/zinc/74/02/02/1117740202.db2.gz QTBJBCQNBOVJRK-FYYLOGMGSA-N 2 0 369.597 4.093 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000462796803 1117779158 /nfs/dbraw/zinc/77/91/58/1117779158.db2.gz XFXBTHRUISUTPR-RJGXRXQPSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000462812284 1117782310 /nfs/dbraw/zinc/78/23/10/1117782310.db2.gz HBQWAFBJZYRRAQ-SFHLNBCPSA-N 2 0 373.560 4.285 20 0 FIADRP C[C@H](C[C@H](C)O)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462801400 1117785251 /nfs/dbraw/zinc/78/52/51/1117785251.db2.gz GXRHXQJEKXCZDI-LVCYWYKZSA-N 2 0 350.522 4.128 20 0 FIADRP CO[C@@H](C)CC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462806281 1117788209 /nfs/dbraw/zinc/78/82/09/1117788209.db2.gz JIZYHLFIGXHOKS-GHTZIAJQSA-N 2 0 350.522 4.394 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000462848256 1117818756 /nfs/dbraw/zinc/81/87/56/1117818756.db2.gz OMYZPCTXEUQOQE-QRVBRYPASA-N 2 0 362.558 4.404 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cc3ccccc3[nH]c2=O)CC1)CC1CC1 ZINC000540049699 1117829242 /nfs/dbraw/zinc/82/92/42/1117829242.db2.gz QDBLNIBHBUUPOU-UHFFFAOYSA-N 2 0 367.537 4.274 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)[C@@H](C)C1 ZINC000540141165 1117894182 /nfs/dbraw/zinc/89/41/82/1117894182.db2.gz FIABDWFHQDPNLS-HTAPYJJXSA-N 2 0 356.485 4.225 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cc2c(s1)CCCC2 ZINC000540158257 1117903321 /nfs/dbraw/zinc/90/33/21/1117903321.db2.gz TVMCKYYQLQICLK-ZYSHUDEJSA-N 2 0 362.583 4.045 20 0 FIADRP CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540175337 1117916075 /nfs/dbraw/zinc/91/60/75/1117916075.db2.gz UFNZYOQEANTBRL-HTAPYJJXSA-N 2 0 368.521 4.364 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000540258263 1117961938 /nfs/dbraw/zinc/96/19/38/1117961938.db2.gz FVAUDQYNXJYROR-JXFKEZNVSA-N 2 0 359.514 4.475 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1nc2ccc(Cl)cc2n1C ZINC000540259518 1117961993 /nfs/dbraw/zinc/96/19/93/1117961993.db2.gz WIRZALDCGGUYHY-CVEARBPZSA-N 2 0 362.949 4.389 20 0 FIADRP Cc1csc(CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1 ZINC000463106574 1117967159 /nfs/dbraw/zinc/96/71/59/1117967159.db2.gz AOTININTOOQWIE-QUCCMNQESA-N 2 0 357.567 4.417 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)ccn1 ZINC000540317863 1117981605 /nfs/dbraw/zinc/98/16/05/1117981605.db2.gz IWCOABDAAKGAAT-JOCHJYFZSA-N 2 0 371.500 4.182 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C2CCN(CCC(F)(F)F)CC2)c1 ZINC000463145575 1117982052 /nfs/dbraw/zinc/98/20/52/1117982052.db2.gz MPXRQFRNCNITKK-UHFFFAOYSA-N 2 0 371.491 4.035 20 0 FIADRP CC(C)(C)[C@@H]1OCCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463133156 1117984354 /nfs/dbraw/zinc/98/43/54/1117984354.db2.gz DJKAYHTUBBJPHQ-IFMALSPDSA-N 2 0 358.570 4.124 20 0 FIADRP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Sc1ccccc1 ZINC000463191775 1118008696 /nfs/dbraw/zinc/00/86/96/1118008696.db2.gz PZTNWCPIXFTYEQ-LJQANCHMSA-N 2 0 354.563 4.464 20 0 FIADRP CCCOc1cccc(CC[NH2+]C2CCN(CCC(F)(F)F)CC2)c1 ZINC000463188148 1118017642 /nfs/dbraw/zinc/01/76/42/1118017642.db2.gz FXKUQSHJIPLMBX-UHFFFAOYSA-N 2 0 358.448 4.024 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000463291124 1118085947 /nfs/dbraw/zinc/08/59/47/1118085947.db2.gz WAXNSURLYBTVQS-JDBUVZGPSA-N 2 0 365.565 4.321 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)cc1F ZINC000540989946 1118339806 /nfs/dbraw/zinc/33/98/06/1118339806.db2.gz ALMLWZRMPZHMAE-APWZRJJASA-N 2 0 356.913 4.003 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)C1CC[NH+](C)CC1 ZINC000312267200 1118406446 /nfs/dbraw/zinc/40/64/46/1118406446.db2.gz GELREKUOGJLAJN-MGPUTAFESA-N 2 0 373.541 4.341 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000541534448 1118552816 /nfs/dbraw/zinc/55/28/16/1118552816.db2.gz QGPDSSHRIFDJQD-CRAIPNDOSA-N 2 0 350.441 4.093 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168439306 1118688884 /nfs/dbraw/zinc/68/88/84/1118688884.db2.gz SIOWNZKDICUELZ-HSZRJFAPSA-N 2 0 352.497 4.279 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000173300641 1119031056 /nfs/dbraw/zinc/03/10/56/1119031056.db2.gz FAZOLHJRQDOBOQ-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@H]([NH2+]CCCOc1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492371741 1119080923 /nfs/dbraw/zinc/08/09/23/1119080923.db2.gz DQPRDTFOJCZCMD-ICSRJNTNSA-N 2 0 356.485 4.095 20 0 FIADRP COc1cccc(CCC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000492469440 1119100128 /nfs/dbraw/zinc/10/01/28/1119100128.db2.gz XZSDOSLPIREMJS-DENIHFKCSA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCc2ccc(OCc3ccccc3)cc2)CC1 ZINC000311499438 1119376856 /nfs/dbraw/zinc/37/68/56/1119376856.db2.gz LHCBXOTWAOFUAR-UHFFFAOYSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311590937 1119380814 /nfs/dbraw/zinc/38/08/14/1119380814.db2.gz AKZSJXYWOBYVSF-WOIUINJBSA-N 2 0 352.522 4.214 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2c(c1)CCCO2 ZINC000153004293 1119821975 /nfs/dbraw/zinc/82/19/75/1119821975.db2.gz WSSFIVRBWVBXLJ-QFIPXVFZSA-N 2 0 368.521 4.193 20 0 FIADRP Brc1ccc(C2CC([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000494525608 1119890658 /nfs/dbraw/zinc/89/06/58/1119890658.db2.gz NQSPGUAWPDGZSO-UHFFFAOYSA-N 2 0 363.343 4.159 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467368335 1119946941 /nfs/dbraw/zinc/94/69/41/1119946941.db2.gz GNRZHZCZJQDGBY-HSALFYBXSA-N 2 0 354.542 4.281 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000191022702 1119958455 /nfs/dbraw/zinc/95/84/55/1119958455.db2.gz ITVBRNOZHLNIKU-UHFFFAOYSA-N 2 0 366.553 4.204 20 0 FIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1csc(Cl)c1 ZINC000191314475 1119970677 /nfs/dbraw/zinc/97/06/77/1119970677.db2.gz ILGWWQMGNAOCDO-OAHLLOKOSA-N 2 0 355.979 4.002 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH+]2Cc3ccccc3-c3ccccc3C2)CC1 ZINC000191471611 1119978640 /nfs/dbraw/zinc/97/86/40/1119978640.db2.gz UXCQQXXIYDEWKW-UHFFFAOYSA-N 2 0 363.549 4.085 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCS2 ZINC000191515000 1119981245 /nfs/dbraw/zinc/98/12/45/1119981245.db2.gz OKPFXQOVGUJNJF-IBGZPJMESA-N 2 0 360.498 4.223 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)C[N@@H+]1Cc1ccccc1 ZINC000494612391 1119996104 /nfs/dbraw/zinc/99/61/04/1119996104.db2.gz NCIDTDILVVJBHU-FUBOCBINSA-N 2 0 368.565 4.224 20 0 FIADRP C[C@H]1COCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000192466863 1120063623 /nfs/dbraw/zinc/06/36/23/1120063623.db2.gz HWEPLVXNWGXFMH-YADARESESA-N 2 0 364.533 4.464 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(Cl)cs2)C[C@H](C)O1 ZINC000193031242 1120095696 /nfs/dbraw/zinc/09/56/96/1120095696.db2.gz JPBCDMIZXAYEGR-GASCZTMLSA-N 2 0 364.942 4.301 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(Br)cc32)c1 ZINC000193972052 1120222668 /nfs/dbraw/zinc/22/26/68/1120222668.db2.gz UWJZBIIUMIMHKY-LJQANCHMSA-N 2 0 359.311 4.288 20 0 FIADRP C[N@H+](CCCOCc1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000542512429 1120309747 /nfs/dbraw/zinc/30/97/47/1120309747.db2.gz YYWFWYPVXVFWTK-UHFFFAOYSA-N 2 0 367.537 4.227 20 0 FIADRP C[N@H+](CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)Cc1ccccc1 ZINC000494882554 1120356205 /nfs/dbraw/zinc/35/62/05/1120356205.db2.gz ZVHNQTKTABTBJB-OFNKIYASSA-N 2 0 370.512 4.405 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495380983 1120768893 /nfs/dbraw/zinc/76/88/93/1120768893.db2.gz TXVRJVQADCGNPC-LZNRXBQRSA-N 2 0 350.506 4.183 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495415299 1120793148 /nfs/dbraw/zinc/79/31/48/1120793148.db2.gz OURXFFLZHVTRKJ-SVFBPWRDSA-N 2 0 351.538 4.314 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccccc3F)CC2)cc1 ZINC000495673485 1120926347 /nfs/dbraw/zinc/92/63/47/1120926347.db2.gz ZFMLHSSANJLMCN-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000235135442 1120939891 /nfs/dbraw/zinc/93/98/91/1120939891.db2.gz MXZFKUMSIMGTPR-ZDUSSCGKSA-N 2 0 353.348 4.279 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1 ZINC000236891271 1120971221 /nfs/dbraw/zinc/97/12/21/1120971221.db2.gz PVKSBLFRZHWKRZ-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000237146010 1120974064 /nfs/dbraw/zinc/97/40/64/1120974064.db2.gz KRTWHBPBNPCPSU-RTBURBONSA-N 2 0 352.522 4.148 20 0 FIADRP COc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)ccc1OCc1cccs1 ZINC000237210772 1120975008 /nfs/dbraw/zinc/97/50/08/1120975008.db2.gz IBQKVGMSQQJVRU-QGZVFWFLSA-N 2 0 374.550 4.157 20 0 FIADRP Cc1cc(F)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237622164 1120980387 /nfs/dbraw/zinc/98/03/87/1120980387.db2.gz HECYJPAFVDDBHE-HDICACEKSA-N 2 0 356.485 4.033 20 0 FIADRP C[C@@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)CC1CCCCC1 ZINC001649060600 1121432986 /nfs/dbraw/zinc/43/29/86/1121432986.db2.gz PZGVUEGRNITQCH-NFBKMPQASA-N 2 0 357.586 4.171 20 0 FIADRP C[C@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)CC1CCCCC1 ZINC001649060601 1121433568 /nfs/dbraw/zinc/43/35/68/1121433568.db2.gz PZGVUEGRNITQCH-NZQKXSOJSA-N 2 0 357.586 4.171 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cnn1-c1ccc(F)cc1 ZINC000123726619 1121627506 /nfs/dbraw/zinc/62/75/06/1121627506.db2.gz VNYJZRYIAFCUBJ-MRXNPFEDSA-N 2 0 366.484 4.232 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3[nH]c(=O)oc3c2)c1 ZINC000671744370 1121657833 /nfs/dbraw/zinc/65/78/33/1121657833.db2.gz XREYRTZERAFFRV-OAHLLOKOSA-N 2 0 353.466 4.224 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000063917778 1121728106 /nfs/dbraw/zinc/72/81/06/1121728106.db2.gz NPDJVTBTIAUEJG-OAQYLSRUSA-N 2 0 368.521 4.096 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C[C@@H]4CC45CCOCC5)[C@H]3C2)cc1 ZINC000671761460 1121791038 /nfs/dbraw/zinc/79/10/38/1121791038.db2.gz VDZKCPJRRYHFBK-MLCQCVOFSA-N 2 0 368.565 4.084 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2CC[NH+](C)CC2)CCC3)cc1 ZINC000126300061 1121942992 /nfs/dbraw/zinc/94/29/92/1121942992.db2.gz DPCDJMMCXQMPCS-SFHVURJKSA-N 2 0 371.550 4.128 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CSC(C)(C)C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765781864 1121992627 /nfs/dbraw/zinc/99/26/27/1121992627.db2.gz XOWUKRHQEHTCHU-JKSUJKDBSA-N 2 0 367.578 4.148 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc(F)c3)cc2)C1 ZINC000917006228 1121999629 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CCC[C@H](CCO)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556871796 1123153211 /nfs/dbraw/zinc/15/32/11/1123153211.db2.gz MXXHRQKNRHDLBI-CWKRKGSWSA-N 2 0 358.570 4.066 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)c1 ZINC000132467382 1123263496 /nfs/dbraw/zinc/26/34/96/1123263496.db2.gz XHQJRYKMCVIBGH-GOSISDBHSA-N 2 0 363.427 4.329 20 0 FIADRP Cc1cccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499140337 1123280851 /nfs/dbraw/zinc/28/08/51/1123280851.db2.gz VJDVBKHZMUUVTQ-DKUWSORSSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499144747 1123287229 /nfs/dbraw/zinc/28/72/29/1123287229.db2.gz XXLDIIADNBBAQY-UOHRICOVSA-N 2 0 369.597 4.140 20 0 FIADRP C[N@H+](CCCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1)C1CCCCC1 ZINC000499149210 1123292523 /nfs/dbraw/zinc/29/25/23/1123292523.db2.gz SKCNAQVXQFEZOV-VILGAWFOSA-N 2 0 369.597 4.426 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499196128 1123315896 /nfs/dbraw/zinc/31/58/96/1123315896.db2.gz RGVQFYGICYSSBU-GJPOJAMWSA-N 2 0 362.517 4.468 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499218591 1123332582 /nfs/dbraw/zinc/33/25/82/1123332582.db2.gz YPJYKMJERIHLGH-FWKCKQQBSA-N 2 0 356.554 4.103 20 0 FIADRP O[C@@H]1CCCC[C@H]1CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499218593 1123332916 /nfs/dbraw/zinc/33/29/16/1123332916.db2.gz YPJYKMJERIHLGH-IACLWVNRSA-N 2 0 356.554 4.103 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1 ZINC000499232161 1123340904 /nfs/dbraw/zinc/34/09/04/1123340904.db2.gz GOWJZYVXIDNGMG-PSWRPDDJSA-N 2 0 350.506 4.239 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccc(F)cc1 ZINC000499250183 1123358352 /nfs/dbraw/zinc/35/83/52/1123358352.db2.gz LTXODGDYFUCAJX-HLRQEUIKSA-N 2 0 368.496 4.378 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccc(F)cc1 ZINC000499250179 1123358400 /nfs/dbraw/zinc/35/84/00/1123358400.db2.gz LTXODGDYFUCAJX-AGOPTVSRSA-N 2 0 368.496 4.378 20 0 FIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2ccccc2)cc1 ZINC000132827844 1123366133 /nfs/dbraw/zinc/36/61/33/1123366133.db2.gz UPFIRKHZLRPZRD-ZJSXRUAMSA-N 2 0 364.533 4.061 20 0 FIADRP Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000920179165 1123396055 /nfs/dbraw/zinc/39/60/55/1123396055.db2.gz BNLVXQAUFIUORY-QGZVFWFLSA-N 2 0 374.960 4.436 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccc(OC)cc2)CC1 ZINC000134175607 1123601082 /nfs/dbraw/zinc/60/10/82/1123601082.db2.gz FREGIAJAJVNLFN-UHFFFAOYSA-N 2 0 370.541 4.029 20 0 FIADRP Cc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000237767002 1123655648 /nfs/dbraw/zinc/65/56/48/1123655648.db2.gz HMSGKJDLEZEJMS-UHFFFAOYSA-N 2 0 352.522 4.156 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccccc1 ZINC000615316038 1123988580 /nfs/dbraw/zinc/98/85/80/1123988580.db2.gz HXXRXNPFWLUMFE-RBUKOAKNSA-N 2 0 365.521 4.035 20 0 FIADRP OCCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000245642333 1124159375 /nfs/dbraw/zinc/15/93/75/1124159375.db2.gz AZQRXMJWKMAMHG-DKUWSORSSA-N 2 0 356.554 4.105 20 0 FIADRP CCc1cnc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000245642233 1124159491 /nfs/dbraw/zinc/15/94/91/1124159491.db2.gz AYAZYWJMWITUIC-REPLKXPHSA-N 2 0 355.551 4.033 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)C1CCC(C(F)(F)F)CC1 ZINC000474477008 1124173478 /nfs/dbraw/zinc/17/34/78/1124173478.db2.gz YQDOABXZVCNCGW-ZLPCBKJTSA-N 2 0 372.475 4.474 20 0 FIADRP COCc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245701913 1124209672 /nfs/dbraw/zinc/20/96/72/1124209672.db2.gz LUSKAFARPHUPBC-NUNAXRQHSA-N 2 0 350.506 4.118 20 0 FIADRP CCCCC[C@H]([NH2+]C)c1nc(-c2ncccc2/C=C/[NH+]2CCCC2)no1 ZINC001212281128 1124278530 /nfs/dbraw/zinc/27/85/30/1124278530.db2.gz IYJJYHDZCXYIFT-JMPLCFMRSA-N 2 0 355.486 4.039 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000246122255 1124362307 /nfs/dbraw/zinc/36/23/07/1124362307.db2.gz QTCCDLVACTZMRF-HBMCJLEFSA-N 2 0 362.945 4.149 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC(C)(C)Cc1ccccc1 ZINC000246516950 1124520602 /nfs/dbraw/zinc/52/06/02/1124520602.db2.gz UKFRRUZGNZTQOW-SIKLNZKXSA-N 2 0 351.538 4.151 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2cccs2)C2CCCC2)CC1 ZINC000246528754 1124524643 /nfs/dbraw/zinc/52/46/43/1124524643.db2.gz VEZFJTCGEYXOEL-QKNQBKEWSA-N 2 0 362.583 4.337 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000246564184 1124534743 /nfs/dbraw/zinc/53/47/43/1124534743.db2.gz XHRBLSPFXMVTCQ-RJGXRXQPSA-N 2 0 358.570 4.001 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000246895528 1124572311 /nfs/dbraw/zinc/57/23/11/1124572311.db2.gz FPHNUWGZWQTXSC-KFKAGJAMSA-N 2 0 371.491 4.161 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C2CC2)cc1 ZINC000248430228 1124766983 /nfs/dbraw/zinc/76/69/83/1124766983.db2.gz BNAPPOPQOKEYRJ-ZEQRLZLVSA-N 2 0 364.533 4.193 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000248433985 1124768114 /nfs/dbraw/zinc/76/81/14/1124768114.db2.gz DOBCUQBQPQNCNM-RZFNWQHOSA-N 2 0 364.533 4.290 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc(F)ccc1F ZINC000248434434 1124768579 /nfs/dbraw/zinc/76/85/79/1124768579.db2.gz DWUJRNAHHQMPFX-UGKGYDQZSA-N 2 0 374.475 4.162 20 0 FIADRP CC1(C)Cc2occc2[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C1 ZINC000248438890 1124769630 /nfs/dbraw/zinc/76/96/30/1124769630.db2.gz ICXIYWTURDPWRT-PZJWPPBQSA-N 2 0 368.521 4.040 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1 ZINC000248455235 1124772034 /nfs/dbraw/zinc/77/20/34/1124772034.db2.gz RJMUXLXBZKWONB-FCHUYYIVSA-N 2 0 356.485 4.023 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215500 1124891159 /nfs/dbraw/zinc/89/11/59/1124891159.db2.gz BLVASNLZFMQCKW-ROUUACIJSA-N 2 0 353.510 4.088 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000089214800 1124891299 /nfs/dbraw/zinc/89/12/99/1124891299.db2.gz XOQMUGXIMRWAKQ-IBGZPJMESA-N 2 0 357.498 4.264 20 0 FIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215401 1124891564 /nfs/dbraw/zinc/89/15/64/1124891564.db2.gz GELZINCPMLZHCK-HNNXBMFYSA-N 2 0 359.901 4.311 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccccc3Cl)CC2)cc1 ZINC000063319616 1124908375 /nfs/dbraw/zinc/90/83/75/1124908375.db2.gz YGBXLTNJIMJDDW-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000090525582 1125001825 /nfs/dbraw/zinc/00/18/25/1125001825.db2.gz HHWHUUWGPOANML-JVPBZIDWSA-N 2 0 370.459 4.124 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1OC(F)F ZINC000090586080 1125006232 /nfs/dbraw/zinc/00/62/32/1125006232.db2.gz DVJCTGBNIQSERQ-HOTGVXAUSA-N 2 0 370.484 4.315 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2)ccc1OC ZINC000182285320 1125322656 /nfs/dbraw/zinc/32/26/56/1125322656.db2.gz YKPZUTVBPOAWMG-HRAATJIYSA-N 2 0 374.500 4.060 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000521435301 568014622 /nfs/dbraw/zinc/01/46/22/568014622.db2.gz ZNYSVGZBOCSQEW-IBGZPJMESA-N 2 0 374.532 4.158 20 0 FIADRP c1ccc(COc2cccc(C[NH2+]C3CCN(c4ccccn4)CC3)c2)cc1 ZINC000067693018 568080776 /nfs/dbraw/zinc/08/07/76/568080776.db2.gz BTUWYZCBDMFVTO-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP CC[C@H](C[N@H+](Cc1nccn1CC)[C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000563136709 568270156 /nfs/dbraw/zinc/27/01/56/568270156.db2.gz NHZVWTYOCFQUEL-TZIWHRDSSA-N 2 0 366.553 4.041 20 0 FIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@H](Cc4ccccc4)C3)c2)CC1 ZINC001165038281 721900167 /nfs/dbraw/zinc/90/01/67/721900167.db2.gz PNZSFNZCKOPIDJ-HXUWFJFHSA-N 2 0 365.521 4.014 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)ccc1OC ZINC000182574671 1125572819 /nfs/dbraw/zinc/57/28/19/1125572819.db2.gz KSYDHQWNRWIWNX-ROUUACIJSA-N 2 0 370.537 4.441 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000152751101 1125643532 /nfs/dbraw/zinc/64/35/32/1125643532.db2.gz AJZDSHXRWOFNLB-MRXNPFEDSA-N 2 0 360.473 4.016 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]CCc2cn3c(n2)CCCC3)cc1OC ZINC000152815789 1125659328 /nfs/dbraw/zinc/65/93/28/1125659328.db2.gz UGTGYJMJPFDEAH-KRWDZBQOSA-N 2 0 371.525 4.300 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000619766644 1125688433 /nfs/dbraw/zinc/68/84/33/1125688433.db2.gz RVEGCQHHJCTSGX-GOSISDBHSA-N 2 0 356.485 4.021 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)cc1C[NH+]1CCCCC1 ZINC000183013479 1125721356 /nfs/dbraw/zinc/72/13/56/1125721356.db2.gz QZXSYWHQYYURIL-VHHKXPHXSA-N 2 0 372.553 4.145 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@H]2CSCCS2)ccc1OC ZINC000183093604 1125750191 /nfs/dbraw/zinc/75/01/91/1125750191.db2.gz WXNKWBOJXIGAMH-CRAIPNDOSA-N 2 0 368.612 4.036 20 0 FIADRP COc1ccc([C@@H](C)NC2CC[NH+](C(C)C)CC2)cc1C[NH+]1CCCCC1 ZINC000183165829 1125767767 /nfs/dbraw/zinc/76/77/67/1125767767.db2.gz NSUPYOJCSWHGFB-LJQANCHMSA-N 2 0 373.585 4.205 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C2CC2)s1 ZINC000643548328 1079680667 /nfs/dbraw/zinc/68/06/67/1079680667.db2.gz NWNINSVZBIBDBG-SWLSCSKDSA-N 2 0 355.345 4.226 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)ccc1OCCC(C)C ZINC000643547785 1079681441 /nfs/dbraw/zinc/68/14/41/1079681441.db2.gz GQPHZIHGJINXLX-IJXRJRJASA-N 2 0 360.542 4.159 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)ccc1OCCC(C)C ZINC000643547780 1079682030 /nfs/dbraw/zinc/68/20/30/1079682030.db2.gz GQPHZIHGJINXLX-FRYIKTPZSA-N 2 0 360.542 4.159 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)CCCC(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000137302141 1080314610 /nfs/dbraw/zinc/31/46/10/1080314610.db2.gz OXVJMCXZZVMCOB-UHFFFAOYSA-N 2 0 359.558 4.137 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000154846414 1080443217 /nfs/dbraw/zinc/44/32/17/1080443217.db2.gz MHYPMSRSUFSOSI-QGZVFWFLSA-N 2 0 353.510 4.336 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180136091 1080455590 /nfs/dbraw/zinc/45/55/90/1080455590.db2.gz PGNWBGPJQALPEF-IRFPFTSISA-N 2 0 350.506 4.108 20 0 FIADRP COCc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1 ZINC001648791908 1080496787 /nfs/dbraw/zinc/49/67/87/1080496787.db2.gz DLZPGQXVOABHQI-LJQANCHMSA-N 2 0 352.522 4.355 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc2ccccc21 ZINC000180645294 1080533398 /nfs/dbraw/zinc/53/33/98/1080533398.db2.gz GWTAOGLTLTXCNI-AVRDEDQJSA-N 2 0 360.501 4.257 20 0 FIADRP O=C(CC[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)Nc1ccc(Cl)cc1 ZINC000683342217 1080680569 /nfs/dbraw/zinc/68/05/69/1080680569.db2.gz OCTVSVQQGIXSJU-UHFFFAOYSA-N 2 0 371.912 4.054 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[C@H]3COCC[C@@H]3C2)cc1 ZINC001648795414 1080795555 /nfs/dbraw/zinc/79/55/55/1080795555.db2.gz OGUORQJEHUUYKZ-TWHAJKEOSA-N 2 0 356.554 4.356 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C3CC(OCc4ccccc4)C3)C2)CC1 ZINC001167256522 1080915586 /nfs/dbraw/zinc/91/55/86/1080915586.db2.gz YWUZJTIZVTVYDB-UVKLAMSESA-N 2 0 356.554 4.178 20 0 FIADRP CCOc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC ZINC000312519850 1080965546 /nfs/dbraw/zinc/96/55/46/1080965546.db2.gz OIRGYUJSQYDGPM-NQIIRXRSSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@@H]([NH3+])c2ccccc2)cc1 ZINC000237526609 1080973324 /nfs/dbraw/zinc/97/33/24/1080973324.db2.gz OWAHVXDELALJSZ-PGRDOPGGSA-N 2 0 365.521 4.480 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc(C)c1 ZINC000397500694 1081003151 /nfs/dbraw/zinc/00/31/51/1081003151.db2.gz XHGROPJIWUMDJG-JOCHJYFZSA-N 2 0 352.522 4.063 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc3c(c2)OCCCCO3)C1 ZINC001648811400 1081126415 /nfs/dbraw/zinc/12/64/15/1081126415.db2.gz MEEJUZDLTZKMIQ-OALUTQOASA-N 2 0 360.542 4.086 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+]C2CCN([C@H]3CCOC3)CC2)cc1 ZINC000655711204 1081129192 /nfs/dbraw/zinc/12/91/92/1081129192.db2.gz GKJFRJYYLLKDER-NRFANRHFSA-N 2 0 366.505 4.130 20 0 FIADRP Cc1nn(-c2ccc(C)cc2)cc1CN[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000655758097 1081173994 /nfs/dbraw/zinc/17/39/94/1081173994.db2.gz QKGQYRIWJLSBCE-QUCCMNQESA-N 2 0 366.553 4.232 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CCC3)cc1 ZINC000655806230 1081214857 /nfs/dbraw/zinc/21/48/57/1081214857.db2.gz RWQJZAFDHLFVTK-UWWQBHOKSA-N 2 0 371.550 4.126 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]C3CCC4(CCCC4)CC3)cc2)CC1 ZINC001648814098 1081215968 /nfs/dbraw/zinc/21/59/68/1081215968.db2.gz FQCRBZMUCKCVHD-UHFFFAOYSA-N 2 0 369.597 4.417 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc3ccccc3n2C)cc1 ZINC001648814444 1081219309 /nfs/dbraw/zinc/21/93/09/1081219309.db2.gz MNXCRBNWPGUODQ-UHFFFAOYSA-N 2 0 365.521 4.189 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCC(C)(C)CC3)cc2)CC1 ZINC001648815009 1081227753 /nfs/dbraw/zinc/22/77/53/1081227753.db2.gz YDWVDZNOUBMNIP-JOCHJYFZSA-N 2 0 357.586 4.273 20 0 FIADRP FC(F)(F)Oc1cccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000655820807 1081231585 /nfs/dbraw/zinc/23/15/85/1081231585.db2.gz LYBTVNYICCQRNX-IRXDYDNUSA-N 2 0 368.443 4.223 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC000137683408 1081264497 /nfs/dbraw/zinc/26/44/97/1081264497.db2.gz BEEYVSUFTWSAIU-NRFANRHFSA-N 2 0 371.569 4.138 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC000137691507 1081275273 /nfs/dbraw/zinc/27/52/73/1081275273.db2.gz XQZCUJGUNHQPLJ-HXUWFJFHSA-N 2 0 359.558 4.137 20 0 FIADRP COc1ccccc1C[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397600979 1081296123 /nfs/dbraw/zinc/29/61/23/1081296123.db2.gz UGUQOTHFYCEBCE-LJQANCHMSA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000579982262 1081361570 /nfs/dbraw/zinc/36/15/70/1081361570.db2.gz VFYKTFRDTNDJFM-FUHWJXTLSA-N 2 0 368.949 4.015 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000579982261 1081361750 /nfs/dbraw/zinc/36/17/50/1081361750.db2.gz VFYKTFRDTNDJFM-AEFFLSMTSA-N 2 0 368.949 4.015 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2OCCc4ccccc42)C3)cc1 ZINC000683692379 1081390370 /nfs/dbraw/zinc/39/03/70/1081390370.db2.gz PQIIPDWDWGNWIU-YCSHWKNNSA-N 2 0 362.517 4.086 20 0 FIADRP CC(C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000683692947 1081392254 /nfs/dbraw/zinc/39/22/54/1081392254.db2.gz YHWZRBVNUUCJJM-KJJMTIBFSA-N 2 0 356.554 4.367 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4cccc5cccnc54)C[C@@H]3C2)cc1 ZINC000312614221 1081459563 /nfs/dbraw/zinc/45/95/63/1081459563.db2.gz GEBXRVCSAWITEM-GMAHTHKFSA-N 2 0 357.501 4.189 20 0 FIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)cc1 ZINC000537956461 1081504431 /nfs/dbraw/zinc/50/44/31/1081504431.db2.gz RQIRBZVHWMPONH-UFYCRDLUSA-N 2 0 350.934 4.149 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](N[C@@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)C1 ZINC000580101778 1081593853 /nfs/dbraw/zinc/59/38/53/1081593853.db2.gz IOHVVGLHWMYKDE-OUJCMCIWSA-N 2 0 363.549 4.247 20 0 FIADRP COc1ccccc1CC[N@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001167364158 1081729220 /nfs/dbraw/zinc/72/92/20/1081729220.db2.gz VHDRWSPBMOBIFM-UHFFFAOYSA-N 2 0 352.522 4.356 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000048745020 1081835259 /nfs/dbraw/zinc/83/52/59/1081835259.db2.gz ZEIAUXRKGZWPQE-QGZVFWFLSA-N 2 0 371.912 4.024 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000580373565 1081907003 /nfs/dbraw/zinc/90/70/03/1081907003.db2.gz CILUNRLISXDFAS-LJQANCHMSA-N 2 0 361.917 4.306 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cc(C(=O)OC)cs1 ZINC000580415259 1081939438 /nfs/dbraw/zinc/93/94/38/1081939438.db2.gz PSEABTPRWPFMTN-OAHLLOKOSA-N 2 0 360.523 4.227 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000564432367 1082035486 /nfs/dbraw/zinc/03/54/86/1082035486.db2.gz DKGKGMCGESYLHW-KRWDZBQOSA-N 2 0 350.572 4.344 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(C2CCCCC2)cc1 ZINC000471599099 1082036475 /nfs/dbraw/zinc/03/64/75/1082036475.db2.gz NYSROAMDLZDGDR-WOJBJXKFSA-N 2 0 357.586 4.411 20 0 FIADRP CCC[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471611262 1082093874 /nfs/dbraw/zinc/09/38/74/1082093874.db2.gz BRPNZCZRWSLEDF-HNAYVOBHSA-N 2 0 372.384 4.450 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000471619842 1082161556 /nfs/dbraw/zinc/16/15/56/1082161556.db2.gz ODXDOEAOIUQDOX-MSOLQXFVSA-N 2 0 357.567 4.092 20 0 FIADRP FC(F)(F)[C@H]1CC([NH2+]C2CCN(C3CC3)CC2)C[C@H](C(F)(F)F)C1 ZINC000656472380 1082455689 /nfs/dbraw/zinc/45/56/89/1082455689.db2.gz DRLJOPOHKOBQHX-GHMZBOCLSA-N 2 0 358.370 4.112 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)[NH+]1CCCCCC1 ZINC000510389113 1082470778 /nfs/dbraw/zinc/47/07/78/1082470778.db2.gz NUKMAMBTSNPFIZ-OALUTQOASA-N 2 0 357.542 4.122 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCCCCC1 ZINC000510389887 1082477106 /nfs/dbraw/zinc/47/71/06/1082477106.db2.gz UHKABTCRXCCKQB-OALUTQOASA-N 2 0 357.542 4.264 20 0 FIADRP C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001167472764 1082691311 /nfs/dbraw/zinc/69/13/11/1082691311.db2.gz CQFSMJQXTVXWGE-HXUWFJFHSA-N 2 0 352.522 4.056 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cn(C)nc1-c1ccc(C)o1 ZINC000647168990 1082721671 /nfs/dbraw/zinc/72/16/71/1082721671.db2.gz UQGNCLDYJANHIR-UHFFFAOYSA-N 2 0 366.509 4.120 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)cc1O ZINC000581755928 1082872048 /nfs/dbraw/zinc/87/20/48/1082872048.db2.gz LTCVXJIRLMCNSQ-SFHVURJKSA-N 2 0 368.521 4.484 20 0 FIADRP COC[C@@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000559095525 1082901952 /nfs/dbraw/zinc/90/19/52/1082901952.db2.gz ZJLVBAAOEGNECP-PXWCZTGZSA-N 2 0 350.934 4.126 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)[C@@H](C)C1 ZINC000430758014 1083146509 /nfs/dbraw/zinc/14/65/09/1083146509.db2.gz YHQTVEOAHDYVQP-ADOMEBDSSA-N 2 0 369.322 4.154 20 0 FIADRP Cc1cccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2cccc(F)c2)c1 ZINC000510716027 1083259218 /nfs/dbraw/zinc/25/92/18/1083259218.db2.gz OFPIXZMNUYPZSK-PKTZIBPZSA-N 2 0 370.512 4.050 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3ccc(Br)cc32)C1 ZINC000510754585 1083291360 /nfs/dbraw/zinc/29/13/60/1083291360.db2.gz ULFYJZKXKRRMJY-KBXCAEBGSA-N 2 0 351.332 4.146 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431041216 1083310994 /nfs/dbraw/zinc/31/09/94/1083310994.db2.gz RTCZBJBKFDKGAB-GOSISDBHSA-N 2 0 363.505 4.075 20 0 FIADRP C[C@@H](CC1CCOCC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320172 1083406144 /nfs/dbraw/zinc/40/61/44/1083406144.db2.gz PHEBTDGCLWULMO-UGKGYDQZSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(O)c1 ZINC000658320439 1083408436 /nfs/dbraw/zinc/40/84/36/1083408436.db2.gz YDENUTMZUMBHEX-RXVVDRJESA-N 2 0 350.506 4.345 20 0 FIADRP C[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483457 1083467748 /nfs/dbraw/zinc/46/77/48/1083467748.db2.gz NWTPQWMMTMQUPL-MJGOQNOKSA-N 2 0 371.594 4.483 20 0 FIADRP C[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483458 1083468491 /nfs/dbraw/zinc/46/84/91/1083468491.db2.gz NWTPQWMMTMQUPL-PKOBYXMFSA-N 2 0 371.594 4.483 20 0 FIADRP CCC(=O)Nc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000548483510 1083468533 /nfs/dbraw/zinc/46/85/33/1083468533.db2.gz ATFUGWZMQXYKNF-RXVVDRJESA-N 2 0 365.521 4.035 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1cccc(OC(C)(C)C)n1 ZINC000548487955 1083489744 /nfs/dbraw/zinc/48/97/44/1083489744.db2.gz GDCARKXTJHSJJE-WIYYLYMNSA-N 2 0 367.537 4.259 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000510973762 1083543146 /nfs/dbraw/zinc/54/31/46/1083543146.db2.gz AUDUBFGAENQOQK-VFNWGFHPSA-N 2 0 372.484 4.113 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000535808495 1083693772 /nfs/dbraw/zinc/69/37/72/1083693772.db2.gz IKYBXVNTYPRJTK-IRLDBZIGSA-N 2 0 360.505 4.049 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccc(F)cc2)s1 ZINC000535809145 1083697554 /nfs/dbraw/zinc/69/75/54/1083697554.db2.gz IPALIYXZJKTHTM-HOJAQTOUSA-N 2 0 374.525 4.238 20 0 FIADRP CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)CCO1 ZINC000181272971 1083850646 /nfs/dbraw/zinc/85/06/46/1083850646.db2.gz JXXSDKJJJJQIHW-XJABCFGWSA-N 2 0 362.558 4.261 20 0 FIADRP Cn1cc2c(n1)CCC[C@@H]2[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000375647845 1083913555 /nfs/dbraw/zinc/91/35/55/1083913555.db2.gz GKVWNEQYAMZWGN-QHCPKHFHSA-N 2 0 374.532 4.316 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@H](C)[C@@H]3CCC[NH2+]C3)c2C1 ZINC000236721005 1083973021 /nfs/dbraw/zinc/97/30/21/1083973021.db2.gz SCUXUQKVEFZBBW-ZWKOTPCHSA-N 2 0 357.542 4.013 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+][C@@H]2CCCOC2)c1 ZINC000133445220 1084133053 /nfs/dbraw/zinc/13/30/53/1084133053.db2.gz NMYMKRKUCGYXDQ-JOCHJYFZSA-N 2 0 350.506 4.218 20 0 FIADRP Cc1c[nH]c(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000657303322 1084343025 /nfs/dbraw/zinc/34/30/25/1084343025.db2.gz MOYDJLAILMWGEW-UHFFFAOYSA-N 2 0 360.505 4.271 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2c(C3CCC3)cnn2C)cc1 ZINC000657311016 1084405084 /nfs/dbraw/zinc/40/50/84/1084405084.db2.gz VOYMCZCWOPNAQK-SFHVURJKSA-N 2 0 366.553 4.352 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OC ZINC000414162064 1084719314 /nfs/dbraw/zinc/71/93/14/1084719314.db2.gz CUELDBJUFVTVAU-INIZCTEOSA-N 2 0 353.466 4.373 20 0 FIADRP FC(F)(F)Oc1cccc([C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)c1 ZINC000414190426 1084778494 /nfs/dbraw/zinc/77/84/94/1084778494.db2.gz RRHRFOXZZDNNNY-SFHVURJKSA-N 2 0 361.367 4.474 20 0 FIADRP COCc1csc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000657415575 1084957732 /nfs/dbraw/zinc/95/77/32/1084957732.db2.gz LAFINQVDDKSEHK-PKOBYXMFSA-N 2 0 358.551 4.285 20 0 FIADRP CCc1ncc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cn1 ZINC000414277147 1084958100 /nfs/dbraw/zinc/95/81/00/1084958100.db2.gz VECAEEGDDHRHIG-UHFFFAOYSA-N 2 0 360.505 4.057 20 0 FIADRP C[NH+](C)CCC1CC[NH+](CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000511507458 1084979464 /nfs/dbraw/zinc/97/94/64/1084979464.db2.gz UVNSQLHTPZZYAL-UHFFFAOYSA-N 2 0 369.336 4.433 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@@H]1CN(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167573360 1084992643 /nfs/dbraw/zinc/99/26/43/1084992643.db2.gz VKNLBHHDVKEEFE-AKIFATBCSA-N 2 0 357.586 4.234 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)CC1 ZINC000472584092 1085049764 /nfs/dbraw/zinc/04/97/64/1085049764.db2.gz GOVNTAOTMZVGSZ-XIQMRYHBSA-N 2 0 369.597 4.361 20 0 FIADRP FC(F)(F)c1ccc(C2(C[NH2+]Cc3ccnn3-c3cc[nH+]cc3)CC2)cc1 ZINC000657444243 1085061622 /nfs/dbraw/zinc/06/16/22/1085061622.db2.gz WYZPSPZXYXYEDZ-UHFFFAOYSA-N 2 0 372.394 4.108 20 0 FIADRP COCC[C@@H](Cc1ccco1)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582486512 1085063666 /nfs/dbraw/zinc/06/36/66/1085063666.db2.gz MMTBVBQFADEVRA-LEWJYISDSA-N 2 0 368.521 4.014 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000563415144 1085244719 /nfs/dbraw/zinc/24/47/19/1085244719.db2.gz BXNJTNDGAWQBAS-BZSNNMDCSA-N 2 0 352.526 4.114 20 0 FIADRP CCC(C)(C)C1CCC([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657536877 1085453078 /nfs/dbraw/zinc/45/30/78/1085453078.db2.gz SBQPBJFVXCNWSZ-UHFFFAOYSA-N 2 0 350.591 4.462 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH+](C)C)c2)cc1 ZINC000511188366 1085521137 /nfs/dbraw/zinc/52/11/37/1085521137.db2.gz OPGHDVHEPCUSMT-UHFFFAOYSA-N 2 0 353.510 4.232 20 0 FIADRP FC(F)(F)[C@@H](CNC1CC[NH+](Cc2ccccc2)CC1)OC1CCCC1 ZINC000657587028 1085648110 /nfs/dbraw/zinc/64/81/10/1085648110.db2.gz OWRGHIOLSJDTCK-LJQANCHMSA-N 2 0 370.459 4.131 20 0 FIADRP FC(F)(F)c1ccccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657612282 1085687581 /nfs/dbraw/zinc/68/75/81/1085687581.db2.gz LOQUYQWYGFDZFQ-UHFFFAOYSA-N 2 0 363.427 4.102 20 0 FIADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613834 1085699296 /nfs/dbraw/zinc/69/92/96/1085699296.db2.gz SLNIOOQVXKYVAX-BJKOFHAPSA-N 2 0 363.549 4.295 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)cc1 ZINC000651949036 1085706104 /nfs/dbraw/zinc/70/61/04/1085706104.db2.gz AZDANBPGGNOKNI-HXUWFJFHSA-N 2 0 372.484 4.158 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000652152189 1085719988 /nfs/dbraw/zinc/71/99/88/1085719988.db2.gz GQXSIMCMQJDEFK-HSZRJFAPSA-N 2 0 367.537 4.425 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582844802 1085821625 /nfs/dbraw/zinc/82/16/25/1085821625.db2.gz NQBXNGREMGYUAW-IRLDBZIGSA-N 3 0 357.586 4.284 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000090846584 1085897903 /nfs/dbraw/zinc/89/79/03/1085897903.db2.gz BUPCDTQZWGNQOS-VQTJNVASSA-N 2 0 366.505 4.246 20 0 FIADRP Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000663097537 1085990290 /nfs/dbraw/zinc/99/02/90/1085990290.db2.gz ZZDBXPQZFIENGO-JOCHJYFZSA-N 2 0 352.526 4.052 20 0 FIADRP C[C@@H]([NH2+]CC1(C[NH2+][C@H](C)C2CCC(F)CC2)COC1)C1CCC(F)CC1 ZINC000662001799 1086002892 /nfs/dbraw/zinc/00/28/92/1086002892.db2.gz OTVYNXLZLSZXGW-SBXPZINTSA-N 2 0 372.544 4.016 20 0 FIADRP COc1ccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)cc1 ZINC001167647379 1086024370 /nfs/dbraw/zinc/02/43/70/1086024370.db2.gz MBWRTMSTDMLFLE-FYYLOGMGSA-N 2 0 350.506 4.182 20 0 FIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(OCc4ccc(F)cc4)cc3)CC[C@H]21 ZINC001167648327 1086027383 /nfs/dbraw/zinc/02/73/83/1086027383.db2.gz SMCFXJIYYUDDTP-NFBKMPQASA-N 2 0 368.496 4.321 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H](CO)c2ccccc2Cl)CC1 ZINC000583162205 1086326691 /nfs/dbraw/zinc/32/66/91/1086326691.db2.gz OWIQEXDZYHAJPZ-LLGFUMIMSA-N 2 0 364.961 4.049 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC(C)(C)C(F)(F)F)c1ccccc1O2 ZINC000583476394 1086331388 /nfs/dbraw/zinc/33/13/88/1086331388.db2.gz PQCKCMJZCKCFBD-OAHLLOKOSA-N 2 0 356.432 4.153 20 0 FIADRP CC[NH+](CC)Cc1ccc(CNCc2csc(-c3ccccn3)n2)cc1 ZINC000124059127 1086349524 /nfs/dbraw/zinc/34/95/24/1086349524.db2.gz PXEOWOPQCDARHI-UHFFFAOYSA-N 2 0 366.534 4.337 20 0 FIADRP CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1cccc2c1CC[NH2+]C2 ZINC000662260326 1086381245 /nfs/dbraw/zinc/38/12/45/1086381245.db2.gz LJGCUBNWNJTZRW-JOCHJYFZSA-N 2 0 360.505 4.039 20 0 FIADRP Clc1cccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)co2)c1 ZINC000662294056 1086398930 /nfs/dbraw/zinc/39/89/30/1086398930.db2.gz AMSFPTGBOGBQFN-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293722 1086399998 /nfs/dbraw/zinc/39/99/98/1086399998.db2.gz MMNVSZOITBJOGU-GDBMZVCRSA-N 2 0 362.468 4.204 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297820 1086401246 /nfs/dbraw/zinc/40/12/46/1086401246.db2.gz SGXWCTUGXKNSKY-QUCCMNQESA-N 2 0 371.569 4.157 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2cccc(OCc3ccccn3)c2)[C@@H]1CCC[NH3+] ZINC000662318444 1086413437 /nfs/dbraw/zinc/41/34/37/1086413437.db2.gz ZIHPSDGFSUURQS-XMSQKQJNSA-N 2 0 353.510 4.000 20 0 FIADRP CC(C)[C@@H](O)[C@@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccccc1 ZINC000657745655 1086465553 /nfs/dbraw/zinc/46/55/53/1086465553.db2.gz JOYMRONJULOLSS-BJKOFHAPSA-N 2 0 366.549 4.041 20 0 FIADRP COCc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc1OC ZINC000162927346 1086479150 /nfs/dbraw/zinc/47/91/50/1086479150.db2.gz ZIWVTHRXRKPJPN-SFHVURJKSA-N 2 0 368.521 4.288 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535987980 1086528838 /nfs/dbraw/zinc/52/88/38/1086528838.db2.gz PGCGMUFLPKVUBP-BEFAXECRSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@@H](C[NH2+]C1CCN([C@H]2CCOC2)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000657751325 1086561405 /nfs/dbraw/zinc/56/14/05/1086561405.db2.gz QBQHXJGERFKSMZ-GCJKJVERSA-N 2 0 358.570 4.006 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC001167823891 1086603895 /nfs/dbraw/zinc/60/38/95/1086603895.db2.gz AEJMRYPSSBJNPN-SFHVURJKSA-N 2 0 369.594 4.218 20 0 FIADRP CCCN1Cc2cccc(NC(=O)c3ccc(NC4=[NH+]CCC4)cc3)c2C1 ZINC001143528271 1086623344 /nfs/dbraw/zinc/62/33/44/1086623344.db2.gz LACMTMGXIMVEIE-UHFFFAOYSA-N 2 0 362.477 4.269 20 0 FIADRP CC(C)C1CCC(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)CC1 ZINC000512022123 1086656918 /nfs/dbraw/zinc/65/69/18/1086656918.db2.gz FAHVNLCZFFAEFD-UHFFFAOYSA-N 2 0 358.570 4.195 20 0 FIADRP C[C@H]1C[C@@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000525641288 1086669061 /nfs/dbraw/zinc/66/90/61/1086669061.db2.gz ICHJBCDEXATZJG-HKUYNNGSSA-N 2 0 372.557 4.055 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001167838252 1086712403 /nfs/dbraw/zinc/71/24/03/1086712403.db2.gz SNJPBYITHWHYDQ-XLIONFOSSA-N 2 0 352.950 4.398 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C ZINC001167840006 1086718809 /nfs/dbraw/zinc/71/88/09/1086718809.db2.gz DGITWYTUBMDYIA-FHWLQOOXSA-N 2 0 369.594 4.265 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167841368 1086736397 /nfs/dbraw/zinc/73/63/97/1086736397.db2.gz LMOCSOPUWNDZIS-LADGPHEKSA-N 3 0 371.613 4.485 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432423684 1086745410 /nfs/dbraw/zinc/74/54/10/1086745410.db2.gz ZERYEQPXRABSFO-UHFFFAOYSA-N 2 0 365.359 4.407 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427670397 1086748313 /nfs/dbraw/zinc/74/83/13/1086748313.db2.gz DXOWZCVLJYMPSN-MAUKXSAKSA-N 2 0 369.475 4.435 20 0 FIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432424577 1086748522 /nfs/dbraw/zinc/74/85/22/1086748522.db2.gz PGUFCYTUUKMARB-WIYYLYMNSA-N 2 0 360.542 4.114 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCN2CCCO[C@@H](C)C2)cc1 ZINC000432430011 1086757802 /nfs/dbraw/zinc/75/78/02/1086757802.db2.gz RJRVIGFAGMOSGL-ZWKOTPCHSA-N 2 0 350.572 4.339 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccccc2)c2ccccc2)CCCO1 ZINC000432438713 1086769018 /nfs/dbraw/zinc/76/90/18/1086769018.db2.gz BWWNYPGWLVSIHF-NZQKXSOJSA-N 2 0 352.522 4.061 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCO1 ZINC000657771556 1086798915 /nfs/dbraw/zinc/79/89/15/1086798915.db2.gz CXZHKLKPOZPGPO-FKBYEOEOSA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)Oc1cccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000382383441 1086888557 /nfs/dbraw/zinc/88/85/57/1086888557.db2.gz RYGONTZBJOJNTF-JOCHJYFZSA-N 2 0 352.522 4.476 20 0 FIADRP CCO[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000583660780 1086903075 /nfs/dbraw/zinc/90/30/75/1086903075.db2.gz MDMYYOSXXNQVBZ-WWPVKYPJSA-N 2 0 352.522 4.264 20 0 FIADRP Fc1ccc([C@H]([NH2+]CCC2CC[NH2+]CC2)c2cnc3ccccc3c2)cc1 ZINC000650762880 1086992156 /nfs/dbraw/zinc/99/21/56/1086992156.db2.gz MVGXRDFFYRZIOY-QHCPKHFHSA-N 2 0 363.480 4.443 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000151306928 1087085874 /nfs/dbraw/zinc/08/58/74/1087085874.db2.gz BCHHYGIZZMXVNR-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP Fc1ccccc1-c1ncc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)s1 ZINC000657816543 1087099397 /nfs/dbraw/zinc/09/93/97/1087099397.db2.gz WYZIVWZPLQVTPS-UHFFFAOYSA-N 2 0 359.514 4.161 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)C(C)(C)C(F)F)CC2)cc1 ZINC000657859909 1087410592 /nfs/dbraw/zinc/41/05/92/1087410592.db2.gz YUYJZXHPIVEDSM-HNNXBMFYSA-N 2 0 354.485 4.177 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccc(CN3CCOCC3)cc2)C(C)C)cc1 ZINC000091265913 1087426577 /nfs/dbraw/zinc/42/65/77/1087426577.db2.gz YKQUIUCWYUPDCV-HSZRJFAPSA-N 2 0 368.521 4.014 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(F)cn1 ZINC000092752552 1087447992 /nfs/dbraw/zinc/44/79/92/1087447992.db2.gz XPMYTBULPJKDOZ-MRXNPFEDSA-N 2 0 353.441 4.297 20 0 FIADRP COc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000166115972 1087510622 /nfs/dbraw/zinc/51/06/22/1087510622.db2.gz LKGQCFPLPFUFFG-UHFFFAOYSA-N 2 0 350.506 4.183 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000657886871 1087536204 /nfs/dbraw/zinc/53/62/04/1087536204.db2.gz CEFGKXXSJYCFAW-KCZVDYSFSA-N 2 0 372.597 4.468 20 0 FIADRP CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000685470127 1087578277 /nfs/dbraw/zinc/57/82/77/1087578277.db2.gz ZEYLIQHGSNNQOK-QFIPXVFZSA-N 2 0 353.510 4.139 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000685644943 1087655542 /nfs/dbraw/zinc/65/55/42/1087655542.db2.gz LUGMTANXFGPNBK-XJUOHMSHSA-N 2 0 350.506 4.195 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000685662364 1087668597 /nfs/dbraw/zinc/66/85/97/1087668597.db2.gz FSDWPRMQGKBZJU-FDDCHVKYSA-N 2 0 352.522 4.299 20 0 FIADRP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000658029153 1087698793 /nfs/dbraw/zinc/69/87/93/1087698793.db2.gz HCBPZHAAFRNVDM-IPQPSQTFSA-N 2 0 365.359 4.231 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc2c(c1)CCCC2 ZINC000658069056 1087710920 /nfs/dbraw/zinc/71/09/20/1087710920.db2.gz KLRMETFNJZRNFD-GOSISDBHSA-N 2 0 356.554 4.107 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000658071079 1087711610 /nfs/dbraw/zinc/71/16/10/1087711610.db2.gz SVTBFOCCUWGQSV-SJORKVTESA-N 2 0 364.961 4.313 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(F)c(F)c1 ZINC000658136383 1087725403 /nfs/dbraw/zinc/72/54/03/1087725403.db2.gz GYXYEVUFTKRUHK-UGKGYDQZSA-N 2 0 374.475 4.018 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000658137321 1087742106 /nfs/dbraw/zinc/74/21/06/1087742106.db2.gz GLFMTADMPPNYJJ-SJORKVTESA-N 2 0 364.942 4.209 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1nccc2ccccc21 ZINC000658164874 1087760758 /nfs/dbraw/zinc/76/07/58/1087760758.db2.gz GDNHNTDIPRXPOF-SFHVURJKSA-N 2 0 360.505 4.193 20 0 FIADRP Cc1cccc(CC[C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000658166842 1087761743 /nfs/dbraw/zinc/76/17/43/1087761743.db2.gz PZVKALCQWSMXOH-HXUWFJFHSA-N 2 0 351.538 4.213 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168446 1087765102 /nfs/dbraw/zinc/76/51/02/1087765102.db2.gz XFDNBRYRORZESS-RTBURBONSA-N 2 0 367.537 4.084 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171810 1087766630 /nfs/dbraw/zinc/76/66/30/1087766630.db2.gz KHVKAXRTCASGDH-INIZCTEOSA-N 2 0 372.484 4.158 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(Cl)c1 ZINC000424257742 1087880481 /nfs/dbraw/zinc/88/04/81/1087880481.db2.gz BNZYHWJPEUUBFQ-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]1CC2(C[N@@H+]1Cc1nc(-c3ccccc3Cl)cs1)CC[NH2+]CC2 ZINC000424289666 1087898874 /nfs/dbraw/zinc/89/88/74/1087898874.db2.gz MGIFNTTVDXABLZ-CQSZACIVSA-N 2 0 361.942 4.428 20 0 FIADRP c1csc([C@@H](Cc2ccncc2)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000424325169 1087921820 /nfs/dbraw/zinc/92/18/20/1087921820.db2.gz XFEDKQCHUZCAST-HXUWFJFHSA-N 2 0 355.551 4.424 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C[C@H]3CCCC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424343564 1087953207 /nfs/dbraw/zinc/95/32/07/1087953207.db2.gz FTIAOXXFZRAASJ-ZQGJOIPISA-N 2 0 356.554 4.082 20 0 FIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000580099388 1087953438 /nfs/dbraw/zinc/95/34/38/1087953438.db2.gz CUCREXXOLXNGJS-UHFFFAOYSA-N 2 0 366.958 4.188 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000504896670 1087968811 /nfs/dbraw/zinc/96/88/11/1087968811.db2.gz ZDYQTFLXIBOYHO-XXBNENTESA-N 2 0 363.549 4.081 20 0 FIADRP COc1ccc(-c2nc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cs2)cc1 ZINC000647543579 1088029594 /nfs/dbraw/zinc/02/95/94/1088029594.db2.gz PTJBAYJIPNWBHL-ROUUACIJSA-N 2 0 371.550 4.030 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544252 1088032407 /nfs/dbraw/zinc/03/24/07/1088032407.db2.gz YODNSZYZKYNGFE-VQTJNVASSA-N 2 0 353.485 4.099 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@@H](C[NH3+])c2ccc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000423385590 1088184558 /nfs/dbraw/zinc/18/45/58/1088184558.db2.gz GRUWOCIHMFERQW-KMDXXIMOSA-N 2 0 359.517 4.265 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@@H](C[NH3+])c2ccc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000423385589 1088184703 /nfs/dbraw/zinc/18/47/03/1088184703.db2.gz GRUWOCIHMFERQW-HJOGWXRNSA-N 2 0 359.517 4.265 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414813110 1088229347 /nfs/dbraw/zinc/22/93/47/1088229347.db2.gz LXMVRYZLUXVNNY-HUUCEWRRSA-N 2 0 359.901 4.175 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000472613645 1088236569 /nfs/dbraw/zinc/23/65/69/1088236569.db2.gz SNWJGDXURMQIRM-UHFFFAOYSA-N 2 0 352.526 4.056 20 0 FIADRP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414815882 1088248671 /nfs/dbraw/zinc/24/86/71/1088248671.db2.gz YRPAXRGYEJEHPG-ZDUSSCGKSA-N 2 0 370.447 4.077 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414816757 1088269547 /nfs/dbraw/zinc/26/95/47/1088269547.db2.gz QLOLXIDDCSCIOC-IAGOWNOFSA-N 2 0 353.510 4.337 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)cc1 ZINC000163568689 1088292031 /nfs/dbraw/zinc/29/20/31/1088292031.db2.gz KINHUXCSSAWVDI-NSYGIPOTSA-N 2 0 358.551 4.117 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000513819061 1088416468 /nfs/dbraw/zinc/41/64/68/1088416468.db2.gz PECMLFJWXQHLJM-LJQANCHMSA-N 2 0 352.522 4.335 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)C[C@H]3[NH2+]Cc4ccccc43)cc2)C1 ZINC000659284820 1088421872 /nfs/dbraw/zinc/42/18/72/1088421872.db2.gz HQIDJRNTLLIJSR-VGOFRKELSA-N 2 0 363.505 4.092 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177886085 1088451865 /nfs/dbraw/zinc/45/18/65/1088451865.db2.gz KVUZBGMTVQBHEE-CQSZACIVSA-N 2 0 353.348 4.233 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4F)cc2)C[C@H](C)O1 ZINC000513859851 1088454390 /nfs/dbraw/zinc/45/43/90/1088454390.db2.gz QMBYOWGDEIOFGA-SAHWJRBASA-N 2 0 368.496 4.212 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4F)cc2)C[C@@H](C)O1 ZINC000513859852 1088454859 /nfs/dbraw/zinc/45/48/59/1088454859.db2.gz QMBYOWGDEIOFGA-SEPYTNNBSA-N 2 0 368.496 4.212 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-n3ccnc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000080339110 1088457585 /nfs/dbraw/zinc/45/75/85/1088457585.db2.gz WRFBUUWXMLBGPZ-DENIHFKCSA-N 2 0 360.505 4.015 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCN2CCc3ccccc3C2)c(C)c1OC ZINC000514084829 1088724473 /nfs/dbraw/zinc/72/44/73/1088724473.db2.gz RWMHCVWASUUIMG-SFHVURJKSA-N 2 0 368.521 4.111 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(CC(F)(F)F)s2)c1 ZINC000892698023 1088741330 /nfs/dbraw/zinc/74/13/30/1088741330.db2.gz XPHZSFUPVSGJDI-UHFFFAOYSA-N 2 0 371.472 4.378 20 0 FIADRP CC[NH+](CC)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000514129807 1088775808 /nfs/dbraw/zinc/77/58/08/1088775808.db2.gz BTEARYHEHMXBCS-SFHVURJKSA-N 2 0 353.510 4.321 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc21 ZINC000549145883 1089016030 /nfs/dbraw/zinc/01/60/30/1089016030.db2.gz IBSUDADSQDHTNY-RTBURBONSA-N 2 0 358.526 4.067 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000415029246 1089058967 /nfs/dbraw/zinc/05/89/67/1089058967.db2.gz ZZGCILMFNBAHES-IBGZPJMESA-N 2 0 362.521 4.124 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415032695 1089068730 /nfs/dbraw/zinc/06/87/30/1089068730.db2.gz IDOCVIFOGYUVKS-REWPJTCUSA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Br)c(F)c1)c1ccccc1 ZINC000415044661 1089091787 /nfs/dbraw/zinc/09/17/87/1089091787.db2.gz ATXLDGLGPPJIQD-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000415046867 1089092777 /nfs/dbraw/zinc/09/27/77/1089092777.db2.gz VLDICKKDPIPOLS-SMDDNHRTSA-N 2 0 355.429 4.046 20 0 FIADRP COc1cccc([C@H]([NH2+]C2CCC(C[NH3+])CC2)c2cc(F)ccc2OC)c1 ZINC000415077557 1089127150 /nfs/dbraw/zinc/12/71/50/1089127150.db2.gz FLJMWGFULAIYSD-URWDPPFZSA-N 2 0 372.484 4.039 20 0 FIADRP CC1CC[NH+]([C@H](CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c2cccs2)CC1 ZINC000415089312 1089147153 /nfs/dbraw/zinc/14/71/53/1089147153.db2.gz WDFDOBBLHPIABN-MTQWCTHYSA-N 2 0 361.599 4.031 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)s2)cs1 ZINC000415086612 1089148203 /nfs/dbraw/zinc/14/82/03/1089148203.db2.gz JTWINUMXDXZNEK-BRWVUGGUSA-N 2 0 361.580 4.233 20 0 FIADRP [NH3+]CC1CCC([NH2+]C2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000415088300 1089148735 /nfs/dbraw/zinc/14/87/35/1089148735.db2.gz WGPWYEBBZLNZSS-UHFFFAOYSA-N 2 0 370.368 4.065 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(OCC(F)F)cc2)C1 ZINC000462671721 1089171334 /nfs/dbraw/zinc/17/13/34/1089171334.db2.gz CUUPYACBNZNKDC-IRXDYDNUSA-N 2 0 354.485 4.178 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)c1 ZINC000415117148 1089178809 /nfs/dbraw/zinc/17/88/09/1089178809.db2.gz BTNFINSPIUISRM-UPVQGACJSA-N 2 0 364.533 4.380 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000415120967 1089182614 /nfs/dbraw/zinc/18/26/14/1089182614.db2.gz GWZRKDRRTQUJEA-FPOVZHCZSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](CCCc3c(Cl)cccc3Cl)CC2)C1 ZINC000415120813 1089185045 /nfs/dbraw/zinc/18/50/45/1089185045.db2.gz HBBCEVQHWLLUHT-KXBFYZLASA-N 2 0 371.352 4.144 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](CCCc3c(Cl)cccc3Cl)CC2)C1 ZINC000415120810 1089185394 /nfs/dbraw/zinc/18/53/94/1089185394.db2.gz HBBCEVQHWLLUHT-BEFAXECRSA-N 2 0 371.352 4.144 20 0 FIADRP C[C@@H]1COCC[C@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549236668 1089310291 /nfs/dbraw/zinc/31/02/91/1089310291.db2.gz DBGXKGOQMMKLIC-RMGXSAEISA-N 2 0 362.945 4.269 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435369357 1089579845 /nfs/dbraw/zinc/57/98/45/1089579845.db2.gz DVZUXZMESFZNDK-DOTOQJQBSA-N 2 0 371.912 4.152 20 0 FIADRP c1cc(C[N@H+](Cc2cccc3cccnc32)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000435427315 1089645461 /nfs/dbraw/zinc/64/54/61/1089645461.db2.gz MGWLSWWJQRARJJ-FQEVSTJZSA-N 2 0 363.530 4.441 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCC[C@H]1OCCC(C)C ZINC000435738658 1089917243 /nfs/dbraw/zinc/91/72/43/1089917243.db2.gz CANIDGXUCKKVEY-NHCUHLMSSA-N 2 0 356.514 4.039 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)N1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000415931604 1090002894 /nfs/dbraw/zinc/00/28/94/1090002894.db2.gz MGJNLQSUPYUTCF-UHFFFAOYSA-N 2 0 374.573 4.160 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cccs1 ZINC000163948032 1090284311 /nfs/dbraw/zinc/28/43/11/1090284311.db2.gz RMFMPFYOSOYWII-QGZVFWFLSA-N 2 0 374.550 4.089 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000183178567 1090396592 /nfs/dbraw/zinc/39/65/92/1090396592.db2.gz SZKVKXWUXGHGLI-MRXNPFEDSA-N 2 0 371.481 4.296 20 0 FIADRP C[C@@H](NC[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1nc2ccccc2n1C ZINC000312268565 1090466984 /nfs/dbraw/zinc/46/69/84/1090466984.db2.gz IDNKCCWJQVEJEQ-JPYJTQIMSA-N 2 0 362.521 4.136 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](CCc3ccc4ccccc4c3)CC2)C[C@@H](C)O1 ZINC000511595887 1090611627 /nfs/dbraw/zinc/61/16/27/1090611627.db2.gz TYNIMWVAKYWLMO-WOJBJXKFSA-N 2 0 366.549 4.204 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310969 1090805363 /nfs/dbraw/zinc/80/53/63/1090805363.db2.gz LELUWSLBEXWJAN-FYZZASKESA-N 2 0 354.563 4.394 20 0 FIADRP C[C@@H]([NH2+]CCc1nccn1Cc1ccccc1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323167 1090814596 /nfs/dbraw/zinc/81/45/96/1090814596.db2.gz OBOYMICJOOYNOA-NZSAHSFTSA-N 2 0 351.519 4.317 20 0 FIADRP CC[N@H+](CCCc1cnccc1C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000584806903 1090908553 /nfs/dbraw/zinc/90/85/53/1090908553.db2.gz RUDMXCHYNPJDDW-JOCHJYFZSA-N 2 0 351.538 4.167 20 0 FIADRP CC(C)(C)[C@H](Cn1ccnc1)[NH2+][C@@H]1CCc2ccc(Br)cc21 ZINC000319351120 1091117931 /nfs/dbraw/zinc/11/79/31/1091117931.db2.gz MUBZAYWLCKKPLW-SJORKVTESA-N 2 0 362.315 4.337 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000390685395 1091399182 /nfs/dbraw/zinc/39/91/82/1091399182.db2.gz XPVVBLFSSASETL-XMSQKQJNSA-N 2 0 352.522 4.214 20 0 FIADRP C[NH+](C)Cc1ccc(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)cc1 ZINC000511665201 1091517950 /nfs/dbraw/zinc/51/79/50/1091517950.db2.gz OQXBFJFXSSNSIY-UHFFFAOYSA-N 2 0 365.521 4.029 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(Cl)c1 ZINC000467839156 1091885496 /nfs/dbraw/zinc/88/54/96/1091885496.db2.gz NNEDAKYZWZXXPW-HXUWFJFHSA-N 2 0 372.944 4.118 20 0 FIADRP C[C@H](c1nc2ccccc2o1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512236290 1091944560 /nfs/dbraw/zinc/94/45/60/1091944560.db2.gz GJJOHFLJARPCAI-JPYJTQIMSA-N 2 0 361.489 4.487 20 0 FIADRP COCC[C@H](c1ccccc1)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512237459 1091946515 /nfs/dbraw/zinc/94/65/15/1091946515.db2.gz RJZZTCQVMSMWKO-RPWUZVMVSA-N 2 0 364.533 4.362 20 0 FIADRP CCN1CCC([NH2+][C@H](C)C[C@@H]2CCCCCN2C(=O)OC(C)(C)C)CC1 ZINC000236859609 1092070072 /nfs/dbraw/zinc/07/00/72/1092070072.db2.gz PORMDSNBODFSPR-MJGOQNOKSA-N 2 0 367.578 4.019 20 0 FIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000512382581 1092196721 /nfs/dbraw/zinc/19/67/21/1092196721.db2.gz JZESFIPLEUWIQJ-FRIKZZABSA-N 2 0 350.506 4.467 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012412 1092335266 /nfs/dbraw/zinc/33/52/66/1092335266.db2.gz ZRCKQGVIRGEAFC-IRJINJETSA-N 3 0 365.565 4.279 20 0 FIADRP C[C@H]1CC(NCC[N@H+](C)Cc2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012506 1092340117 /nfs/dbraw/zinc/34/01/17/1092340117.db2.gz BCRBKECNTXGBTO-SFTDATJTSA-N 2 0 365.565 4.150 20 0 FIADRP COc1cc([C@H](C)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000521016648 1092425231 /nfs/dbraw/zinc/42/52/31/1092425231.db2.gz QGBCDIFIFFXLHY-HKUYNNGSSA-N 2 0 371.500 4.182 20 0 FIADRP C[C@H](O)[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1F ZINC000563262847 1092436017 /nfs/dbraw/zinc/43/60/17/1092436017.db2.gz SLQGKXAMXNJTDN-VJNDCXKWSA-N 2 0 370.512 4.280 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)C1 ZINC000237478433 1092500245 /nfs/dbraw/zinc/50/02/45/1092500245.db2.gz ZUJVOWGZHBQOQQ-XMSQKQJNSA-N 2 0 365.521 4.337 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CCC3)cc1 ZINC000665281237 1092597028 /nfs/dbraw/zinc/59/70/28/1092597028.db2.gz YBIHDVZURTZPEI-SJORKVTESA-N 2 0 359.539 4.159 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2CC(C)(C)N(O)C(C)(C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014151 1092684426 /nfs/dbraw/zinc/68/44/26/1092684426.db2.gz KPYDTVPKJVJSLT-OPVJXMOQSA-N 2 0 373.585 4.428 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000549817999 1092843563 /nfs/dbraw/zinc/84/35/63/1092843563.db2.gz KTUNHNHTOCXRII-ILWGZMRPSA-N 2 0 372.553 4.000 20 0 FIADRP C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110430631 1092875311 /nfs/dbraw/zinc/87/53/11/1092875311.db2.gz BBUSTTIOUWKNMR-BBWFWOEESA-N 2 0 350.934 4.222 20 0 FIADRP Fc1ccc(Br)cc1CC[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000521831475 1092933293 /nfs/dbraw/zinc/93/32/93/1092933293.db2.gz WBISLVVLHQNAMB-UHFFFAOYSA-N 2 0 374.257 4.106 20 0 FIADRP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000521830263 1092933448 /nfs/dbraw/zinc/93/34/48/1092933448.db2.gz LVPCIUAKTCYYBK-QFIPXVFZSA-N 2 0 352.522 4.130 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](O)c1ccc(F)cc1 ZINC000245689283 1092948403 /nfs/dbraw/zinc/94/84/03/1092948403.db2.gz KAZHVCUSKIFONH-VXDOVQPVSA-N 2 0 368.496 4.033 20 0 FIADRP CC[C@@H](C)Sc1ccc(NC(=O)CCC[NH+]2CCC([NH3+])CC2)c(C)c1 ZINC000433129293 1093304562 /nfs/dbraw/zinc/30/45/62/1093304562.db2.gz DAQJHLISPGJSIE-MRXNPFEDSA-N 2 0 363.571 4.027 20 0 FIADRP Cc1ncc(CNc2cccc3c2OCC[C@H]3[NH+](C)C)n1-c1ccccc1 ZINC000433190777 1093394190 /nfs/dbraw/zinc/39/41/90/1093394190.db2.gz RRATVTJUEPUMCQ-OAQYLSRUSA-N 2 0 362.477 4.178 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4nc5ccccc5o4)C3)CC2)cc1 ZINC000433188466 1093402590 /nfs/dbraw/zinc/40/25/90/1093402590.db2.gz ABLCTYCQUAIWQA-UHFFFAOYSA-N 2 0 361.489 4.316 20 0 FIADRP C[C@H](Cc1cccc(O)c1)[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168031376 1093623581 /nfs/dbraw/zinc/62/35/81/1093623581.db2.gz YVXHRYACVWMSIA-GUDVDZBRSA-N 2 0 352.522 4.354 20 0 FIADRP C[C@H]1CC([NH2+]Cc2cccc3c2cnn3C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031840 1093655667 /nfs/dbraw/zinc/65/56/67/1093655667.db2.gz CPOCSKFDUXWLLJ-ROUUACIJSA-N 2 0 362.521 4.105 20 0 FIADRP C[C@H]1CC([NH2+]CC2(Cc3cccnc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168033282 1093709525 /nfs/dbraw/zinc/70/95/25/1093709525.db2.gz KPUCSGJZRUSSFX-PMACEKPBSA-N 2 0 363.549 4.436 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4cc(F)ccc34)CC2)C1 ZINC000513063212 1093711338 /nfs/dbraw/zinc/71/13/38/1093711338.db2.gz GZKQPBIUSDOQPF-UZLBHIALSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4cc(F)ccc34)CC2)C1 ZINC000513063207 1093711714 /nfs/dbraw/zinc/71/17/14/1093711714.db2.gz GZKQPBIUSDOQPF-JXFKEZNVSA-N 2 0 357.517 4.482 20 0 FIADRP CC(C)C[NH+]1CCC(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168033362 1093713844 /nfs/dbraw/zinc/71/38/44/1093713844.db2.gz KQRIPTMDPSTZTB-SFTDATJTSA-N 3 0 371.613 4.386 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168033626 1093722797 /nfs/dbraw/zinc/72/27/97/1093722797.db2.gz MVKWEJVRTFTAJF-JHDGKUDLSA-N 3 0 369.597 4.282 20 0 FIADRP CC(C)[C@@H](C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1 ZINC000474473068 1093818502 /nfs/dbraw/zinc/81/85/02/1093818502.db2.gz JFDBCNZFFDQJTR-XMMPIXPASA-N 2 0 366.549 4.173 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000474480203 1093825921 /nfs/dbraw/zinc/82/59/21/1093825921.db2.gz ZOMDBWKNXGJTCK-IPMKNSEASA-N 2 0 362.558 4.440 20 0 FIADRP CC(C)n1nccc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000474482983 1093830182 /nfs/dbraw/zinc/83/01/82/1093830182.db2.gz QXDNDPXRPIACET-UHFFFAOYSA-N 2 0 362.521 4.482 20 0 FIADRP C[N@H+](CCOc1ccc(Oc2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513160456 1093942754 /nfs/dbraw/zinc/94/27/54/1093942754.db2.gz PFIZFEQBESPFKJ-YOFSQIOKSA-N 2 0 366.505 4.415 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(F)cc23)CC1 ZINC000513231520 1094014248 /nfs/dbraw/zinc/01/42/48/1094014248.db2.gz DUWYDKRHUQFABQ-AOMKIAJQSA-N 2 0 357.517 4.482 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)cc1 ZINC000430011588 1094028393 /nfs/dbraw/zinc/02/83/93/1094028393.db2.gz HGBYZTWHECIKBL-UHFFFAOYSA-N 2 0 358.913 4.480 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1 ZINC000513343166 1094076004 /nfs/dbraw/zinc/07/60/04/1094076004.db2.gz NIHMSUVTOVQTQV-HXUWFJFHSA-N 2 0 360.448 4.072 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)c1 ZINC000513364821 1094081196 /nfs/dbraw/zinc/08/11/96/1094081196.db2.gz JMMNRTYYVWTDEL-QHCPKHFHSA-N 2 0 360.505 4.002 20 0 FIADRP O=c1oc2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)cc2o1 ZINC001648951621 1094106402 /nfs/dbraw/zinc/10/64/02/1094106402.db2.gz ZTMWXNHNUXZNBK-UHFFFAOYSA-N 2 0 366.461 4.052 20 0 FIADRP Cc1ccn2c(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cnc2c1 ZINC000513494347 1094162102 /nfs/dbraw/zinc/16/21/02/1094162102.db2.gz HONRAUYGRIUZEU-PZJWPPBQSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513487302 1094165865 /nfs/dbraw/zinc/16/58/65/1094165865.db2.gz BAHDJNXHDOFFOR-GHTZIAJQSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474598665 1094394351 /nfs/dbraw/zinc/39/43/51/1094394351.db2.gz JMFPOSFWRJXFDQ-BPKGMFCQSA-N 2 0 370.990 4.373 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@@H]2CCCc2ccccc2)CC1 ZINC000501024322 1094441911 /nfs/dbraw/zinc/44/19/11/1094441911.db2.gz PEZANWNVCGDRQG-XMMPIXPASA-N 2 0 371.613 4.280 20 0 FIADRP CCC(CC)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1cccs1 ZINC000501028771 1094446106 /nfs/dbraw/zinc/44/61/06/1094446106.db2.gz JTIDVOZOBGWJAI-HXUWFJFHSA-N 2 0 351.604 4.231 20 0 FIADRP C[N@H+](CCSc1ccc(F)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501046156 1094452813 /nfs/dbraw/zinc/45/28/13/1094452813.db2.gz OTJKHHUKZLNIDS-UHFFFAOYSA-N 2 0 359.514 4.161 20 0 FIADRP C[N@@H+](Cc1cccc(C(F)(F)F)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501075146 1094494358 /nfs/dbraw/zinc/49/43/58/1094494358.db2.gz DGNMZKGULXTCHI-UHFFFAOYSA-N 2 0 363.427 4.449 20 0 FIADRP CC1(C)CC([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC(C)(C)[NH2+]1 ZINC000102665593 1094629835 /nfs/dbraw/zinc/62/98/35/1094629835.db2.gz FTZPSORIYWSCJC-UHFFFAOYSA-N 2 0 363.977 4.203 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](F)C(F)(F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041854 1094635187 /nfs/dbraw/zinc/63/51/87/1094635187.db2.gz WMYXXUDTHZCIJV-UKBAYJJMSA-N 2 0 354.460 4.497 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000501390333 1094674978 /nfs/dbraw/zinc/67/49/78/1094674978.db2.gz VRJYTFNWOFCKMZ-AKFKNWHVSA-N 2 0 363.549 4.262 20 0 FIADRP C[N@@H+](Cc1cn(Cc2ccccc2)nc1C(C)(C)C)CC1CC[NH+](C)CC1 ZINC000513717001 1094791243 /nfs/dbraw/zinc/79/12/43/1094791243.db2.gz KYGSNYQXTDAADU-UHFFFAOYSA-N 2 0 368.569 4.003 20 0 FIADRP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420316158 1094880129 /nfs/dbraw/zinc/88/01/29/1094880129.db2.gz XZETYZARHDLIOK-OXXUSNJHSA-N 2 0 359.901 4.424 20 0 FIADRP Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)nn1 ZINC000414452265 1094897094 /nfs/dbraw/zinc/89/70/94/1094897094.db2.gz PEKHNDOIFIVHRX-DTHFOOOUSA-N 2 0 370.928 4.142 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420373854 1094903371 /nfs/dbraw/zinc/90/33/71/1094903371.db2.gz GWYSQXIJHQUSCL-NXOUGTEYSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420394249 1094911073 /nfs/dbraw/zinc/91/10/73/1094911073.db2.gz RNBKUGOAESANCE-MRAWALMUSA-N 2 0 357.325 4.273 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[N@H+](C)[C@H](C)c2sc(C(C)C)nc2C)cc1 ZINC000420376670 1094913159 /nfs/dbraw/zinc/91/31/59/1094913159.db2.gz QYENFPPUXNTWMA-WBVHZDCISA-N 2 0 361.555 4.319 20 0 FIADRP Cc1cc(Cl)ccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501787504 1094924188 /nfs/dbraw/zinc/92/41/88/1094924188.db2.gz YGQVNJXAGKFYSO-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP Cc1cc(Cl)ccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501787505 1094924793 /nfs/dbraw/zinc/92/47/93/1094924793.db2.gz YGQVNJXAGKFYSO-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)[C@@H](C)[C@H]([NH3+])c3ccccc3)c2C1 ZINC000166934713 1095012641 /nfs/dbraw/zinc/01/26/41/1095012641.db2.gz CVNRQIWVVXFVMA-JTSKRJEESA-N 2 0 365.521 4.323 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2C[NH2+]CC)cc1 ZINC000428314338 1095228578 /nfs/dbraw/zinc/22/85/78/1095228578.db2.gz ZVNFHRGQWCWHOT-UHFFFAOYSA-N 2 0 353.510 4.280 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000502453301 1095474048 /nfs/dbraw/zinc/47/40/48/1095474048.db2.gz PCLOEDOWMSGZCC-AVRDEDQJSA-N 2 0 356.510 4.206 20 0 FIADRP CCN1CCC[C@@H](C[N@H+](C)Cc2cccc(C3CC3)c2)[C@@H]1c1cnn(C)c1 ZINC000421347466 1095542086 /nfs/dbraw/zinc/54/20/86/1095542086.db2.gz VDKNKGFWKSSJNT-JTHBVZDNSA-N 2 0 366.553 4.203 20 0 FIADRP C[NH+](C)C1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000421376609 1095574716 /nfs/dbraw/zinc/57/47/16/1095574716.db2.gz RQYOKCAISXGUKH-UHFFFAOYSA-N 2 0 351.332 4.158 20 0 FIADRP COc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)c(-c2ccccc2)cc1OC ZINC000421376983 1095576491 /nfs/dbraw/zinc/57/64/91/1095576491.db2.gz SKGFSHRMOIOCDP-UHFFFAOYSA-N 2 0 368.521 4.333 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]C[C@H]4CC45CCSCC5)[C@@H]3C2)cc1 ZINC000421384110 1095586552 /nfs/dbraw/zinc/58/65/52/1095586552.db2.gz OWHBYWHNGQTVFA-BQJUDKOJSA-N 2 0 356.579 4.020 20 0 FIADRP C[C@H]1CC(N2CC[NH+](CC3CCCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053025 1095921118 /nfs/dbraw/zinc/92/11/18/1095921118.db2.gz LXDCLIPMIGPARO-SFTDATJTSA-N 2 0 369.597 4.236 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccncc1Cl ZINC000421836135 1095945642 /nfs/dbraw/zinc/94/56/42/1095945642.db2.gz NYCILTMERUIALD-QGZVFWFLSA-N 2 0 373.928 4.103 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000502969977 1095991001 /nfs/dbraw/zinc/99/10/01/1095991001.db2.gz NHIOYZKRXQZKKP-NRFANRHFSA-N 2 0 365.606 4.003 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CCC[NH+]2CCC(C)CC2)cc1 ZINC000513761019 1095994543 /nfs/dbraw/zinc/99/45/43/1095994543.db2.gz LMTMBVLHXXWVJE-HSZRJFAPSA-N 2 0 367.537 4.086 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C(C)(C)c1ccccc1 ZINC000422703572 1096457798 /nfs/dbraw/zinc/45/77/98/1096457798.db2.gz IDIWDYDPHABNNX-WGGBDISSSA-N 2 0 350.506 4.198 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](COc1ccccc1F)C(C)(C)C ZINC000422710988 1096460097 /nfs/dbraw/zinc/46/00/97/1096460097.db2.gz METPSSDPVMCIBD-YWZLYKJASA-N 2 0 359.489 4.132 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)CCCC1 ZINC000422730097 1096464235 /nfs/dbraw/zinc/46/42/35/1096464235.db2.gz DDJJZWMACDTNNL-INIZCTEOSA-N 2 0 353.510 4.020 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC000503562797 1096465463 /nfs/dbraw/zinc/46/54/63/1096465463.db2.gz NMTCOZNTFCPWRE-HDICACEKSA-N 2 0 358.482 4.051 20 0 FIADRP Cc1ccc(C[C@@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c2ccccn2)cc1 ZINC000422742741 1096478411 /nfs/dbraw/zinc/47/84/11/1096478411.db2.gz HAFDMQWEJAXGSK-WZONZLPQSA-N 2 0 360.505 4.187 20 0 FIADRP CC(C)COc1ccccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422745014 1096479355 /nfs/dbraw/zinc/47/93/55/1096479355.db2.gz XAMQHATXHGSVHP-OFNKIYASSA-N 2 0 366.505 4.067 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)Sc1ccccc1 ZINC000422778585 1096488731 /nfs/dbraw/zinc/48/87/31/1096488731.db2.gz ATOJOKGQAKETBY-LKUPVBHCSA-N 2 0 354.519 4.013 20 0 FIADRP CC[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1F ZINC000422762271 1096490939 /nfs/dbraw/zinc/49/09/39/1096490939.db2.gz MMFXIRYJIDTNLL-ZVDOUQERSA-N 2 0 358.432 4.261 20 0 FIADRP COc1ccc2cc(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422799493 1096493205 /nfs/dbraw/zinc/49/32/05/1096493205.db2.gz XAGDRFOHBXONAE-LADGPHEKSA-N 2 0 374.484 4.194 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000422796281 1096493676 /nfs/dbraw/zinc/49/36/76/1096493676.db2.gz YBGHFIGGZZJXGQ-DJJJIMSYSA-N 2 0 350.478 4.493 20 0 FIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422840921 1096503029 /nfs/dbraw/zinc/50/30/29/1096503029.db2.gz CIOIEOLNEXVBLE-BBTUJRGHSA-N 2 0 370.493 4.208 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c(OC2CCCC2)c1 ZINC000422819458 1096503484 /nfs/dbraw/zinc/50/34/84/1096503484.db2.gz IIHWFNRRCVDDCF-HNNXBMFYSA-N 2 0 369.509 4.030 20 0 FIADRP COc1ccc(-c2csc(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)c2)cc1 ZINC000422818031 1096503854 /nfs/dbraw/zinc/50/38/54/1096503854.db2.gz FHRAPUKSTTWZEE-AWEZNQCLSA-N 2 0 367.518 4.437 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422857049 1096505560 /nfs/dbraw/zinc/50/55/60/1096505560.db2.gz GNKPNHGWLPPVTQ-BHIFYINESA-N 2 0 366.505 4.034 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@H](Cc2ccccc2)[C@@H](C)[NH3+])C1 ZINC000422878252 1096510023 /nfs/dbraw/zinc/51/00/23/1096510023.db2.gz JVBNQGNJZOOVCT-YFVAEKQCSA-N 2 0 371.956 4.023 20 0 FIADRP [NH3+]CC1CCC([NH2+]Cc2cc(Cl)cc(Cl)c2OC(F)F)CC1 ZINC000422877818 1096510392 /nfs/dbraw/zinc/51/03/92/1096510392.db2.gz RVLDMKVFQSENCD-UHFFFAOYSA-N 2 0 353.240 4.202 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000422879569 1096511034 /nfs/dbraw/zinc/51/10/34/1096511034.db2.gz MOZCNRSVMCZAIJ-GMVOTWDCSA-N 2 0 360.860 4.386 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422897364 1096518678 /nfs/dbraw/zinc/51/86/78/1096518678.db2.gz ZTGMLPXVTALCOD-FYYLOGMGSA-N 2 0 366.505 4.211 20 0 FIADRP c1c2ccccc2sc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422902784 1096520316 /nfs/dbraw/zinc/52/03/16/1096520316.db2.gz NOYUNSWYBKUXSW-GHTZIAJQSA-N 2 0 350.487 4.247 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 ZINC000422938195 1096530424 /nfs/dbraw/zinc/53/04/24/1096530424.db2.gz GVSDTUOVZVXIBR-UXHICEINSA-N 2 0 356.897 4.123 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000422937848 1096530701 /nfs/dbraw/zinc/53/07/01/1096530701.db2.gz CWKXBQQUCMNSHL-CTWPCTMYSA-N 2 0 359.311 4.398 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@H]1CCCC[C@@H]1C[NH3+])C1CCCCC1 ZINC000414705575 1096531219 /nfs/dbraw/zinc/53/12/19/1096531219.db2.gz FMYAAWYPQQDCNF-XLIONFOSSA-N 2 0 372.557 4.090 20 0 FIADRP Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422964023 1096533369 /nfs/dbraw/zinc/53/33/69/1096533369.db2.gz KFWICMMXLXQLOH-XPWALMASSA-N 2 0 366.553 4.014 20 0 FIADRP CC[C@H](C)C(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422945757 1096535560 /nfs/dbraw/zinc/53/55/60/1096535560.db2.gz NTZAARMZJUWGAE-LLUDDFSJSA-N 2 0 357.542 4.072 20 0 FIADRP c1ccc(Sc2ccc(C[NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)cc2)cc1 ZINC000423001716 1096547116 /nfs/dbraw/zinc/54/71/16/1096547116.db2.gz XNXMKDUORYIMNP-BHDDXSALSA-N 2 0 368.546 4.085 20 0 FIADRP CC(C)(C)c1ccc(C(C)(C)C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000423015078 1096550636 /nfs/dbraw/zinc/55/06/36/1096550636.db2.gz QJOCFGHMXFSVLR-PCCBWWKXSA-N 2 0 358.570 4.008 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCOCc1ccc(Cl)cc1Cl ZINC000423025356 1096554092 /nfs/dbraw/zinc/55/40/92/1096554092.db2.gz LLDICOAHAOKZDL-LBPRGKRZSA-N 2 0 368.308 4.023 20 0 FIADRP c1ccc(COCCC2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000423052835 1096565045 /nfs/dbraw/zinc/56/50/45/1096565045.db2.gz QOLZEYAXYWTQNX-BHIFYINESA-N 2 0 356.554 4.274 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)ccn1 ZINC000423085747 1096570030 /nfs/dbraw/zinc/57/00/30/1096570030.db2.gz KMKUZNLDOFZNJA-DFQSSKMNSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423092004 1096572028 /nfs/dbraw/zinc/57/20/28/1096572028.db2.gz ACUYERBTVRUBHS-LYKNXKPOSA-N 2 0 370.443 4.056 20 0 FIADRP CCc1nc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)ccc2n1C1CC1 ZINC000423116902 1096577565 /nfs/dbraw/zinc/57/75/65/1096577565.db2.gz RZTQGTVLSKMCAV-HSALFYBXSA-N 2 0 366.553 4.334 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423119773 1096578756 /nfs/dbraw/zinc/57/87/56/1096578756.db2.gz DQXBFCXEIGBPNF-MMPTUQATSA-N 2 0 350.304 4.023 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@H]1CCC[NH2+]CC1 ZINC000423127446 1096579818 /nfs/dbraw/zinc/57/98/18/1096579818.db2.gz TWHTVTHMGLPUEO-SUMWQHHRSA-N 2 0 362.315 4.040 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000423127443 1096580359 /nfs/dbraw/zinc/58/03/59/1096580359.db2.gz TWHTVTHMGLPUEO-CXAGYDPISA-N 2 0 362.315 4.040 20 0 FIADRP CCSc1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423129458 1096580967 /nfs/dbraw/zinc/58/09/67/1096580967.db2.gz LXLUFLNCBZEPBL-PZJWPPBQSA-N 2 0 354.519 4.144 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423129809 1096581502 /nfs/dbraw/zinc/58/15/02/1096581502.db2.gz MIZCHZCUZFBLKG-SESVDKBCSA-N 2 0 358.913 4.315 20 0 FIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106549 1096582353 /nfs/dbraw/zinc/58/23/53/1096582353.db2.gz ZZOXYBCMXJEUHV-QBTZDCLLSA-N 2 0 366.480 4.307 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000423106762 1096583186 /nfs/dbraw/zinc/58/31/86/1096583186.db2.gz PDHJPNQYIRSOTI-BVGQSLNGSA-N 2 0 366.347 4.196 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1F ZINC000423109747 1096584378 /nfs/dbraw/zinc/58/43/78/1096584378.db2.gz OFQMBGSCGDXUCI-PWSUYJOCSA-N 2 0 366.278 4.162 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112054 1096586139 /nfs/dbraw/zinc/58/61/39/1096586139.db2.gz XGZVPQVDHFNTRE-ZRCAFCQKSA-N 2 0 354.519 4.315 20 0 FIADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000423139603 1096593956 /nfs/dbraw/zinc/59/39/56/1096593956.db2.gz VTTKPOCNUMJVPX-ZYSHUDEJSA-N 2 0 350.428 4.271 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cccc(Br)c1Cl ZINC000423168431 1096599493 /nfs/dbraw/zinc/59/94/93/1096599493.db2.gz HKDCKUVJDVHIAM-SNVBAGLBSA-N 2 0 368.706 4.115 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000503950146 1096609664 /nfs/dbraw/zinc/60/96/64/1096609664.db2.gz SSNRVKSDAMDVOU-OUUBHVDSSA-N 2 0 364.480 4.322 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000503954068 1096612333 /nfs/dbraw/zinc/61/23/33/1096612333.db2.gz TUHVYMXQJXXBCE-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]CC[C@@H]2CC[NH2+]C2)nc1 ZINC000423248304 1096628519 /nfs/dbraw/zinc/62/85/19/1096628519.db2.gz MYHQEIKEZPPHDP-SIKLNZKXSA-N 2 0 371.956 4.040 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423248780 1096629616 /nfs/dbraw/zinc/62/96/16/1096629616.db2.gz NUOXRKWHDNFYNP-BEFAXECRSA-N 2 0 359.311 4.128 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423255548 1096631858 /nfs/dbraw/zinc/63/18/58/1096631858.db2.gz CHCJNQZOLGRYKC-PBHICJAKSA-N 2 0 359.514 4.306 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NCC(C)(C)[NH3+] ZINC000423286334 1096634909 /nfs/dbraw/zinc/63/49/09/1096634909.db2.gz GPOSEOANDWTMGE-SNVBAGLBSA-N 2 0 368.344 4.269 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000423291463 1096636198 /nfs/dbraw/zinc/63/61/98/1096636198.db2.gz IJMKEVKONNHEMH-DIFFPNOSSA-N 2 0 363.274 4.385 20 0 FIADRP CC1(C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC[NH2+]CC1 ZINC000423317070 1096642209 /nfs/dbraw/zinc/64/22/09/1096642209.db2.gz BJSYWOMAGABQCR-QFIPXVFZSA-N 2 0 363.480 4.443 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000423296226 1096644386 /nfs/dbraw/zinc/64/43/86/1096644386.db2.gz YPKWEABVQDPWPI-XIKOKIGWSA-N 2 0 350.384 4.382 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000423296224 1096644729 /nfs/dbraw/zinc/64/47/29/1096644729.db2.gz YPKWEABVQDPWPI-SGTLLEGYSA-N 2 0 350.384 4.382 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000423326202 1096647360 /nfs/dbraw/zinc/64/73/60/1096647360.db2.gz LXOQWKXCMXPTHH-CQSZACIVSA-N 2 0 365.237 4.248 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc(F)c(F)c2)c1 ZINC000423350393 1096652960 /nfs/dbraw/zinc/65/29/60/1096652960.db2.gz ZGDDPSRNZJQOFZ-HXUWFJFHSA-N 2 0 360.473 4.285 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2ccc(Br)cc2)CC[NH2+]1 ZINC000423387054 1096662862 /nfs/dbraw/zinc/66/28/62/1096662862.db2.gz SIIVUUVNWHAGQX-CCKFTAQKSA-N 2 0 359.311 4.269 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)sc1Br ZINC000423401218 1096664129 /nfs/dbraw/zinc/66/41/29/1096664129.db2.gz VWUYGPSNLPTDJB-NSHDSACASA-N 2 0 351.313 4.273 20 0 FIADRP Brc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423398135 1096667616 /nfs/dbraw/zinc/66/76/16/1096667616.db2.gz TZHIJWNHBAHMOD-IBGZPJMESA-N 2 0 357.295 4.293 20 0 FIADRP COCCC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423459926 1096689334 /nfs/dbraw/zinc/68/93/34/1096689334.db2.gz AJROLRBQIQFMEL-WBAXXEDZSA-N 2 0 369.347 4.024 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1nccc2ccccc21 ZINC000423463998 1096691780 /nfs/dbraw/zinc/69/17/80/1096691780.db2.gz GHPBYFBZHRVICO-NBHGPNQESA-N 2 0 363.480 4.418 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccc(OC)cc2)cc1 ZINC000423471273 1096694113 /nfs/dbraw/zinc/69/41/13/1096694113.db2.gz DXWUSYAMGXWNNR-NZQKXSOJSA-N 2 0 368.521 4.109 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000423475047 1096696060 /nfs/dbraw/zinc/69/60/60/1096696060.db2.gz PSCKDMLQYJBKRQ-QBIMZIAESA-N 2 0 363.299 4.239 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423480482 1096698054 /nfs/dbraw/zinc/69/80/54/1096698054.db2.gz NIXIPJJVEGICRN-WMZOPIPTSA-N 2 0 371.550 4.318 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(Br)cc1C(F)(F)F ZINC000423504889 1096701211 /nfs/dbraw/zinc/70/12/11/1096701211.db2.gz LIMHGLPOKWKTST-HOSYDEDBSA-N 2 0 365.237 4.246 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2ccc(F)cc2)CC1 ZINC000423503289 1096701445 /nfs/dbraw/zinc/70/14/45/1096701445.db2.gz KJANFJMGLXOBAL-NYVOZVTQSA-N 3 0 361.549 4.096 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000423482053 1096703047 /nfs/dbraw/zinc/70/30/47/1096703047.db2.gz XONFIEMTHBGHFO-VMXDCPSBSA-N 2 0 370.512 4.309 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1F ZINC000423483781 1096703497 /nfs/dbraw/zinc/70/34/97/1096703497.db2.gz ZOIKYQYEGODDEH-UCLAIMLFSA-N 2 0 360.448 4.017 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCC[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000423487400 1096704492 /nfs/dbraw/zinc/70/44/92/1096704492.db2.gz UGQFXSQPIQXQLS-RHSMWYFYSA-N 2 0 359.539 4.310 20 0 FIADRP CCc1ccccc1[C@@H]([NH3+])CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423495041 1096707589 /nfs/dbraw/zinc/70/75/89/1096707589.db2.gz BLIWTZSOCJKAGQ-YCSHWKNNSA-N 2 0 363.549 4.034 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000423496282 1096707942 /nfs/dbraw/zinc/70/79/42/1096707942.db2.gz GKCGSLBYHBVKSY-ZMYBRWDISA-N 2 0 359.311 4.256 20 0 FIADRP [NH3+]C1(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C2CC3CC(C2)CC1C3 ZINC000423530375 1096708746 /nfs/dbraw/zinc/70/87/46/1096708746.db2.gz RHIRQZLREOUVQO-KUEIPULJSA-N 2 0 372.528 4.037 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000423511991 1096710277 /nfs/dbraw/zinc/71/02/77/1096710277.db2.gz QJQYLSUFICGZHC-RISOHXOYSA-N 2 0 362.489 4.493 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000423512693 1096710314 /nfs/dbraw/zinc/71/03/14/1096710314.db2.gz QXKNVZXHDCELGM-AKWBHNSASA-N 2 0 357.723 4.271 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423516557 1096711282 /nfs/dbraw/zinc/71/12/82/1096711282.db2.gz YCDZXKSQPFEMGU-DYESRHJHSA-N 2 0 368.525 4.347 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423521800 1096712357 /nfs/dbraw/zinc/71/23/57/1096712357.db2.gz TZGRNPBMPDPBKY-OXJNMPFZSA-N 2 0 356.510 4.013 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCC3=CC[NH2+]CC3)s2)cc1 ZINC000423535376 1096715750 /nfs/dbraw/zinc/71/57/50/1096715750.db2.gz CVONVCPQEUOTFV-CQSZACIVSA-N 2 0 357.523 4.088 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423536470 1096715779 /nfs/dbraw/zinc/71/57/79/1096715779.db2.gz AIDUUHCDPPXTBB-RWYOIZDWSA-N 2 0 369.734 4.068 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2ccccc2)cc1 ZINC000423537610 1096715791 /nfs/dbraw/zinc/71/57/91/1096715791.db2.gz DICCHEUBKUMZOB-ANTGDGSKSA-N 2 0 372.459 4.355 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423539357 1096716234 /nfs/dbraw/zinc/71/62/34/1096716234.db2.gz IEFBDQWZFCOHHH-VRXWPRPYSA-N 2 0 350.506 4.401 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CCC1=CC[NH2+]CC1)CCC2 ZINC000423540539 1096716388 /nfs/dbraw/zinc/71/63/88/1096716388.db2.gz QQFXKQAJMTWYDQ-KRWDZBQOSA-N 2 0 357.498 4.226 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000423548998 1096719105 /nfs/dbraw/zinc/71/91/05/1096719105.db2.gz RPLQZWWRUCQGFW-YRWGSWDYSA-N 2 0 367.306 4.017 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000423548997 1096719459 /nfs/dbraw/zinc/71/94/59/1096719459.db2.gz RPLQZWWRUCQGFW-HOPMXRPOSA-N 2 0 367.306 4.017 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCOC4(CCCC4)C2)C3)cc1 ZINC000245743282 1098708168 /nfs/dbraw/zinc/70/81/68/1098708168.db2.gz RYRZWWPQBCZTIA-KJJMTIBFSA-N 2 0 354.538 4.263 20 0 FIADRP CCC1(C[NH2+]Cc2cnn3ccccc23)CC[NH+](Cc2ccccc2)CC1 ZINC000533124588 1098806286 /nfs/dbraw/zinc/80/62/86/1098806286.db2.gz URIGIKATPJPJFG-UHFFFAOYSA-N 2 0 362.521 4.116 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000436233565 1098856457 /nfs/dbraw/zinc/85/64/57/1098856457.db2.gz TVTLEZASLNVVED-FCHUYYIVSA-N 2 0 352.522 4.095 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C1 ZINC000436292355 1098907851 /nfs/dbraw/zinc/90/78/51/1098907851.db2.gz NACOURMXBPEFQM-PGRDOPGGSA-N 2 0 356.554 4.181 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436298708 1098911043 /nfs/dbraw/zinc/91/10/43/1098911043.db2.gz HGHGBTOWCPVVTK-LRQRDZAKSA-N 2 0 356.485 4.363 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436301834 1098915675 /nfs/dbraw/zinc/91/56/75/1098915675.db2.gz OTIHAPJGTIOWBH-KKSFZXQISA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000515846352 1098978711 /nfs/dbraw/zinc/97/87/11/1098978711.db2.gz VUSQXTJGJACWER-UZLBHIALSA-N 2 0 372.484 4.083 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000533391190 1099019044 /nfs/dbraw/zinc/01/90/44/1099019044.db2.gz NZYRMUWUHAFNMC-UHFFFAOYSA-N 2 0 374.960 4.353 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001211994318 1099158959 /nfs/dbraw/zinc/15/89/59/1099158959.db2.gz SROCZQHMKGAANI-UHFFFAOYSA-N 2 0 366.553 4.414 20 0 FIADRP CCC1(C[NH2+]Cc2cnn(C(C)(C)C)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000533583673 1099197399 /nfs/dbraw/zinc/19/73/99/1099197399.db2.gz ICUWWIMYASKEOA-UHFFFAOYSA-N 2 0 368.569 4.420 20 0 FIADRP CC[N@H+](Cc1ccccc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000505859256 1099201726 /nfs/dbraw/zinc/20/17/26/1099201726.db2.gz SKASMRJRONTCFL-UHFFFAOYSA-N 2 0 351.538 4.239 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000248744164 1099408545 /nfs/dbraw/zinc/40/85/45/1099408545.db2.gz ANYYVFYLBKDTOO-GEALJGNFSA-N 2 0 355.551 4.340 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000248744170 1099408605 /nfs/dbraw/zinc/40/86/05/1099408605.db2.gz ANYYVFYLBKDTOO-XLNTUCKNSA-N 2 0 355.551 4.340 20 0 FIADRP c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000161938086 1099548172 /nfs/dbraw/zinc/54/81/72/1099548172.db2.gz DCMPOXYECWVJQA-FQEVSTJZSA-N 2 0 356.535 4.390 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2ccc(OC)cc2)CC1 ZINC000516501593 1099549390 /nfs/dbraw/zinc/54/93/90/1099549390.db2.gz ZGFJLLWGXCXYJO-JOCHJYFZSA-N 2 0 356.485 4.245 20 0 FIADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000414898247 1099595478 /nfs/dbraw/zinc/59/54/78/1099595478.db2.gz SNIANOYWUHPLNF-GFCCVEGCSA-N 2 0 366.292 4.073 20 0 FIADRP C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000079492319 1099757736 /nfs/dbraw/zinc/75/77/36/1099757736.db2.gz ZPSUGKQKTDOHDH-AWEZNQCLSA-N 2 0 362.905 4.115 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1Cl ZINC000076761481 1099815903 /nfs/dbraw/zinc/81/59/03/1099815903.db2.gz DGOBLDRZFBKYSS-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1cccc(F)c1 ZINC000508702106 1099856232 /nfs/dbraw/zinc/85/62/32/1099856232.db2.gz YNXRTPFAKIXUMC-QWFCFKBJSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702685 1099858039 /nfs/dbraw/zinc/85/80/39/1099858039.db2.gz WHKNJEUQZNNMDK-WIYYLYMNSA-N 2 0 367.537 4.259 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000508714824 1099884536 /nfs/dbraw/zinc/88/45/36/1099884536.db2.gz CAAKPCUOZVVPQH-PTUXOGIPSA-N 2 0 351.538 4.321 20 0 FIADRP C[C@@H](Nc1ccc(CC[NH+](C)C)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715202 1099884980 /nfs/dbraw/zinc/88/49/80/1099884980.db2.gz XGUFJMUWVPPYFR-DENIHFKCSA-N 2 0 351.538 4.113 20 0 FIADRP COc1ccc(CCC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711294 1099900917 /nfs/dbraw/zinc/90/09/17/1099900917.db2.gz AIUARZHYIXHIRP-KNQAVFIVSA-N 2 0 352.522 4.128 20 0 FIADRP COc1ccc(CCC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711297 1099901073 /nfs/dbraw/zinc/90/10/73/1099901073.db2.gz AIUARZHYIXHIRP-SIKLNZKXSA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2ccccc21 ZINC000516890982 1099912908 /nfs/dbraw/zinc/91/29/08/1099912908.db2.gz YGKHHFYYAWEJHJ-YADHBBJMSA-N 2 0 367.537 4.386 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000516999378 1099986189 /nfs/dbraw/zinc/98/61/89/1099986189.db2.gz PSDXNSRXQTURFU-XMMPIXPASA-N 2 0 364.533 4.443 20 0 FIADRP CC1(C)C[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccc(F)cc2O1 ZINC000459435190 1100147396 /nfs/dbraw/zinc/14/73/96/1100147396.db2.gz OTQHBYIFXPOFAC-LJQANCHMSA-N 2 0 355.457 4.082 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1CN(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536672219 1100155698 /nfs/dbraw/zinc/15/56/98/1100155698.db2.gz OPWLQBANNBBACN-OAQYLSRUSA-N 2 0 368.569 4.209 20 0 FIADRP Cc1ccc([C@H]2OCCC[C@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459431902 1100168055 /nfs/dbraw/zinc/16/80/55/1100168055.db2.gz ZBZYIUHDSAPVQQ-NZQKXSOJSA-N 2 0 365.521 4.116 20 0 FIADRP c1ccc2c(c1)CCC[C@H]2OCCC[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459450587 1100186731 /nfs/dbraw/zinc/18/67/31/1100186731.db2.gz WEGIFWGMEFSWMM-HSZRJFAPSA-N 2 0 365.521 4.124 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000379628416 1100244890 /nfs/dbraw/zinc/24/48/90/1100244890.db2.gz IXHGKJJKKQZJSB-XQBPLPMBSA-N 2 0 352.522 4.356 20 0 FIADRP Cn1nccc1[C@H]1CCC[C@@H]([NH2+]CC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000517278541 1100253328 /nfs/dbraw/zinc/25/33/28/1100253328.db2.gz JDEOECAOSDAXMD-VQTJNVASSA-N 2 0 358.574 4.225 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@H]2CCC[NH2+]CC2)c(-c2ccccc2Cl)n1 ZINC000666856550 1100268785 /nfs/dbraw/zinc/26/87/85/1100268785.db2.gz PDZBUGZDUWKCJV-INIZCTEOSA-N 2 0 360.933 4.190 20 0 FIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCCC[N@@H+]3Cc3ncccn3)CC2)cc1 ZINC000459531388 1100281921 /nfs/dbraw/zinc/28/19/21/1100281921.db2.gz VPYMLMLOPKZMBZ-QFIPXVFZSA-N 2 0 364.537 4.133 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[NH2+]CC2)ccc1OCc1ccc(Cl)cc1 ZINC000666856617 1100298117 /nfs/dbraw/zinc/29/81/17/1100298117.db2.gz UQOOCQBERYLHPV-IBGZPJMESA-N 2 0 374.912 4.159 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536834935 1100346367 /nfs/dbraw/zinc/34/63/67/1100346367.db2.gz YUAWAHMAUFSGAA-AZUAARDMSA-N 2 0 354.542 4.199 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@@H]4CC[N@H+](C)C[C@@H]4C)cc3)ccc2O1 ZINC000536838069 1100349457 /nfs/dbraw/zinc/34/94/57/1100349457.db2.gz GNOJDLTZNSUSCX-GSHUGGBRSA-N 2 0 350.506 4.107 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000536844297 1100357028 /nfs/dbraw/zinc/35/70/28/1100357028.db2.gz HWSNDMDHWMMEEG-QHAWAJNXSA-N 2 0 362.945 4.075 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2csc3ccccc23)[C@@H](C)C1 ZINC000536849938 1100363405 /nfs/dbraw/zinc/36/34/05/1100363405.db2.gz DRGOABVKVLOKPN-FXAWDEMLSA-N 2 0 360.567 4.170 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2csc3ccccc23)[C@H](C)C1 ZINC000536849943 1100364132 /nfs/dbraw/zinc/36/41/32/1100364132.db2.gz DRGOABVKVLOKPN-XLIONFOSSA-N 2 0 360.567 4.170 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000536860370 1100376100 /nfs/dbraw/zinc/37/61/00/1100376100.db2.gz YZWLFHBEWJDTLU-JTDSTZFVSA-N 2 0 370.484 4.218 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000414921850 1100417395 /nfs/dbraw/zinc/41/73/95/1100417395.db2.gz FAJSFYGOSPRUCQ-QLBRKBSLSA-N 2 0 361.533 4.146 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Br)cc2)C1 ZINC000517536617 1100458958 /nfs/dbraw/zinc/45/89/58/1100458958.db2.gz UVDLWSNEMFZPGZ-HOTGVXAUSA-N 2 0 353.348 4.297 20 0 FIADRP CSC1(C[NH2+]Cc2cccc(OCc3ccccc3)c2)CC[NH+](C)CC1 ZINC000517786288 1100668366 /nfs/dbraw/zinc/66/83/66/1100668366.db2.gz SHNUJFXFOVMUSE-UHFFFAOYSA-N 2 0 370.562 4.183 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)C[C@@H](C)c2cccc(Br)c2)CC1 ZINC000506381719 1100947079 /nfs/dbraw/zinc/94/70/79/1100947079.db2.gz OOFCYETZEVEHID-OAHLLOKOSA-N 2 0 353.348 4.357 20 0 FIADRP Cc1ccc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C[NH+](C)C)c1 ZINC000438846341 1100974982 /nfs/dbraw/zinc/97/49/82/1100974982.db2.gz ASAKFBQHTXUVCA-CTNGQTDRSA-N 2 0 351.538 4.379 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000518274595 1101057529 /nfs/dbraw/zinc/05/75/29/1101057529.db2.gz LWJHMRXZDDRBCK-UHFFFAOYSA-N 2 0 363.299 4.141 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)C1 ZINC000414991880 1101285767 /nfs/dbraw/zinc/28/57/67/1101285767.db2.gz BHBZWQSPAQDPMZ-ZWNOBZJWSA-N 2 0 365.237 4.075 20 0 FIADRP C[C@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001167964321 1101348383 /nfs/dbraw/zinc/34/83/83/1101348383.db2.gz OXLPUZDLYCQICJ-ARVAWAHQSA-N 2 0 367.581 4.035 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000536947249 1101368334 /nfs/dbraw/zinc/36/83/34/1101368334.db2.gz PLUDHHQQZYVPRZ-MRXNPFEDSA-N 2 0 362.949 4.389 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC(C)C[NH2+][C@@H](C)c2ccc(OC)cc2)cc1 ZINC000537027161 1101406656 /nfs/dbraw/zinc/40/66/56/1101406656.db2.gz LDAHPXPCJKDNFO-ROUUACIJSA-N 2 0 356.510 4.341 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000537117293 1101461976 /nfs/dbraw/zinc/46/19/76/1101461976.db2.gz BBJUTUWXNFHRRP-LJQANCHMSA-N 2 0 374.912 4.284 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O2 ZINC000537173930 1101517201 /nfs/dbraw/zinc/51/72/01/1101517201.db2.gz OZOUPEZPSORWDA-FQEVSTJZSA-N 2 0 372.459 4.085 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(Br)s2)C1 ZINC000518763544 1101518368 /nfs/dbraw/zinc/51/83/68/1101518368.db2.gz UZPMMSNDPXTWSO-OKILXGFUSA-N 2 0 359.377 4.358 20 0 FIADRP CCc1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)s1 ZINC000537173610 1101518441 /nfs/dbraw/zinc/51/84/41/1101518441.db2.gz AQGSJPXQPUHEQI-IBGZPJMESA-N 2 0 356.535 4.388 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](CCN(C)C)CC3)s2)cc1 ZINC000518774354 1101536928 /nfs/dbraw/zinc/53/69/28/1101536928.db2.gz BEBCZQPKOHYSHT-UHFFFAOYSA-N 2 0 371.594 4.087 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1O ZINC000426418772 1101538206 /nfs/dbraw/zinc/53/82/06/1101538206.db2.gz YDDFLRUJNQKNFL-CEXWTWQISA-N 2 0 362.558 4.070 20 0 FIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)oc21 ZINC000537303641 1101627907 /nfs/dbraw/zinc/62/79/07/1101627907.db2.gz HEBAGZGGBGXKII-FGTMMUONSA-N 2 0 374.525 4.372 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[N@@H+]1C ZINC000537310124 1101640572 /nfs/dbraw/zinc/64/05/72/1101640572.db2.gz CYCANGWTQJOFAC-SJLPKXTDSA-N 2 0 366.534 4.173 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccc(F)cc2)CC1 ZINC001168169620 1101864406 /nfs/dbraw/zinc/86/44/06/1101864406.db2.gz ZMTQQAAEIZNVPR-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N[C@H](C)c2ccccc2C)CC1 ZINC000519222204 1102020149 /nfs/dbraw/zinc/02/01/49/1102020149.db2.gz SFFBTFOBBXAMNJ-UXHICEINSA-N 2 0 373.585 4.005 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000061070941 1102257634 /nfs/dbraw/zinc/25/76/34/1102257634.db2.gz BRDUOVBBAIKREH-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccccc1OC(F)F ZINC000120891120 1102262892 /nfs/dbraw/zinc/26/28/92/1102262892.db2.gz DTRFVQIKNBDZKW-CYBMUJFWSA-N 2 0 352.400 4.340 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000537631681 1102270220 /nfs/dbraw/zinc/27/02/20/1102270220.db2.gz RPSCORLZJYBCHJ-UHFFFAOYSA-N 2 0 362.514 4.097 20 0 FIADRP COc1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000532457485 1102358428 /nfs/dbraw/zinc/35/84/28/1102358428.db2.gz QXGJZQIPBGQCES-JOCHJYFZSA-N 2 0 350.506 4.458 20 0 FIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2c1 ZINC001167969875 1102415055 /nfs/dbraw/zinc/41/50/55/1102415055.db2.gz HGJADYKWFGHOMT-ZEDDUWKQSA-N 2 0 351.538 4.417 20 0 FIADRP Cc1ccc(-c2nnc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000121645421 1102430036 /nfs/dbraw/zinc/43/00/36/1102430036.db2.gz LYOHDMPJJCBILV-UHFFFAOYSA-N 2 0 368.525 4.133 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2CCCN(C)C2)CCC3)cc1 ZINC000532507009 1102434691 /nfs/dbraw/zinc/43/46/91/1102434691.db2.gz LAKPLADTRYVWQC-AEFFLSMTSA-N 2 0 355.551 4.427 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000532524395 1102443261 /nfs/dbraw/zinc/44/32/61/1102443261.db2.gz FSFSHFVWLILMJS-IIDMSEBBSA-N 2 0 354.460 4.445 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cccc(CO)c1 ZINC000121739579 1102446326 /nfs/dbraw/zinc/44/63/26/1102446326.db2.gz GJVXVYIXQRGIGV-KRWDZBQOSA-N 2 0 372.940 4.395 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC000122352553 1102577651 /nfs/dbraw/zinc/57/76/51/1102577651.db2.gz JPCPLKCJNLJUPE-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCCC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC1 ZINC001167975395 1102631855 /nfs/dbraw/zinc/63/18/55/1102631855.db2.gz OLPUEVPUUVAUSO-GGRGVLTASA-N 3 0 359.602 4.296 20 0 FIADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550886440 1102658326 /nfs/dbraw/zinc/65/83/26/1102658326.db2.gz PDTVVMMAYCVIDK-VABKMULXSA-N 2 0 370.581 4.330 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cn2ccccc2n1 ZINC000550886244 1102658679 /nfs/dbraw/zinc/65/86/79/1102658679.db2.gz NOKFQIKJNQAKAT-OALUTQOASA-N 2 0 362.521 4.417 20 0 FIADRP C[C@@H](O)CCC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000550897449 1102672589 /nfs/dbraw/zinc/67/25/89/1102672589.db2.gz DNXCSHNLVGSMPV-WIYYLYMNSA-N 2 0 350.522 4.130 20 0 FIADRP COc1cnccc1[C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000550911169 1102685416 /nfs/dbraw/zinc/68/54/16/1102685416.db2.gz METZQHLXWRMFTM-QHGAOEGBSA-N 2 0 353.510 4.184 20 0 FIADRP Clc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCOCC2)cc1 ZINC001167977470 1102721981 /nfs/dbraw/zinc/72/19/81/1102721981.db2.gz CPXACPBNECWNAL-SEJPIABJSA-N 2 0 374.956 4.341 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@H](c2cccs2)[NH+]2CCCC2)C[C@@H]1c1ccccc1 ZINC000550977394 1102739969 /nfs/dbraw/zinc/73/99/69/1102739969.db2.gz SZRQCIVKSMDKPC-PWRODBHTSA-N 2 0 369.578 4.310 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCCO2 ZINC000123013231 1102744855 /nfs/dbraw/zinc/74/48/55/1102744855.db2.gz MBVYEGUYLPRKJR-NRFANRHFSA-N 2 0 354.469 4.425 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@]1(C)CCCO1 ZINC000550999414 1102759567 /nfs/dbraw/zinc/75/95/67/1102759567.db2.gz QKGFAPCJOWRYRY-JPYJTQIMSA-N 2 0 352.522 4.462 20 0 FIADRP [NH3+]CCc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2cccc(Cl)c12 ZINC001167982011 1102775947 /nfs/dbraw/zinc/77/59/47/1102775947.db2.gz SUCQWOWNNJQXPI-JWTNVVGKSA-N 2 0 357.929 4.374 20 0 FIADRP CC[N@@H+](Cc1ccc(COC)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537661082 1102785785 /nfs/dbraw/zinc/78/57/85/1102785785.db2.gz LRDQKXNHDQCGRP-HSZRJFAPSA-N 2 0 352.522 4.177 20 0 FIADRP CC[N@@H+](Cc1ccc(COC)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537661083 1102786569 /nfs/dbraw/zinc/78/65/69/1102786569.db2.gz LRDQKXNHDQCGRP-QHCPKHFHSA-N 2 0 352.522 4.177 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[NH+](C)C)cc1 ZINC000551014268 1102790915 /nfs/dbraw/zinc/79/09/15/1102790915.db2.gz QVTVMSDUIKGDRF-VJBWXMMDSA-N 2 0 351.538 4.023 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC3CCN(c4cc[nH+]cc4)CC3)cc2)C1 ZINC000459335993 1102846319 /nfs/dbraw/zinc/84/63/19/1102846319.db2.gz BLEBMSVZCWXJOF-IBGZPJMESA-N 2 0 364.537 4.394 20 0 FIADRP Cc1ccccc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550262494 1102883397 /nfs/dbraw/zinc/88/33/97/1102883397.db2.gz IKFLOBIRMOFCSG-QHCPKHFHSA-N 2 0 364.533 4.013 20 0 FIADRP CN1CC[C@H]([NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@H]1c1ccccc1 ZINC000551086692 1102905877 /nfs/dbraw/zinc/90/58/77/1102905877.db2.gz ARNFEWTYCMDCBO-JSRAGOMMSA-N 2 0 372.553 4.312 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cccc(OCc3ccccc3F)c2)CC1 ZINC000506860864 1102923140 /nfs/dbraw/zinc/92/31/40/1102923140.db2.gz IWLZKNUOGCOUAI-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000506863757 1102924101 /nfs/dbraw/zinc/92/41/01/1102924101.db2.gz XRGNFINIJAPPPL-UHFFFAOYSA-N 2 0 360.933 4.284 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133011583 1102928108 /nfs/dbraw/zinc/92/81/08/1102928108.db2.gz SHGOWHAWPXISPN-QZTJIDSGSA-N 2 0 362.583 4.339 20 0 FIADRP CCOc1cccc(C[NH+]2CCC(C[NH+](CC)CC)CC2)c1OC(F)F ZINC000506941978 1102964227 /nfs/dbraw/zinc/96/42/27/1102964227.db2.gz BIHLBZVHTGCIJL-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCc3c(O)cccc32)cc1 ZINC000551268151 1103026222 /nfs/dbraw/zinc/02/62/22/1103026222.db2.gz PEAHATALRNROFW-QFIPXVFZSA-N 2 0 368.521 4.280 20 0 FIADRP C[C@@H](CC1CCCC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265358 1103027372 /nfs/dbraw/zinc/02/73/72/1103027372.db2.gz UBCBRZOUMSWCAD-REWPJTCUSA-N 2 0 370.581 4.474 20 0 FIADRP Oc1cccc2c1CCC[C@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000551267925 1103029905 /nfs/dbraw/zinc/02/99/05/1103029905.db2.gz XTWBTSBRSBEHFG-HXUWFJFHSA-N 2 0 356.535 4.333 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2sc3nc(C)nc(C)c3c2C)c1 ZINC000729682362 1103036590 /nfs/dbraw/zinc/03/65/90/1103036590.db2.gz SXEPUIGRXQPVKX-UHFFFAOYSA-N 2 0 368.550 4.358 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CC[C@H](c2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000507082067 1103103395 /nfs/dbraw/zinc/10/33/95/1103103395.db2.gz ALCNFDHYTGXSQF-NRFANRHFSA-N 2 0 363.549 4.207 20 0 FIADRP CC[N@H+]([C@@H](C)Cc1ccc(OC)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167984747 1103219461 /nfs/dbraw/zinc/21/94/61/1103219461.db2.gz QOWUXKBSHRARAS-HNYYDBCASA-N 2 0 356.554 4.354 20 0 FIADRP Cc1ccccc1[C@@H](C)[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)CC(C)C ZINC000551428899 1103220817 /nfs/dbraw/zinc/22/08/17/1103220817.db2.gz WAZHZEPTFXLKSR-HXUWFJFHSA-N 2 0 373.585 4.003 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2conc2Cc2ccccc2)CC1 ZINC000507215549 1103221076 /nfs/dbraw/zinc/22/10/76/1103221076.db2.gz SODDQEVIRRNBGB-UHFFFAOYSA-N 2 0 355.526 4.209 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000551798475 1103675815 /nfs/dbraw/zinc/67/58/15/1103675815.db2.gz YQSKJDGGFQLJPH-MDASCCDHSA-N 2 0 352.444 4.415 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000519672248 1103783904 /nfs/dbraw/zinc/78/39/04/1103783904.db2.gz JTAJXNHKKVUZPB-DTQAZKPQSA-N 2 0 352.469 4.496 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CCC2 ZINC000537767809 1103925745 /nfs/dbraw/zinc/92/57/45/1103925745.db2.gz MMHPNRAZSZUYKO-IBGZPJMESA-N 2 0 363.343 4.433 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CC(=O)Nc2ccc(C)cc2C)CC1)CC1CC1 ZINC000537848651 1103969899 /nfs/dbraw/zinc/96/98/99/1103969899.db2.gz MSPMITKZQGYFFG-UHFFFAOYSA-N 2 0 371.569 4.076 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC1(c3ccccc3)CC1)c1ccccc1O2 ZINC000538268386 1104090253 /nfs/dbraw/zinc/09/02/53/1104090253.db2.gz HHZVODAFPAIGKC-NRFANRHFSA-N 2 0 362.517 4.296 20 0 FIADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538295263 1104113548 /nfs/dbraw/zinc/11/35/48/1104113548.db2.gz BILCWCWOROWOPR-VQIMIIECSA-N 2 0 356.535 4.257 20 0 FIADRP CSCc1cccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000188717507 1104751297 /nfs/dbraw/zinc/75/12/97/1104751297.db2.gz VHBLJQGOXSFDKY-QGZVFWFLSA-N 2 0 358.551 4.341 20 0 FIADRP CC[C@H]1C[C@@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCO1 ZINC000507792729 1105081467 /nfs/dbraw/zinc/08/14/67/1105081467.db2.gz GAXXTPCLVXJCIS-VXKWHMMOSA-N 2 0 356.554 4.180 20 0 FIADRP C[C@@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)c1cccc(Cl)c1 ZINC000189825138 1105095532 /nfs/dbraw/zinc/09/55/32/1105095532.db2.gz UKEIKBGCYWYYSP-SFHVURJKSA-N 2 0 371.956 4.477 20 0 FIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000474010373 1105149931 /nfs/dbraw/zinc/14/99/31/1105149931.db2.gz BXCBFMXNFGWQHZ-FQEVSTJZSA-N 2 0 372.940 4.149 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000152426639 1105173936 /nfs/dbraw/zinc/17/39/36/1105173936.db2.gz CRSFCTZBWZCCCZ-RDTXWAMCSA-N 2 0 371.525 4.401 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H](CCO)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168009142 1105208001 /nfs/dbraw/zinc/20/80/01/1105208001.db2.gz HAKOLKNKABZTPB-PWHSHALESA-N 2 0 352.522 4.141 20 0 FIADRP CC(C)[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1F ZINC000665240452 1105258410 /nfs/dbraw/zinc/25/84/10/1105258410.db2.gz LKCVGTJEFLSVPN-BVSLBCMMSA-N 2 0 354.469 4.368 20 0 FIADRP c1sc(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1-c1ccccc1 ZINC000530249044 1106919537 /nfs/dbraw/zinc/91/95/37/1106919537.db2.gz SXZHGHMMWAJTST-FQEVSTJZSA-N 2 0 356.535 4.006 20 0 FIADRP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530241013 1106922471 /nfs/dbraw/zinc/92/24/71/1106922471.db2.gz OVPKIIAHLLZTSP-XJKSGUPXSA-N 2 0 357.325 4.145 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530544689 1107127629 /nfs/dbraw/zinc/12/76/29/1107127629.db2.gz UQUPTBAOKNHDNC-SYYKKAFVSA-N 2 0 350.506 4.319 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c(-c2ccccc2)cc1OC ZINC000530675903 1107249155 /nfs/dbraw/zinc/24/91/55/1107249155.db2.gz ZQPVHMQHOCPZDL-UXHICEINSA-N 2 0 368.521 4.333 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c(-c2ccccc2)cc1OC ZINC000530675904 1107249313 /nfs/dbraw/zinc/24/93/13/1107249313.db2.gz ZQPVHMQHOCPZDL-VQTJNVASSA-N 2 0 368.521 4.333 20 0 FIADRP CC(C[NH+]1CCC[C@@]2(CCSC2)C1)C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451980252 1107411425 /nfs/dbraw/zinc/41/14/25/1107411425.db2.gz QXCVPTKGQGGVFZ-WOJBJXKFSA-N 2 0 368.656 4.061 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@@H](c1cccs1)C1(CO)CCC1 ZINC000452058530 1107454188 /nfs/dbraw/zinc/45/41/88/1107454188.db2.gz ITCVJCNZCSTOBM-FQEVSTJZSA-N 2 0 367.518 4.236 20 0 FIADRP Brc1cccc(C2CC([NH2+]C3CC([NH+]4CCCCC4)C3)C2)c1 ZINC000475546797 1107703541 /nfs/dbraw/zinc/70/35/41/1107703541.db2.gz FTSWUIFODVDZHH-UHFFFAOYSA-N 2 0 363.343 4.302 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000152454958 1107719457 /nfs/dbraw/zinc/71/94/57/1107719457.db2.gz RVWISXDVBIFTQH-ZBFHGGJFSA-N 2 0 371.550 4.262 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccsc2)cc1 ZINC000444658090 1108053462 /nfs/dbraw/zinc/05/34/62/1108053462.db2.gz AFYCSLINWWBDRQ-QHAWAJNXSA-N 2 0 356.535 4.099 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000531676620 1108064601 /nfs/dbraw/zinc/06/46/01/1108064601.db2.gz YVWQTMPPUVIJQC-MSYCTHLASA-N 2 0 374.532 4.358 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@H](C)CCCc2cccnc2)CC1 ZINC000453056492 1108133835 /nfs/dbraw/zinc/13/38/35/1108133835.db2.gz CGELWLXFEDDBJR-HXUWFJFHSA-N 2 0 351.538 4.355 20 0 FIADRP c1csc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)n1 ZINC000453144442 1108195336 /nfs/dbraw/zinc/19/53/36/1108195336.db2.gz MNIXZEQBXUHGPH-HSALFYBXSA-N 2 0 355.551 4.109 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CCO1 ZINC000453138505 1108214010 /nfs/dbraw/zinc/21/40/10/1108214010.db2.gz AFVIVGRUHJIDJM-KCSJKLDESA-N 2 0 356.554 4.223 20 0 FIADRP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000523440567 1108224592 /nfs/dbraw/zinc/22/45/92/1108224592.db2.gz PDYHRSZWKDEDKU-WHSLLNHNSA-N 2 0 366.496 4.237 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453164081 1108235243 /nfs/dbraw/zinc/23/52/43/1108235243.db2.gz QQDZWZGEDVSFGY-NJYVYQBISA-N 2 0 362.945 4.149 20 0 FIADRP CCn1ccnc1[C@@H](C)[NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1 ZINC000453184230 1108253063 /nfs/dbraw/zinc/25/30/63/1108253063.db2.gz UDBJBWPZZOWNLN-LJQANCHMSA-N 2 0 354.542 4.246 20 0 FIADRP Cc1cc(C)c(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c(C)c1 ZINC000531848335 1108263845 /nfs/dbraw/zinc/26/38/45/1108263845.db2.gz URRXUXWMLBAESQ-UHFFFAOYSA-N 2 0 365.565 4.432 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453224704 1108296846 /nfs/dbraw/zinc/29/68/46/1108296846.db2.gz UZERQUUTKPOIMZ-SJLPKXTDSA-N 2 0 356.535 4.167 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2sccc21 ZINC000453231172 1108305530 /nfs/dbraw/zinc/30/55/30/1108305530.db2.gz QDVHROIPFYFQFS-YJBOKZPZSA-N 2 0 359.539 4.202 20 0 FIADRP CC(C)[C@@H]1C[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000453311750 1108399114 /nfs/dbraw/zinc/39/91/14/1108399114.db2.gz BIZASZCWHMPEGP-ZQGJOIPISA-N 2 0 356.554 4.223 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]C[C@H](c2cccs2)N2CCN(C)CC2)s1 ZINC000531932418 1108402050 /nfs/dbraw/zinc/40/20/50/1108402050.db2.gz GSLYYZYKURPXML-DOTOQJQBSA-N 2 0 363.596 4.011 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453349123 1108448879 /nfs/dbraw/zinc/44/88/79/1108448879.db2.gz GMLAFCDPMLICKX-GCJKJVERSA-N 2 0 367.537 4.249 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453349118 1108449135 /nfs/dbraw/zinc/44/91/35/1108449135.db2.gz GMLAFCDPMLICKX-AVRDEDQJSA-N 2 0 367.537 4.249 20 0 FIADRP CCC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000531965236 1108461449 /nfs/dbraw/zinc/46/14/49/1108461449.db2.gz DKSJZAXDHVRPAC-DHIUTWEWSA-N 2 0 351.538 4.106 20 0 FIADRP COc1ccc([C@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)cc1C[NH+]1CCCCC1 ZINC000453365422 1108480920 /nfs/dbraw/zinc/48/09/20/1108480920.db2.gz LYRGSEZIVOUPIU-CVDCTZTESA-N 2 0 372.553 4.245 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)Oc1cccc(C(F)(F)F)c1 ZINC000531979220 1108495164 /nfs/dbraw/zinc/49/51/64/1108495164.db2.gz ZBQHZYLMKRBCMN-CXHZTBPHSA-N 2 0 358.448 4.181 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccccc2Cl)CC1 ZINC000532296628 1108748691 /nfs/dbraw/zinc/74/86/91/1108748691.db2.gz VWWLVARVUJBIGG-UHFFFAOYSA-N 2 0 357.929 4.162 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OCC(F)(F)F)CC1 ZINC000524758614 1109144685 /nfs/dbraw/zinc/14/46/85/1109144685.db2.gz OEOPINRLXWYZNZ-UHFFFAOYSA-N 2 0 358.448 4.180 20 0 FIADRP Cc1cc(N2CC[C@@H]([NH+]3CCCCC3)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000524842191 1109176885 /nfs/dbraw/zinc/17/68/85/1109176885.db2.gz YDJRTFWBEWWFJP-OAHLLOKOSA-N 2 0 361.436 4.209 20 0 FIADRP Cc1cn2c(n1)[C@@H](C[NH2+]Cc1cc(Cl)ccc1Br)CCC2 ZINC000525207564 1109301498 /nfs/dbraw/zinc/30/14/98/1109301498.db2.gz HDYHYXKBKYUIEC-GFCCVEGCSA-N 2 0 368.706 4.275 20 0 FIADRP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000525308525 1109334088 /nfs/dbraw/zinc/33/40/88/1109334088.db2.gz BZWDLEQTSKGCGX-HXUWFJFHSA-N 2 0 354.485 4.239 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822907 1109350337 /nfs/dbraw/zinc/35/03/37/1109350337.db2.gz ZEBWIQCHAMIYHQ-OFNKIYASSA-N 2 0 357.586 4.090 20 0 FIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446884057 1109382105 /nfs/dbraw/zinc/38/21/05/1109382105.db2.gz LWDSKXKIVGIHFT-UHFFFAOYSA-N 2 0 350.506 4.326 20 0 FIADRP Fc1ccccc1COc1cccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000446887712 1109383844 /nfs/dbraw/zinc/38/38/44/1109383844.db2.gz XMQZTHZIAXLUCG-UHFFFAOYSA-N 2 0 368.496 4.369 20 0 FIADRP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](CC2CCC(C(C)(C)C)CC2)CC1 ZINC000525633043 1109462455 /nfs/dbraw/zinc/46/24/55/1109462455.db2.gz DSCFXDDDCDAJBJ-JTVPBKEVSA-N 2 0 363.634 4.329 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000447538253 1109572023 /nfs/dbraw/zinc/57/20/23/1109572023.db2.gz BFRAGCCVUFDADE-HSZRJFAPSA-N 2 0 370.512 4.200 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1Br ZINC000447570672 1109577471 /nfs/dbraw/zinc/57/74/71/1109577471.db2.gz HDPLQRKYKSXFOX-GOSISDBHSA-N 2 0 351.332 4.364 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)c(Br)c1 ZINC000447556284 1109580427 /nfs/dbraw/zinc/58/04/27/1109580427.db2.gz FLIWDEGFSOHGSV-LBPRGKRZSA-N 2 0 355.295 4.113 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000447567976 1109585042 /nfs/dbraw/zinc/58/50/42/1109585042.db2.gz GKHKDOBWLFTTBY-IBGZPJMESA-N 2 0 363.343 4.364 20 0 FIADRP FC(F)(F)CSCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447586845 1109587307 /nfs/dbraw/zinc/58/73/07/1109587307.db2.gz PCRDSMLABVWCND-OSYLJGHBSA-N 2 0 358.473 4.067 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Br)ccc1F ZINC000447576781 1109593037 /nfs/dbraw/zinc/59/30/37/1109593037.db2.gz CHBJCWFBYLTJHA-GFCCVEGCSA-N 2 0 355.295 4.113 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2c2ccccc2)CCO1 ZINC001168092320 1109646084 /nfs/dbraw/zinc/64/60/84/1109646084.db2.gz GZGKFFZYAZKXGG-CDIGIKMISA-N 2 0 364.533 4.202 20 0 FIADRP C[C@@H](N[C@H]1CCOc2c(F)cccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527197745 1109717477 /nfs/dbraw/zinc/71/74/77/1109717477.db2.gz ZSDIKLDKLJXOMM-MMOPVJDHSA-N 2 0 354.469 4.150 20 0 FIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000527844928 1109832957 /nfs/dbraw/zinc/83/29/57/1109832957.db2.gz BGYKXBCHHSQKPN-RBUKOAKNSA-N 2 0 366.553 4.198 20 0 FIADRP CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000527862385 1109842498 /nfs/dbraw/zinc/84/24/98/1109842498.db2.gz AYAOKWYYJMMKMX-QHCPKHFHSA-N 2 0 366.549 4.144 20 0 FIADRP CO[C@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000449085148 1109970864 /nfs/dbraw/zinc/97/08/64/1109970864.db2.gz KRBKWKMZQMYYMF-WMZHIEFXSA-N 2 0 352.522 4.059 20 0 FIADRP CO[C@@H](C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000449085149 1109971094 /nfs/dbraw/zinc/97/10/94/1109971094.db2.gz KRBKWKMZQMYYMF-XXBNENTESA-N 2 0 352.522 4.059 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3F)C2)CC1 ZINC000449066701 1109971390 /nfs/dbraw/zinc/97/13/90/1109971390.db2.gz DXLANOPODLIAGM-UHFFFAOYSA-N 2 0 369.322 4.297 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3c(OC)c2)[C@@H](C)C1 ZINC000449137134 1109980305 /nfs/dbraw/zinc/98/03/05/1109980305.db2.gz DQZYBVBTHXBGSA-PGRDOPGGSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2cccc(O)c2)CC1 ZINC000449131753 1109982394 /nfs/dbraw/zinc/98/23/94/1109982394.db2.gz PHNHNRJLVFYEGJ-RBUKOAKNSA-N 2 0 352.522 4.008 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H](CCO)c2ccccc2)CC1 ZINC000449164566 1109990432 /nfs/dbraw/zinc/99/04/32/1109990432.db2.gz ZPTOHXKVOGJKOB-FQEVSTJZSA-N 2 0 360.586 4.421 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCO[C@]3(CCSC3)C2)CC1 ZINC000449188018 1109990764 /nfs/dbraw/zinc/99/07/64/1109990764.db2.gz FNRPMCNEUAZUKA-GHTZIAJQSA-N 2 0 368.631 4.310 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC(NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000449185838 1109994527 /nfs/dbraw/zinc/99/45/27/1109994527.db2.gz OCPWIHJPHDOWCL-FQEVSTJZSA-N 2 0 369.597 4.079 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2COc3ccccc32)CC1 ZINC000449204387 1109995055 /nfs/dbraw/zinc/99/50/55/1109995055.db2.gz JACAFEWVUXJAFG-YDHSSHFGSA-N 2 0 364.533 4.236 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccccc3F)s2)c1 ZINC000449219801 1110000528 /nfs/dbraw/zinc/00/05/28/1110000528.db2.gz OGOFACQHRLKUEW-UHFFFAOYSA-N 2 0 355.482 4.301 20 0 FIADRP CC(C)C[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449250064 1110004878 /nfs/dbraw/zinc/00/48/78/1110004878.db2.gz KVMWLUBCKQDSOM-WTIAFYNJSA-N 2 0 358.570 4.265 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449250063 1110004919 /nfs/dbraw/zinc/00/49/19/1110004919.db2.gz KVMWLUBCKQDSOM-UEVCKROQSA-N 2 0 358.570 4.265 20 0 FIADRP C[C@H](C[N@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cc(F)cc(F)c1 ZINC000449265214 1110019072 /nfs/dbraw/zinc/01/90/72/1110019072.db2.gz RBHLVBWUPQITKK-KUDFPVQQSA-N 2 0 359.464 4.088 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000449312282 1110030020 /nfs/dbraw/zinc/03/00/20/1110030020.db2.gz MCCJOYBEOMXYSN-XWSHUIEDSA-N 2 0 358.570 4.265 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000449312279 1110030405 /nfs/dbraw/zinc/03/04/05/1110030405.db2.gz MCCJOYBEOMXYSN-KEZQHZCBSA-N 2 0 358.570 4.265 20 0 FIADRP c1c2cccnc2oc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000449340207 1110033182 /nfs/dbraw/zinc/03/31/82/1110033182.db2.gz NBZVTYQRBBDTBF-UHFFFAOYSA-N 2 0 361.489 4.316 20 0 FIADRP Fc1cccc(F)c1-c1ncc(C[NH2+]CCCCC[NH+]2CCCC2)s1 ZINC000449342962 1110034784 /nfs/dbraw/zinc/03/47/84/1110034784.db2.gz GSEUIBMWLACNIE-UHFFFAOYSA-N 2 0 365.493 4.444 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCc2c(F)cc(F)cc21 ZINC000449353165 1110047172 /nfs/dbraw/zinc/04/71/72/1110047172.db2.gz YRAFTTAMUDXESK-FQEVSTJZSA-N 2 0 354.404 4.021 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000449542307 1110100669 /nfs/dbraw/zinc/10/06/69/1110100669.db2.gz QEPOCGOZVGMBBX-YADHBBJMSA-N 2 0 367.537 4.050 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@@H]2CCO[C@@H](C)C2)CC3)cc1 ZINC001168112372 1110156056 /nfs/dbraw/zinc/15/60/56/1110156056.db2.gz DJURAVQYYRKIOA-RBBKRZOGSA-N 2 0 356.554 4.241 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@@](C)(Cc3ccccc3)C3CC3)sc2C1 ZINC000449776892 1110167462 /nfs/dbraw/zinc/16/74/62/1110167462.db2.gz PCAYXEMTUBGFFY-QFIPXVFZSA-N 2 0 369.578 4.411 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)C2CC(F)(F)C2)CC1 ZINC000529541044 1110284593 /nfs/dbraw/zinc/28/45/93/1110284593.db2.gz ZVDHXEDWIUVNBG-CABCVRRESA-N 2 0 369.475 4.052 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000538394973 1111122386 /nfs/dbraw/zinc/12/23/86/1111122386.db2.gz VQGQPFGEPOTTEF-HNNXBMFYSA-N 2 0 363.933 4.010 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccccc2)CC1 ZINC000538409031 1111129604 /nfs/dbraw/zinc/12/96/04/1111129604.db2.gz AUTFZFKDQKJTMX-DNVJHFABSA-N 2 0 356.554 4.275 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000538410876 1111130360 /nfs/dbraw/zinc/13/03/60/1111130360.db2.gz LHXIRIGBCSCLII-FPOVZHCZSA-N 2 0 374.532 4.420 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(-n3cccn3)c2)CC1 ZINC000538739994 1111273012 /nfs/dbraw/zinc/27/30/12/1111273012.db2.gz ZTFIWPYXDIYNJI-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP c1nc([C@@H]2CCCO2)sc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000538752915 1111283001 /nfs/dbraw/zinc/28/30/01/1111283001.db2.gz WTYPBRYYASANCH-IBGZPJMESA-N 2 0 363.571 4.083 20 0 FIADRP c1[nH]nc2cc(C[NH+]3CCC4(CC[N@@H+](Cc5ccccc5)C4)CC3)ccc12 ZINC000538761833 1111290920 /nfs/dbraw/zinc/29/09/20/1111290920.db2.gz FJSQJVLUHBBHSR-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP CC[N@@H+](Cc1c[nH]nc1-c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538764144 1111291244 /nfs/dbraw/zinc/29/12/44/1111291244.db2.gz PIDXZDIEHNFCBU-OAQYLSRUSA-N 2 0 374.532 4.421 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]C2CC[NH+](C(C)(C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000539041605 1111395279 /nfs/dbraw/zinc/39/52/79/1111395279.db2.gz LQUNITVZDOPVOM-PZJWPPBQSA-N 3 0 357.586 4.140 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000539218634 1111480395 /nfs/dbraw/zinc/48/03/95/1111480395.db2.gz XMPNSUFRAYNJDA-YTFSRNRJSA-N 2 0 374.544 4.415 20 0 FIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@H]2CCCCC23CCCC3)c2ccccc2)CC1 ZINC000552072246 1111573553 /nfs/dbraw/zinc/57/35/53/1111573553.db2.gz PFJVCWKTSGVFPG-YADHBBJMSA-N 2 0 355.570 4.068 20 0 FIADRP C[C@@H](O)[C@](C)(C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)Cc1ccccc1 ZINC000477858849 1111580089 /nfs/dbraw/zinc/58/00/89/1111580089.db2.gz MWUDVJKBELXPND-CHOVIJNXSA-N 2 0 372.597 4.249 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2n[nH]cc2c1 ZINC000552099308 1111585067 /nfs/dbraw/zinc/58/50/67/1111585067.db2.gz DSOQLZXNMQBHDG-ZINXYGQCSA-N 2 0 360.505 4.409 20 0 FIADRP CN(Cc1ccccc1)CC(C)(C)C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000552129163 1111594218 /nfs/dbraw/zinc/59/42/18/1111594218.db2.gz CLHRQRLWBFZJPC-OAQYLSRUSA-N 2 0 356.554 4.036 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@@H](CCCOC)c2ccc(Cl)cc2)CC1 ZINC000552322505 1111669036 /nfs/dbraw/zinc/66/90/36/1111669036.db2.gz PLPWXMHBWMTJHQ-GOSISDBHSA-N 2 0 352.950 4.314 20 0 FIADRP Fc1ccc([C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2cnc3ccccc3c2)cc1 ZINC000643536997 1111774453 /nfs/dbraw/zinc/77/44/53/1111774453.db2.gz XUDOVRQUSCAYMV-VXKWHMMOSA-N 2 0 361.464 4.195 20 0 FIADRP CCC(CC)(CN[C@@H]1CCCc2nn(C)cc21)[NH2+][C@@H](C)c1ccccc1 ZINC000479057298 1111938401 /nfs/dbraw/zinc/93/84/01/1111938401.db2.gz HUSJKUJEQAKIGJ-FXAWDEMLSA-N 2 0 354.542 4.297 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479063413 1111939222 /nfs/dbraw/zinc/93/92/22/1111939222.db2.gz FEDHKGLHFUSRRO-HSZRJFAPSA-N 2 0 374.532 4.491 20 0 FIADRP Cc1ccc([C@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479268207 1111982864 /nfs/dbraw/zinc/98/28/64/1111982864.db2.gz CFMGTHPPDDNCTN-NZQKXSOJSA-N 2 0 357.586 4.090 20 0 FIADRP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc(Br)ccc21 ZINC000479335861 1111999262 /nfs/dbraw/zinc/99/92/62/1111999262.db2.gz MWSWXZBFGCJHSM-RKVPGOIHSA-N 2 0 363.343 4.388 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc(F)ccc1F ZINC000479364082 1112001526 /nfs/dbraw/zinc/00/15/26/1112001526.db2.gz VUHHYMZSHVRVSD-NRFANRHFSA-N 2 0 362.464 4.392 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000479491490 1112044901 /nfs/dbraw/zinc/04/49/01/1112044901.db2.gz SMFYNUATDXAAAA-AOMKIAJQSA-N 2 0 356.485 4.494 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1nnn(-c2ccc(C)cc2)c1C ZINC000479764449 1112135332 /nfs/dbraw/zinc/13/53/32/1112135332.db2.gz GWMLICSZNQWQBS-MSOLQXFVSA-N 2 0 357.546 4.045 20 0 FIADRP COc1cc([C@@H](C)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c(F)cn1 ZINC000554049917 1112175671 /nfs/dbraw/zinc/17/56/71/1112175671.db2.gz YDJVFMZEKIRKSW-IAGOWNOFSA-N 2 0 371.500 4.312 20 0 FIADRP CC(C)N(CC[NH+]1CCCCCC1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000554080312 1112195825 /nfs/dbraw/zinc/19/58/25/1112195825.db2.gz WHIZQOIRTOPXEJ-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000480157797 1112307417 /nfs/dbraw/zinc/30/74/17/1112307417.db2.gz HCMCQBMOGHKVNF-INIZCTEOSA-N 2 0 372.484 4.290 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)c1)C1CCOCC1 ZINC000554362657 1112317928 /nfs/dbraw/zinc/31/79/28/1112317928.db2.gz XNAUFRVSKAQYJI-FCHUYYIVSA-N 2 0 374.569 4.091 20 0 FIADRP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480243858 1112341678 /nfs/dbraw/zinc/34/16/78/1112341678.db2.gz WMEGSOFSCBASAI-GLDPYIMESA-N 2 0 364.533 4.381 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000554561062 1112401628 /nfs/dbraw/zinc/40/16/28/1112401628.db2.gz OOSUKGFRHUIIMB-HSZRJFAPSA-N 2 0 364.533 4.464 20 0 FIADRP CC(C)n1ncc2c1C[C@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)CC2 ZINC000480461091 1112438812 /nfs/dbraw/zinc/43/88/12/1112438812.db2.gz NEIDFMBXESENMW-OAQYLSRUSA-N 2 0 368.569 4.069 20 0 FIADRP CCC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480534359 1112465633 /nfs/dbraw/zinc/46/56/33/1112465633.db2.gz DGLJHAYNQWOQQU-LJQANCHMSA-N 2 0 372.384 4.450 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c(C)n1 ZINC000480601459 1112491750 /nfs/dbraw/zinc/49/17/50/1112491750.db2.gz PXADDCDDGVEYCJ-IAGOWNOFSA-N 2 0 352.526 4.176 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000480618644 1112511217 /nfs/dbraw/zinc/51/12/17/1112511217.db2.gz YDGVTWPKCHUBPC-WOJBJXKFSA-N 2 0 351.538 4.030 20 0 FIADRP CCC(CC)(CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@@H](C)c1ccccc1 ZINC000667727983 1112544746 /nfs/dbraw/zinc/54/47/46/1112544746.db2.gz LXMRKRWIWZUAGA-KRWDZBQOSA-N 2 0 368.525 4.176 20 0 FIADRP CC(C)C[C@@H](CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@H](C)c1ccccc1 ZINC000667727646 1112551812 /nfs/dbraw/zinc/55/18/12/1112551812.db2.gz DXDHLQFHJLUWTJ-UTKZUKDTSA-N 2 0 368.525 4.032 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000480734086 1112568900 /nfs/dbraw/zinc/56/89/00/1112568900.db2.gz UXCGIWQTCFJWKC-SFHVURJKSA-N 2 0 368.521 4.288 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccccc1 ZINC000480733686 1112569637 /nfs/dbraw/zinc/56/96/37/1112569637.db2.gz BIZINGXEKISCMT-HSZRJFAPSA-N 2 0 351.538 4.065 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000480751130 1112577863 /nfs/dbraw/zinc/57/78/63/1112577863.db2.gz UYKMPLCWHJMWAH-KIFXHHALSA-N 2 0 363.549 4.013 20 0 FIADRP CCC[C@@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480769573 1112587489 /nfs/dbraw/zinc/58/74/89/1112587489.db2.gz IGVVZVBCDDFZOC-LJQANCHMSA-N 2 0 372.384 4.452 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)cc1 ZINC000658355150 1112643775 /nfs/dbraw/zinc/64/37/75/1112643775.db2.gz HTJOCHMOGJSMLW-QFIPXVFZSA-N 2 0 353.485 4.022 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC001649004384 1112662055 /nfs/dbraw/zinc/66/20/55/1112662055.db2.gz FNDSLJKJLJLFPY-RDPSFJRHSA-N 2 0 369.597 4.141 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CCCO2 ZINC000481318444 1112889234 /nfs/dbraw/zinc/88/92/34/1112889234.db2.gz VPTCBCINHKPEIW-JOCHJYFZSA-N 2 0 368.521 4.247 20 0 FIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CC/C=C\c3ccc(Br)cc3)C2)C1 ZINC000555597411 1112941460 /nfs/dbraw/zinc/94/14/60/1112941460.db2.gz HGBFDRYFPFRVPH-LVXZVAJSSA-N 2 0 363.343 4.270 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000481567356 1112983906 /nfs/dbraw/zinc/98/39/06/1112983906.db2.gz SFXWTKJZENDZOQ-UHFFFAOYSA-N 3 0 369.597 4.285 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000481730096 1113057271 /nfs/dbraw/zinc/05/72/71/1113057271.db2.gz SPXMKVNDGOVTSZ-KSFYIVLOSA-N 2 0 356.485 4.179 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(-c3ccncc3)ccc2OC)CC1 ZINC000481907819 1113134513 /nfs/dbraw/zinc/13/45/13/1113134513.db2.gz BUHNUMJFKAHCHJ-UHFFFAOYSA-N 2 0 367.537 4.311 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000482115501 1113173028 /nfs/dbraw/zinc/17/30/28/1113173028.db2.gz RWQKWMUYRMPNES-MRXNPFEDSA-N 2 0 369.484 4.141 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000482326631 1113226311 /nfs/dbraw/zinc/22/63/11/1113226311.db2.gz ZDZURPNMNTWDMG-KBXCAEBGSA-N 2 0 356.432 4.283 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)c(Br)c2)C1 ZINC000482340827 1113229929 /nfs/dbraw/zinc/22/99/29/1113229929.db2.gz BWKLDFTVEVIRCZ-UONOGXRCSA-N 2 0 357.311 4.359 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3cc(Br)ccc32)C1 ZINC000482343616 1113230024 /nfs/dbraw/zinc/23/00/24/1113230024.db2.gz LIAWHCXJUMKDQX-RDTXWAMCSA-N 2 0 351.332 4.146 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482445256 1113258722 /nfs/dbraw/zinc/25/87/22/1113258722.db2.gz ISDJNYYEPXTVJU-GGAORHGYSA-N 2 0 364.533 4.363 20 0 FIADRP CC(C)CC[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)cc1 ZINC000482537489 1113289850 /nfs/dbraw/zinc/28/98/50/1113289850.db2.gz NLDNDHCVUVXBFP-FQEVSTJZSA-N 2 0 352.950 4.111 20 0 FIADRP CC(C)C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)cc1 ZINC000482550514 1113292033 /nfs/dbraw/zinc/29/20/33/1113292033.db2.gz FVYNKLFCKYMLKN-HXUWFJFHSA-N 2 0 351.966 4.044 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000482543628 1113292832 /nfs/dbraw/zinc/29/28/32/1113292832.db2.gz NJDJYXOHYQYAIB-JTSKRJEESA-N 2 0 367.512 4.224 20 0 FIADRP CCC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482547797 1113293866 /nfs/dbraw/zinc/29/38/66/1113293866.db2.gz AMEINVSNZWDVKF-IBGZPJMESA-N 2 0 372.384 4.452 20 0 FIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482554103 1113298079 /nfs/dbraw/zinc/29/80/79/1113298079.db2.gz FEEFROANJWJSTH-VGOFRKELSA-N 2 0 367.512 4.224 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482638261 1113316844 /nfs/dbraw/zinc/31/68/44/1113316844.db2.gz ZPZLQYNQPXRBIB-AUSIDOKSSA-N 2 0 367.537 4.156 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000482882245 1113391252 /nfs/dbraw/zinc/39/12/52/1113391252.db2.gz AUNZAVKXLNXNRG-CRAIPNDOSA-N 2 0 359.341 4.271 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000482907818 1113397279 /nfs/dbraw/zinc/39/72/79/1113397279.db2.gz ZDWINZXQEXRWAC-REWPJTCUSA-N 2 0 366.549 4.313 20 0 FIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(Oc4ccc(F)cc4)nc3)C2)CC1 ZINC000668169272 1113405070 /nfs/dbraw/zinc/40/50/70/1113405070.db2.gz MDVPRPNXSDZOLB-LJQANCHMSA-N 2 0 369.484 4.177 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)c(F)c(C)c2)[C@@H](C)C1 ZINC000483151713 1113455349 /nfs/dbraw/zinc/45/53/49/1113455349.db2.gz HHCVUOXTHHWUBR-NSHGMRRFSA-N 2 0 350.522 4.230 20 0 FIADRP COc1ccccc1/C=C/C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486461858 1113572817 /nfs/dbraw/zinc/57/28/17/1113572817.db2.gz PQAOILFBWFSTDI-JURWAZFJSA-N 2 0 350.506 4.209 20 0 FIADRP C[C@@H](NCc1csc(-c2ccco2)n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486514874 1113585577 /nfs/dbraw/zinc/58/55/77/1113585577.db2.gz FKAZJYGKBUNHNM-AEFFLSMTSA-N 2 0 367.518 4.403 20 0 FIADRP COc1cc(C)c(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000486522134 1113587845 /nfs/dbraw/zinc/58/78/45/1113587845.db2.gz YCJRZYCGTHPXMR-QUCCMNQESA-N 2 0 368.521 4.012 20 0 FIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488408252 1113921191 /nfs/dbraw/zinc/92/11/91/1113921191.db2.gz GUZPCYPGFJTBQE-WMZOPIPTSA-N 2 0 352.613 4.470 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000488434796 1113929632 /nfs/dbraw/zinc/92/96/32/1113929632.db2.gz NKMXWNXAAIXMLO-MRXNPFEDSA-N 2 0 374.504 4.299 20 0 FIADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000490031012 1114204519 /nfs/dbraw/zinc/20/45/19/1114204519.db2.gz NBFLWTOZXCAVAR-SFHVURJKSA-N 2 0 371.912 4.296 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccccc1F ZINC000490124036 1114220865 /nfs/dbraw/zinc/22/08/65/1114220865.db2.gz IBXYDEBPPYGBJI-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP COC(=O)c1csc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000586789169 1114393661 /nfs/dbraw/zinc/39/36/61/1114393661.db2.gz ZFSHVYMUMXPJGS-MRXNPFEDSA-N 2 0 372.534 4.098 20 0 FIADRP CCCn1nc(C)c(CN2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1C ZINC000571567020 1114481973 /nfs/dbraw/zinc/48/19/73/1114481973.db2.gz CMXVMRCOYOOHBA-QHCPKHFHSA-N 2 0 366.553 4.008 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3c(cc2OC)C[C@@H](C)O3)cc1 ZINC000588769457 1114619120 /nfs/dbraw/zinc/61/91/20/1114619120.db2.gz VKOVIBGARGQTNH-QGZVFWFLSA-N 2 0 368.521 4.150 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2OC(F)F)C[C@@H]1C ZINC000572211984 1114622017 /nfs/dbraw/zinc/62/20/17/1114622017.db2.gz NXBDIZQVHVJWNY-QNPCKFRZSA-N 2 0 352.469 4.496 20 0 FIADRP CN1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C[C@@H]1c1ccccc1 ZINC000572370807 1114638428 /nfs/dbraw/zinc/63/84/28/1114638428.db2.gz APHQHDBWHPSVPP-BJKOFHAPSA-N 2 0 363.549 4.208 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(F)c(Br)c1 ZINC000589835995 1114846949 /nfs/dbraw/zinc/84/69/49/1114846949.db2.gz CFLWTHGPWXALNC-AWEZNQCLSA-N 2 0 357.311 4.332 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000589836994 1114847330 /nfs/dbraw/zinc/84/73/30/1114847330.db2.gz UCPAYRHXIOWUTN-UHFFFAOYSA-N 2 0 368.949 4.349 20 0 FIADRP COc1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cs2)cc1 ZINC000590786246 1114974555 /nfs/dbraw/zinc/97/45/55/1114974555.db2.gz ITTIANSAGXQMPI-UHFFFAOYSA-N 2 0 373.566 4.371 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2cc(C)c(OCc3ccccn3)c(C)c2)CC1 ZINC000573207015 1115064551 /nfs/dbraw/zinc/06/45/51/1115064551.db2.gz YUNQBTDESYTANZ-UHFFFAOYSA-N 2 0 367.537 4.099 20 0 FIADRP CCCc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000591713826 1115120073 /nfs/dbraw/zinc/12/00/73/1115120073.db2.gz QPUMLVLLOYBBSW-GOSISDBHSA-N 2 0 369.528 4.381 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000591722236 1115121694 /nfs/dbraw/zinc/12/16/94/1115121694.db2.gz UIECXEKHAVRVRC-UHFFFAOYSA-N 2 0 364.489 4.219 20 0 FIADRP CC(C)(C)OC(=O)[C@H]1C[C@H](NC2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000593691160 1115342497 /nfs/dbraw/zinc/34/24/97/1115342497.db2.gz ORMWKFRAPRRQOF-PMACEKPBSA-N 2 0 372.553 4.409 20 0 FIADRP CCC(O)(CC)C(C)(C)C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000574704941 1115440566 /nfs/dbraw/zinc/44/05/66/1115440566.db2.gz SUAQXTKCNWQDAD-IBGZPJMESA-N 2 0 374.569 4.142 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1cccc(O)c1 ZINC000669617957 1115673281 /nfs/dbraw/zinc/67/32/81/1115673281.db2.gz MIRPLCFMBPGTRZ-CZEIZJIKSA-N 2 0 350.506 4.344 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2ccc(F)cc2C(F)(F)F)CC[NH+](C)CC1 ZINC000599045402 1115780035 /nfs/dbraw/zinc/78/00/35/1115780035.db2.gz ALDXHNQJMMDQIU-LBPRGKRZSA-N 2 0 364.452 4.323 20 0 FIADRP Cc1cccc(C(C)(C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000605596052 1115909073 /nfs/dbraw/zinc/90/90/73/1115909073.db2.gz FZJBHLGUHMSISP-UHFFFAOYSA-N 2 0 352.522 4.495 20 0 FIADRP C[N@H+](CCOC(c1ccccc1)c1ccccc1)C[C@H]1CCC[NH+](C)C1 ZINC000607358127 1116022772 /nfs/dbraw/zinc/02/27/72/1116022772.db2.gz AXYABDXCPOTRAT-FQEVSTJZSA-N 2 0 352.522 4.066 20 0 FIADRP COc1c(C)cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC000063551435 1116079210 /nfs/dbraw/zinc/07/92/10/1116079210.db2.gz UPXJCQTZFXXBJC-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000608061237 1116079860 /nfs/dbraw/zinc/07/98/60/1116079860.db2.gz IEUXEKXMUUMRBI-DENIHFKCSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(F)c(Br)cc1F ZINC000623998124 1116229932 /nfs/dbraw/zinc/22/99/32/1116229932.db2.gz HQCXMDDEWYUGKF-NSHDSACASA-N 2 0 361.274 4.252 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000534794987 1116237687 /nfs/dbraw/zinc/23/76/87/1116237687.db2.gz SRSPEYCNHFYERY-GTNSWQLSSA-N 2 0 369.734 4.164 20 0 FIADRP Cc1nc(C)c(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)s1 ZINC000534963809 1116258298 /nfs/dbraw/zinc/25/82/98/1116258298.db2.gz NQXQMOSEHUITDJ-UHFFFAOYSA-N 2 0 355.551 4.248 20 0 FIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](c2cc3ccccc3o2)C(C)C)CC1 ZINC000539555255 1116344954 /nfs/dbraw/zinc/34/49/54/1116344954.db2.gz RCQGPBATMREYNP-QFIPXVFZSA-N 2 0 357.542 4.137 20 0 FIADRP C[C@@H](Nc1ccc(N2CCCCC2)cn1)c1cccc(OCC[NH+](C)C)c1 ZINC000539626886 1116356062 /nfs/dbraw/zinc/35/60/62/1116356062.db2.gz FUULEAGDEOYTFL-GOSISDBHSA-N 2 0 368.525 4.185 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000539714336 1116370314 /nfs/dbraw/zinc/37/03/14/1116370314.db2.gz OZWIIDMFTOOWTO-UHFFFAOYSA-N 2 0 350.506 4.103 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(OCC(F)F)cc2)C1 ZINC000462671714 1116386670 /nfs/dbraw/zinc/38/66/70/1116386670.db2.gz CUUPYACBNZNKDC-CALCHBBNSA-N 2 0 354.485 4.178 20 0 FIADRP Cc1ccccc1-c1cccc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1 ZINC000539895240 1117739212 /nfs/dbraw/zinc/73/92/12/1117739212.db2.gz AJLGOOCYDNTMRS-YFNKSVMNSA-N 2 0 364.533 4.346 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1cccnc1 ZINC000539968337 1117787112 /nfs/dbraw/zinc/78/71/12/1117787112.db2.gz TZSOTRFEBHHXMD-HXUWFJFHSA-N 2 0 351.538 4.467 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2(CCO)CC2)c2ccc(F)cc2)CC1 ZINC000462806823 1117788325 /nfs/dbraw/zinc/78/83/25/1117788325.db2.gz XTXWCLLBYKDNLB-OAQYLSRUSA-N 2 0 362.533 4.131 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)CC1 ZINC000462815744 1117793449 /nfs/dbraw/zinc/79/34/49/1117793449.db2.gz JHSLLNQXSAHNAH-GOSISDBHSA-N 2 0 371.569 4.315 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCCc3c2cnn3C)CC[NH+](Cc2ccccc2)CC1 ZINC000540141575 1117893811 /nfs/dbraw/zinc/89/38/11/1117893811.db2.gz OMWCMMKUMPSTRP-OAQYLSRUSA-N 2 0 366.553 4.080 20 0 FIADRP COc1ccc([C@H](OC)[C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC000540146662 1117897637 /nfs/dbraw/zinc/89/76/37/1117897637.db2.gz KDFSLKKXKXWJIL-SGAADRECSA-N 2 0 374.569 4.404 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(-c2cccs2)cc1 ZINC000540159221 1117903051 /nfs/dbraw/zinc/90/30/51/1117903051.db2.gz ZVDMVJMKQZJWNT-ZLGUVYLKSA-N 2 0 370.562 4.444 20 0 FIADRP COc1ccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@H](C)O[C@@H](C)C3)ccc2c1 ZINC000540171553 1117912930 /nfs/dbraw/zinc/91/29/30/1117912930.db2.gz RJOFTMNOKVAVGV-FHWLQOOXSA-N 2 0 370.537 4.388 20 0 FIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000540173121 1117913453 /nfs/dbraw/zinc/91/34/53/1117913453.db2.gz CVEPVEROSQGXDF-ULQDDVLXSA-N 2 0 370.484 4.136 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCCOc3c(Cl)cccc32)C[C@H](C)O1 ZINC000540175436 1117916080 /nfs/dbraw/zinc/91/60/80/1117916080.db2.gz IJWNCXBTOIOHQF-JTDSTZFVSA-N 2 0 366.933 4.033 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(OCC(F)F)c1 ZINC000540176635 1117916683 /nfs/dbraw/zinc/91/66/83/1117916683.db2.gz UJBNWNPVRJSSTO-LAUBAEHRSA-N 2 0 374.475 4.331 20 0 FIADRP CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540178726 1117923417 /nfs/dbraw/zinc/92/34/17/1117923417.db2.gz FCXFGJUNQSGZQH-HTAPYJJXSA-N 2 0 368.521 4.364 20 0 FIADRP Fc1ccccc1CSCC[NH2+]C1CCN(CCC(F)(F)F)CC1 ZINC000463112491 1117969083 /nfs/dbraw/zinc/96/90/83/1117969083.db2.gz VLVOBGLGKDVQAM-UHFFFAOYSA-N 2 0 364.452 4.065 20 0 FIADRP CC(C)[NH+](CCNC1CC[NH+](Cc2ccccc2Cl)CC1)C(C)C ZINC000463128991 1117976058 /nfs/dbraw/zinc/97/60/58/1117976058.db2.gz BQHYBZKRRMUCFN-UHFFFAOYSA-N 2 0 351.966 4.013 20 0 FIADRP COc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000540302001 1117976332 /nfs/dbraw/zinc/97/63/32/1117976332.db2.gz MHHQNCUBVRHZEM-GBXCKJPGSA-N 2 0 364.533 4.301 20 0 FIADRP C[C@H]1C[C@@H](NCCC[NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463130734 1117978199 /nfs/dbraw/zinc/97/81/99/1117978199.db2.gz IHTPYYSHVZIRBT-URXFXBBRSA-N 2 0 365.565 4.151 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C(C)C)cc1 ZINC000540321242 1117983002 /nfs/dbraw/zinc/98/30/02/1117983002.db2.gz RECLOJVZBOYDDB-NZQKXSOJSA-N 2 0 358.570 4.427 20 0 FIADRP C[C@@H](C[NH2+]C1CCN(CCc2ccccc2)CC1)Oc1ccccc1Cl ZINC000463189691 1118007110 /nfs/dbraw/zinc/00/71/10/1118007110.db2.gz JVKKYLQAYPROPI-SFHVURJKSA-N 2 0 372.940 4.404 20 0 FIADRP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Sc1ccccc1 ZINC000463191774 1118009025 /nfs/dbraw/zinc/00/90/25/1118009025.db2.gz PZTNWCPIXFTYEQ-IBGZPJMESA-N 2 0 354.563 4.464 20 0 FIADRP C[C@H]1C[C@H](N[C@H]2CCOc3c(F)cccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463263601 1118058118 /nfs/dbraw/zinc/05/81/18/1118058118.db2.gz DDMOZZNRDNMIRY-CDXJDZJCSA-N 2 0 354.469 4.292 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Oc1ccccc1 ZINC000540493482 1118091443 /nfs/dbraw/zinc/09/14/43/1118091443.db2.gz BAMTVGHIAHMYNP-WIYYLYMNSA-N 2 0 366.505 4.032 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCc3ccc(F)cc31)c1ccccc1O2 ZINC000540494729 1118092554 /nfs/dbraw/zinc/09/25/54/1118092554.db2.gz ISXDTFSKBMWCTP-RTWAWAEBSA-N 2 0 366.480 4.391 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000540596839 1118139995 /nfs/dbraw/zinc/13/99/95/1118139995.db2.gz JQKCEQKBJMYWSZ-HXUWFJFHSA-N 2 0 365.993 4.435 20 0 FIADRP CCC1(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000540709404 1118196927 /nfs/dbraw/zinc/19/69/27/1118196927.db2.gz BXSRZPWGYDMHRE-FCHUYYIVSA-N 2 0 358.570 4.472 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000540748031 1118231842 /nfs/dbraw/zinc/23/18/42/1118231842.db2.gz NWCVFWRBRLCMEX-WMZHIEFXSA-N 2 0 351.538 4.379 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000540992655 1118341837 /nfs/dbraw/zinc/34/18/37/1118341837.db2.gz YKFAZUAXIMTTOE-SPEDKVCISA-N 2 0 365.521 4.206 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000540992654 1118342066 /nfs/dbraw/zinc/34/20/66/1118342066.db2.gz YKFAZUAXIMTTOE-NPPFBWRTSA-N 2 0 365.521 4.206 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(Cl)ccc2Br)CC1 ZINC000464051440 1118414088 /nfs/dbraw/zinc/41/40/88/1118414088.db2.gz NWSIIUCSEQOMLQ-UHFFFAOYSA-N 2 0 359.739 4.314 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc2cccnc12 ZINC000541537938 1118546446 /nfs/dbraw/zinc/54/64/46/1118546446.db2.gz WHVBHSABSOICLU-NRFANRHFSA-N 2 0 359.517 4.497 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000541534452 1118552756 /nfs/dbraw/zinc/55/27/56/1118552756.db2.gz QGPDSSHRIFDJQD-YJBOKZPZSA-N 2 0 350.441 4.093 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541600543 1118574670 /nfs/dbraw/zinc/57/46/70/1118574670.db2.gz LDPYXOJBWWSPAO-PXNSSMCTSA-N 2 0 372.553 4.385 20 0 FIADRP CC(C)[C@@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000541916099 1118706898 /nfs/dbraw/zinc/70/68/98/1118706898.db2.gz AKVPBNAXBWKNDX-DNQXCXABSA-N 2 0 366.549 4.000 20 0 FIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168442523 1118988084 /nfs/dbraw/zinc/98/80/84/1118988084.db2.gz VWPLVJJWKFJUTQ-CVDCTZTESA-N 2 0 352.497 4.137 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000492251448 1119058085 /nfs/dbraw/zinc/05/80/85/1119058085.db2.gz HVSLCUCRPCWUDC-FCHUYYIVSA-N 2 0 372.940 4.256 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000542465096 1119287642 /nfs/dbraw/zinc/28/76/42/1119287642.db2.gz SRAQIXGOTTZZLL-VFNWGFHPSA-N 2 0 350.441 4.298 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2sc(C)nc2C)cc1 ZINC000178131340 1119373152 /nfs/dbraw/zinc/37/31/52/1119373152.db2.gz IAQDODLVUNMVBA-OAHLLOKOSA-N 2 0 361.555 4.331 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000178215756 1119377508 /nfs/dbraw/zinc/37/75/08/1119377508.db2.gz SWCXFEUAANDTLB-CPFNUKBASA-N 2 0 364.496 4.082 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311590935 1119380253 /nfs/dbraw/zinc/38/02/53/1119380253.db2.gz AKZSJXYWOBYVSF-DXIQSLLYSA-N 2 0 352.522 4.214 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000178634448 1119399089 /nfs/dbraw/zinc/39/90/89/1119399089.db2.gz LKCKLXUMQBFKLJ-SFHVURJKSA-N 2 0 365.521 4.208 20 0 FIADRP COC[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000493889988 1119503916 /nfs/dbraw/zinc/50/39/16/1119503916.db2.gz ZUBYDTAOABYHFB-OAQYLSRUSA-N 2 0 358.913 4.282 20 0 FIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000493904418 1119504302 /nfs/dbraw/zinc/50/43/02/1119504302.db2.gz DGVFWSRMWCNVRP-LAUBAEHRSA-N 2 0 358.551 4.326 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000493892920 1119506688 /nfs/dbraw/zinc/50/66/88/1119506688.db2.gz AKEXGQLJEOWFGV-SFHVURJKSA-N 2 0 363.343 4.351 20 0 FIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000493945731 1119513752 /nfs/dbraw/zinc/51/37/52/1119513752.db2.gz TZXPHCBTTXTHRW-AUSIDOKSSA-N 2 0 352.522 4.059 20 0 FIADRP CC[C@H](Cc1cccs1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000671302465 1119527040 /nfs/dbraw/zinc/52/70/40/1119527040.db2.gz LBZDOJMXYCKLEY-GOSISDBHSA-N 2 0 358.551 4.332 20 0 FIADRP CCCc1csc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000494177102 1119551577 /nfs/dbraw/zinc/55/15/77/1119551577.db2.gz UNCODCHYXALAQJ-IEBWSBKVSA-N 2 0 357.567 4.486 20 0 FIADRP FC(F)(F)C1CCC(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000183761016 1119582804 /nfs/dbraw/zinc/58/28/04/1119582804.db2.gz IYZRAOIDKCCMLR-UHFFFAOYSA-N 2 0 355.448 4.256 20 0 FIADRP CCSc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000185623496 1119676511 /nfs/dbraw/zinc/67/65/11/1119676511.db2.gz DTBZMTNJSQMWCX-OAQYLSRUSA-N 2 0 370.562 4.045 20 0 FIADRP COc1ccsc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000186138718 1119708491 /nfs/dbraw/zinc/70/84/91/1119708491.db2.gz SVPKXYIRYBSYEE-CQSZACIVSA-N 2 0 350.553 4.381 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(-c2cccs2)cc1 ZINC000186564844 1119736623 /nfs/dbraw/zinc/73/66/23/1119736623.db2.gz VDFJUUSZLOPUNV-ZWKOTPCHSA-N 2 0 357.567 4.092 20 0 FIADRP Cc1nc2ccc(C[NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)cc2s1 ZINC000494340293 1119828310 /nfs/dbraw/zinc/82/83/10/1119828310.db2.gz RYNKNIUUVPHUBI-FQEVSTJZSA-N 2 0 365.546 4.259 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000189369007 1119889301 /nfs/dbraw/zinc/88/93/01/1119889301.db2.gz QYUDNMNETFBLRS-DYESRHJHSA-N 2 0 354.494 4.110 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000223056152 1119930255 /nfs/dbraw/zinc/93/02/55/1119930255.db2.gz DGJDKFKRUCMMFT-SFHVURJKSA-N 2 0 351.332 4.291 20 0 FIADRP COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cn(-c3cc[nH+]cc3)nc1C)[C@@H]2C ZINC000542485521 1119932800 /nfs/dbraw/zinc/93/28/00/1119932800.db2.gz POURVGZGJQXGKM-DOTOQJQBSA-N 2 0 362.477 4.092 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467368336 1119946875 /nfs/dbraw/zinc/94/68/75/1119946875.db2.gz GNRZHZCZJQDGBY-VAMGGRTRSA-N 2 0 354.542 4.281 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467368334 1119947020 /nfs/dbraw/zinc/94/70/20/1119947020.db2.gz GNRZHZCZJQDGBY-AQNXPRMDSA-N 2 0 354.542 4.281 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCS2 ZINC000191547273 1119983394 /nfs/dbraw/zinc/98/33/94/1119983394.db2.gz JPOVLYGLMQDKSX-GQIGUUNPSA-N 2 0 360.567 4.475 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCCO2 ZINC000195133158 1120120413 /nfs/dbraw/zinc/12/04/13/1120120413.db2.gz DNRGUGFLOCQUIM-KNQAVFIVSA-N 2 0 366.505 4.021 20 0 FIADRP COc1ccc2[nH]cc(C3CC[NH+](CCC[NH+]4CCCCC4)CC3)c2c1 ZINC000193479010 1120148177 /nfs/dbraw/zinc/14/81/77/1120148177.db2.gz BHAGIXVGKIAGBD-UHFFFAOYSA-N 2 0 355.526 4.232 20 0 FIADRP Clc1ccc(Cl)c(OCC[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000195601373 1120188852 /nfs/dbraw/zinc/18/88/52/1120188852.db2.gz HOZBIHYSKFJTFT-UHFFFAOYSA-N 2 0 357.325 4.180 20 0 FIADRP c1coc(-c2ncc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)s2)c1 ZINC000494931413 1120376724 /nfs/dbraw/zinc/37/67/24/1120376724.db2.gz ONZAOAHBAQZZFD-UHFFFAOYSA-N 2 0 359.539 4.491 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000495017136 1120424344 /nfs/dbraw/zinc/42/43/44/1120424344.db2.gz LPCIRUUPNDZUKV-SJORKVTESA-N 2 0 354.485 4.493 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000495005690 1120426458 /nfs/dbraw/zinc/42/64/58/1120426458.db2.gz PCTWYNUAXLZEOC-DLBZAZTESA-N 2 0 354.485 4.493 20 0 FIADRP C[C@H]([NH2+]CCCOc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534265 1120435258 /nfs/dbraw/zinc/43/52/58/1120435258.db2.gz RNHNTTUBGLLMTL-IRXDYDNUSA-N 2 0 350.934 4.352 20 0 FIADRP CC(C)[NH+](CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)C(C)C ZINC000495075737 1120458458 /nfs/dbraw/zinc/45/84/58/1120458458.db2.gz USSAZMGRCCJULG-NQIIRXRSSA-N 2 0 350.522 4.392 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495415297 1120793254 /nfs/dbraw/zinc/79/32/54/1120793254.db2.gz OURXFFLZHVTRKJ-DYXWJJEUSA-N 2 0 351.538 4.314 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)Cc1ccc(Br)cc1 ZINC000233434761 1120863089 /nfs/dbraw/zinc/86/30/89/1120863089.db2.gz NMCUOZCKLJDDPB-HZPDHXFCSA-N 2 0 355.364 4.480 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cc(F)ccc1F ZINC000495548485 1120882483 /nfs/dbraw/zinc/88/24/83/1120882483.db2.gz QKTSKVNBZAVJOM-BRWVUGGUSA-N 2 0 374.475 4.425 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc(Br)ncc1F ZINC000762738591 1120957040 /nfs/dbraw/zinc/95/70/40/1120957040.db2.gz UWSCJGLFGBPKQJ-UONOGXRCSA-N 2 0 372.326 4.146 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cc(Br)ncc1F ZINC000762749265 1120958903 /nfs/dbraw/zinc/95/89/03/1120958903.db2.gz RIBDBIRDQPTGRA-AWEZNQCLSA-N 2 0 372.326 4.290 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000236810590 1120969867 /nfs/dbraw/zinc/96/98/67/1120969867.db2.gz YOIBNIGILXBQGL-OAQYLSRUSA-N 2 0 368.521 4.096 20 0 FIADRP ClC1(Cl)C[C@@H]1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762925927 1120998332 /nfs/dbraw/zinc/99/83/32/1120998332.db2.gz JHZVCSOOVPSAKI-QGZVFWFLSA-N 2 0 353.337 4.168 20 0 FIADRP Cc1ccc([C@H](O)C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000762926432 1120998344 /nfs/dbraw/zinc/99/83/44/1120998344.db2.gz JYWLWDCKILXPRZ-HSZRJFAPSA-N 2 0 364.533 4.017 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(OC)c1 ZINC000397706149 1121289682 /nfs/dbraw/zinc/28/96/82/1121289682.db2.gz XKXSXYGBOZWSDB-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP C[NH+]1CCN(Cc2cccc(C[NH2+]C3CCC4(CCCCC4)CC3)c2)CC1 ZINC001649060379 1121423179 /nfs/dbraw/zinc/42/31/79/1121423179.db2.gz MHRPDXOSYKMLQO-UHFFFAOYSA-N 2 0 369.597 4.417 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000108428701 1121541997 /nfs/dbraw/zinc/54/19/97/1121541997.db2.gz BFYRDZRMRHSUSH-KRWDZBQOSA-N 2 0 371.912 4.024 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)co2)cc1 ZINC000123596909 1121617674 /nfs/dbraw/zinc/61/76/74/1121617674.db2.gz JSRYFSYQSQGFOZ-UHFFFAOYSA-N 2 0 371.525 4.294 20 0 FIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000123704083 1121624944 /nfs/dbraw/zinc/62/49/44/1121624944.db2.gz CUYBVWVLTAFTOE-CQSZACIVSA-N 2 0 362.901 4.270 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c(C)c1OC ZINC000671741414 1121638493 /nfs/dbraw/zinc/63/84/93/1121638493.db2.gz LZKYFLNPQIPMJA-ROUUACIJSA-N 2 0 362.558 4.187 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000671741190 1121639474 /nfs/dbraw/zinc/63/94/74/1121639474.db2.gz MGZDQCBWKCNRDH-HNNXBMFYSA-N 2 0 353.466 4.224 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCc3c2cccc3O)CC1 ZINC000671746331 1121664680 /nfs/dbraw/zinc/66/46/80/1121664680.db2.gz PFMUDYLMBDYMLV-OBFZPWGMSA-N 2 0 350.506 4.412 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)o1 ZINC000124656095 1121711908 /nfs/dbraw/zinc/71/19/08/1121711908.db2.gz HROINLYQUWYUSO-KURKYZTESA-N 2 0 356.510 4.302 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cnn1-c1cccc(Cl)c1 ZINC000125290068 1121766264 /nfs/dbraw/zinc/76/62/64/1121766264.db2.gz ZUAKDFHVAGQJJD-HNNXBMFYSA-N 2 0 360.933 4.217 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 ZINC000125376422 1121774232 /nfs/dbraw/zinc/77/42/32/1121774232.db2.gz QAHYTSNZBSHVFY-INIZCTEOSA-N 2 0 371.352 4.459 20 0 FIADRP Cc1nc2c(s1)[C@@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CCC2 ZINC000125500468 1121785619 /nfs/dbraw/zinc/78/56/19/1121785619.db2.gz HJLABSUJFQYCGY-KRWDZBQOSA-N 2 0 361.580 4.392 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](CCCOC)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000671764655 1121798584 /nfs/dbraw/zinc/79/85/84/1121798584.db2.gz POEHMTIZTAIABC-QRFRQXIXSA-N 2 0 352.950 4.170 20 0 FIADRP CCCC[NH+]1CCC(C[NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608795 1121970633 /nfs/dbraw/zinc/97/06/33/1121970633.db2.gz DNXJLCOXCMBZTC-IFMALSPDSA-N 2 0 360.542 4.017 20 0 FIADRP C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765781857 1121992198 /nfs/dbraw/zinc/99/21/98/1121992198.db2.gz XOWUKRHQEHTCHU-CVEARBPZSA-N 2 0 367.578 4.148 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc(F)c3)cc2)C1 ZINC000917006230 1121999396 /nfs/dbraw/zinc/99/93/96/1121999396.db2.gz MLCUDSVNYZZXHS-PMAPCBKXSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2cc(F)ccc2F)cc1 ZINC000917008175 1122000468 /nfs/dbraw/zinc/00/04/68/1122000468.db2.gz GNSWOZCQQZCBSB-AOMKIAJQSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3F)cc2)C1 ZINC000917009118 1122002220 /nfs/dbraw/zinc/00/22/20/1122002220.db2.gz XXUBUMVOUICRDY-KSFYIVLOSA-N 2 0 374.475 4.020 20 0 FIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616201 1122108777 /nfs/dbraw/zinc/10/87/77/1122108777.db2.gz QPIRGRHMCAWEOK-REWPJTCUSA-N 2 0 374.569 4.406 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)CCO2)cc1 ZINC001168617150 1122126043 /nfs/dbraw/zinc/12/60/43/1122126043.db2.gz SZMKVYOQLUCYSZ-JTHBVZDNSA-N 2 0 372.553 4.017 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)CCO2)cc1 ZINC001168617148 1122126396 /nfs/dbraw/zinc/12/63/96/1122126396.db2.gz SZMKVYOQLUCYSZ-GGAORHGYSA-N 2 0 372.553 4.017 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H](c3ncc[nH]3)c3ccccc3)CC2)CC1 ZINC000128185719 1122203164 /nfs/dbraw/zinc/20/31/64/1122203164.db2.gz QAKGNAKNCSHHBD-XVAXZDLZSA-N 2 0 352.526 4.132 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(-c2ccccc2)c1 ZINC000128242885 1122208810 /nfs/dbraw/zinc/20/88/10/1122208810.db2.gz YTYWJMIRTFZWOB-HXUWFJFHSA-N 2 0 351.538 4.032 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000497409957 1122220910 /nfs/dbraw/zinc/22/09/10/1122220910.db2.gz BWUPZKQLKROGHO-LSUHJGNXSA-N 2 0 364.533 4.264 20 0 FIADRP CCc1noc(C2CCC([NH2+]CC3([NH+]4CCCCC4)CCCCC3)CC2)n1 ZINC000497856333 1122441815 /nfs/dbraw/zinc/44/18/15/1122441815.db2.gz GMJSTPGCBYXQDI-UHFFFAOYSA-N 2 0 374.573 4.437 20 0 FIADRP Cc1cc(F)ccc1[C@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000763430832 1122744508 /nfs/dbraw/zinc/74/45/08/1122744508.db2.gz FMMUPHAUSXCQPG-XMSQKQJNSA-N 2 0 362.533 4.144 20 0 FIADRP Cc1cc(F)ccc1[C@@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000763430826 1122744597 /nfs/dbraw/zinc/74/45/97/1122744597.db2.gz FMMUPHAUSXCQPG-GCJKJVERSA-N 2 0 362.533 4.144 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556228611 1122745450 /nfs/dbraw/zinc/74/54/50/1122745450.db2.gz ASYFKCKQUKBQFH-CEMLEFRQSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)C1 ZINC000556232744 1122749797 /nfs/dbraw/zinc/74/97/97/1122749797.db2.gz IKJVKUBWHWFKNB-BEFAXECRSA-N 2 0 369.475 4.276 20 0 FIADRP Cc1cc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)ccc1F ZINC000556233987 1122750373 /nfs/dbraw/zinc/75/03/73/1122750373.db2.gz UBGCQQGPRXVPEA-QFIPXVFZSA-N 2 0 355.501 4.474 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000556480722 1122914033 /nfs/dbraw/zinc/91/40/33/1122914033.db2.gz KJHMUCMRTCNSFI-QHCPKHFHSA-N 2 0 357.586 4.195 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498805380 1123023075 /nfs/dbraw/zinc/02/30/75/1123023075.db2.gz KFLXBFBOSXHYAY-ACIOBRDBSA-N 2 0 372.528 4.119 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000131308488 1123032585 /nfs/dbraw/zinc/03/25/85/1123032585.db2.gz LNMIXXUMBVPHKL-HOTGVXAUSA-N 2 0 363.937 4.082 20 0 FIADRP CC(C)(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cc2ccccc2o1 ZINC000498942660 1123093777 /nfs/dbraw/zinc/09/37/77/1123093777.db2.gz MWIDGRKIZOCQBH-WIYYLYMNSA-N 2 0 358.526 4.347 20 0 FIADRP C[N@@H+](CCC(=O)Nc1c(Cl)cccc1Cl)CC[C@H]1CCCC[NH+]1C ZINC000072725480 1123133263 /nfs/dbraw/zinc/13/32/63/1123133263.db2.gz SGQPNZQQQVLVRT-CQSZACIVSA-N 2 0 372.340 4.128 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556889552 1123175518 /nfs/dbraw/zinc/17/55/18/1123175518.db2.gz JHGPPIBXELTJMA-ILZDJORESA-N 2 0 374.569 4.186 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556890432 1123176514 /nfs/dbraw/zinc/17/65/14/1123176514.db2.gz LKHDNBQLJQVCJZ-VZAIETPKSA-N 2 0 370.581 4.472 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000131740589 1123177095 /nfs/dbraw/zinc/17/70/95/1123177095.db2.gz RNVFCHYFWGXLNM-CUWPLCDZSA-N 2 0 362.558 4.119 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)c1 ZINC000132467564 1123263320 /nfs/dbraw/zinc/26/33/20/1123263320.db2.gz XHQJRYKMCVIBGH-SFHVURJKSA-N 2 0 363.427 4.329 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N(C)c1ccccc1 ZINC000499140999 1123283774 /nfs/dbraw/zinc/28/37/74/1123283774.db2.gz IYKOJDCQSDIOSP-HFGNEKBZSA-N 2 0 363.549 4.297 20 0 FIADRP Fc1ccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499148181 1123292141 /nfs/dbraw/zinc/29/21/41/1123292141.db2.gz CAUPGXVCWGFVSM-LDLYASANSA-N 2 0 372.459 4.129 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499231284 1123340325 /nfs/dbraw/zinc/34/03/25/1123340325.db2.gz UTCPZCBFWQFIAD-IITNATTFSA-N 2 0 364.533 4.411 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1 ZINC000499232155 1123341209 /nfs/dbraw/zinc/34/12/09/1123341209.db2.gz GOWJZYVXIDNGMG-NMIHRBCNSA-N 2 0 350.506 4.239 20 0 FIADRP CC(C)(C)c1csc(CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)n1 ZINC000133353543 1123478741 /nfs/dbraw/zinc/47/87/41/1123478741.db2.gz KNBRTUIIYRRFBK-UHFFFAOYSA-N 2 0 371.594 4.280 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)CC1 ZINC000921230822 1123593736 /nfs/dbraw/zinc/59/37/36/1123593736.db2.gz BMQGPQBAXCUTDI-SFHVURJKSA-N 2 0 373.585 4.365 20 0 FIADRP C[C@@H](NCc1ccc(C[NH+]2CCCCC2)cc1)c1nc2c(s1)CCC2 ZINC000134696670 1123662673 /nfs/dbraw/zinc/66/26/73/1123662673.db2.gz SPGRKKURXBCAHH-MRXNPFEDSA-N 2 0 355.551 4.469 20 0 FIADRP CC(C)N(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(C)C ZINC000615316367 1123989381 /nfs/dbraw/zinc/98/93/81/1123989381.db2.gz RQGABZBZJNXPRF-PMACEKPBSA-N 2 0 373.585 4.185 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000245601462 1124134043 /nfs/dbraw/zinc/13/40/43/1124134043.db2.gz MMROEJMQVDPKEK-AEFFLSMTSA-N 2 0 374.916 4.054 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245637022 1124154734 /nfs/dbraw/zinc/15/47/34/1124154734.db2.gz AAABSJJGQQEPSN-JOZNFPNDSA-N 2 0 369.597 4.284 20 0 FIADRP OCC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000245637112 1124155316 /nfs/dbraw/zinc/15/53/16/1124155316.db2.gz ABHHSDSSSPMOLG-BJESRGMDSA-N 2 0 356.554 4.103 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523951 1124157728 /nfs/dbraw/zinc/15/77/28/1124157728.db2.gz JDXPNDUKNXIQPU-SFHVURJKSA-N 2 0 359.558 4.109 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000180130832 1124239458 /nfs/dbraw/zinc/23/94/58/1124239458.db2.gz ZCCGVRSWTPZUOB-VIQWUECVSA-N 2 0 367.578 4.067 20 0 FIADRP COc1ccc([C@H](OC)[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000542840771 1124437833 /nfs/dbraw/zinc/43/78/33/1124437833.db2.gz PIWJPHKMLLIZHU-VGOFRKELSA-N 2 0 360.542 4.158 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000246564195 1124534018 /nfs/dbraw/zinc/53/40/18/1124534018.db2.gz XHRBLSPFXMVTCQ-YTFSRNRJSA-N 2 0 358.570 4.001 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+]3CCCC[C@H]3C[C@@H]3CCC[NH+]3C)CCO2)cc1 ZINC001168662272 1124562440 /nfs/dbraw/zinc/56/24/40/1124562440.db2.gz DODNCVJDCFUZEH-QXUYBEEESA-N 2 0 372.553 4.254 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+]3CCCC[C@H]3C[C@@H]3CCC[NH+]3C)CCO2)cc1 ZINC001168662266 1124562485 /nfs/dbraw/zinc/56/24/85/1124562485.db2.gz DODNCVJDCFUZEH-FKEBYFGASA-N 2 0 372.553 4.254 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cccc(N2CCCC2=O)c1 ZINC000247253389 1124612058 /nfs/dbraw/zinc/61/20/58/1124612058.db2.gz ZVCMAMCQXWQRRT-RTBURBONSA-N 2 0 357.542 4.119 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC(F)F)cc2)[C@@H](C)C1 ZINC000248031042 1124739092 /nfs/dbraw/zinc/73/90/92/1124739092.db2.gz QJHQVTASKQNDPP-BXWFABGCSA-N 2 0 370.484 4.076 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cnc3ccsc3c2)[C@@H](C)C1 ZINC000248066020 1124740013 /nfs/dbraw/zinc/74/00/13/1124740013.db2.gz MGCRAZDFUQKPPQ-BQFCYCMXSA-N 2 0 361.555 4.084 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C)Nc1ccccc1 ZINC000248200244 1124750424 /nfs/dbraw/zinc/75/04/24/1124750424.db2.gz YLPMHIVAWFRROW-PTUXOGIPSA-N 2 0 366.553 4.018 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCCO2 ZINC000248403844 1124763002 /nfs/dbraw/zinc/76/30/02/1124763002.db2.gz PGCFDOKNDJNRLX-LNLFQRSKSA-N 2 0 358.526 4.152 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(F)c(F)c1 ZINC000248444568 1124769152 /nfs/dbraw/zinc/76/91/52/1124769152.db2.gz MCBOYSBVGUGYKN-HBMCJLEFSA-N 2 0 366.496 4.019 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)s1 ZINC000248441659 1124769240 /nfs/dbraw/zinc/76/92/40/1124769240.db2.gz KHKOEJBYPOFFJR-SJORKVTESA-N 2 0 364.942 4.209 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)s1 ZINC000248451998 1124770580 /nfs/dbraw/zinc/77/05/80/1124770580.db2.gz PPSLVMLSBLFKJL-APWZRJJASA-N 2 0 358.551 4.118 20 0 FIADRP CC1(C)C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2ccccc21 ZINC000248449848 1124770663 /nfs/dbraw/zinc/77/06/63/1124770663.db2.gz ORFGSMNJIORACB-REWPJTCUSA-N 2 0 364.533 4.156 20 0 FIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1C ZINC000248453061 1124772700 /nfs/dbraw/zinc/77/27/00/1124772700.db2.gz QGUJFVUCSKCLHO-UGKGYDQZSA-N 2 0 352.522 4.111 20 0 FIADRP CN1CCC[C@H](C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)[C@@H]1c1cccs1 ZINC000248739034 1124808322 /nfs/dbraw/zinc/80/83/22/1124808322.db2.gz PQUFWWGVJLYTOD-CVYSASLGSA-N 2 0 360.567 4.068 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168686171 1124824057 /nfs/dbraw/zinc/82/40/57/1124824057.db2.gz WLAFZJABJFKWBO-HXUWFJFHSA-N 2 0 354.925 4.309 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000249255956 1124852201 /nfs/dbraw/zinc/85/22/01/1124852201.db2.gz GNCKJSMCLYBNJU-OTWHNJEPSA-N 2 0 354.460 4.262 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000089214718 1124891821 /nfs/dbraw/zinc/89/18/21/1124891821.db2.gz KPZHOTLREYDFMF-NRFANRHFSA-N 2 0 351.494 4.110 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(N2CCCC2=O)cc1 ZINC000765953147 1124975854 /nfs/dbraw/zinc/97/58/54/1124975854.db2.gz AVCFESALOOUPRM-LJQANCHMSA-N 2 0 357.542 4.120 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000090417510 1124994806 /nfs/dbraw/zinc/99/48/06/1124994806.db2.gz HVHOJONUWFKUQC-FDDCHVKYSA-N 2 0 356.554 4.278 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc2ccccc21 ZINC000090523359 1125000847 /nfs/dbraw/zinc/00/08/47/1125000847.db2.gz ITQAJCZDAJYIBS-IMRHEYAYSA-N 2 0 352.522 4.258 20 0 FIADRP Fc1cnccc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000449122120 1125033076 /nfs/dbraw/zinc/03/30/76/1125033076.db2.gz KIEZPVYOLZLODP-UHFFFAOYSA-N 2 0 355.501 4.045 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285522 1125062116 /nfs/dbraw/zinc/06/21/16/1125062116.db2.gz YUYRXWOCPGVJFM-KUHUBIRLSA-N 2 0 370.368 4.060 20 0 FIADRP Cc1cc([C@H]2CCC[NH+]2CCCCC[N@H+]2CCC[C@@H]2c2cc(C)no2)on1 ZINC000077265786 1125162099 /nfs/dbraw/zinc/16/20/99/1125162099.db2.gz ZYUXUMCISUTDQP-RTBURBONSA-N 2 0 372.513 4.424 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000656678801 1125176101 /nfs/dbraw/zinc/17/61/01/1125176101.db2.gz URVDDMNRDWLCEK-HNNXBMFYSA-N 2 0 370.459 4.247 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H](CO)c2ccc(Cl)cc2)CC1 ZINC000672620780 1125198266 /nfs/dbraw/zinc/19/82/66/1125198266.db2.gz ZFHKECPGXNUSJB-PLMTUMEDSA-N 2 0 364.961 4.049 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC(F)F)cc1 ZINC000092856881 1125247781 /nfs/dbraw/zinc/24/77/81/1125247781.db2.gz UTQBGWWQIQSHKJ-OAHLLOKOSA-N 2 0 361.436 4.250 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2)cc1C[NH+]1CCCCC1 ZINC000182202454 1125288051 /nfs/dbraw/zinc/28/80/51/1125288051.db2.gz ZISFSSTZXPVSPW-XMSQKQJNSA-N 2 0 368.521 4.065 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccnc5ccccc45)C[C@@H]3C2)cc1 ZINC000312643739 1125438676 /nfs/dbraw/zinc/43/86/76/1125438676.db2.gz INSGGPVNAFWPMT-UNMCSNQZSA-N 2 0 357.501 4.189 20 0 FIADRP COc1cc2c(cc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)O[C@H](C)C2 ZINC000065976537 1125439449 /nfs/dbraw/zinc/43/94/49/1125439449.db2.gz IDYBOUYGNOTQHM-QGZVFWFLSA-N 2 0 368.521 4.149 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3F)c2)C1 ZINC000062426850 567951997 /nfs/dbraw/zinc/95/19/97/567951997.db2.gz GHPZMCVXBDPHKX-IBGZPJMESA-N 2 0 356.485 4.225 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCc2c(C)noc2C)cc1C[NH+]1CCCCC1 ZINC000182892625 1125668387 /nfs/dbraw/zinc/66/83/87/1125668387.db2.gz IRZGPSPXZLNNLG-MRXNPFEDSA-N 2 0 371.525 4.179 20 0 FIADRP CCC(CC)[N@H+](C[C@H]1CCCN(C)C1)C1CCN(Cc2ccccc2)CC1 ZINC001208614979 1080016470 /nfs/dbraw/zinc/01/64/70/1080016470.db2.gz GJJZRYNJGZMXSN-QFIPXVFZSA-N 2 0 371.613 4.483 20 0 FIADRP C[C@@H](C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1)OCc1ccccc1 ZINC001208701994 1080090528 /nfs/dbraw/zinc/09/05/28/1080090528.db2.gz GGNHWGPNQKXSMR-URXFXBBRSA-N 2 0 364.533 4.190 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180109063 1080449622 /nfs/dbraw/zinc/44/96/22/1080449622.db2.gz YUYMYGKGEZRZOA-QFIPXVFZSA-N 2 0 371.956 4.047 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180467449 1080501967 /nfs/dbraw/zinc/50/19/67/1080501967.db2.gz HNHVQMAEGIZBKO-QFIPXVFZSA-N 2 0 371.956 4.047 20 0 FIADRP CCOc1cc(C[NH2+]C[C@H]2CC[N@H+](CC)C2)ccc1OCc1ccccc1 ZINC000120783265 1080652017 /nfs/dbraw/zinc/65/20/17/1080652017.db2.gz KJLKBTJWAJJFPH-OAQYLSRUSA-N 2 0 368.521 4.096 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547826049 1080941316 /nfs/dbraw/zinc/94/13/16/1080941316.db2.gz MVBYCJQOGOUMRR-ZMUKGBGYSA-N 2 0 364.533 4.264 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(OCC(F)F)cc1 ZINC001648802446 1080951714 /nfs/dbraw/zinc/95/17/14/1080951714.db2.gz IKKIRECPMLCJOU-UHFFFAOYSA-N 2 0 362.464 4.461 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(OC(F)F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000237539831 1080974094 /nfs/dbraw/zinc/97/40/94/1080974094.db2.gz JCGOLNRAIJXZIA-LPHOPBHVSA-N 2 0 360.448 4.431 20 0 FIADRP CC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(C)cc1 ZINC000397501194 1081004057 /nfs/dbraw/zinc/00/40/57/1081004057.db2.gz YIYVAIMKZHXTMB-QFIPXVFZSA-N 2 0 352.522 4.063 20 0 FIADRP Fc1ccc([C@@H](CC(F)(F)F)NC2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000655735342 1081156219 /nfs/dbraw/zinc/15/62/19/1081156219.db2.gz HLRVLQJYXZCWGZ-QZTJIDSGSA-N 2 0 374.422 4.052 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc(O)cc(Cl)c2)cc1 ZINC001648814987 1081226801 /nfs/dbraw/zinc/22/68/01/1081226801.db2.gz XHUKJQVQPIVCLP-UHFFFAOYSA-N 2 0 362.901 4.056 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CCC4(CCCC4)O2)C3)cc1 ZINC000655853728 1081265691 /nfs/dbraw/zinc/26/56/91/1081265691.db2.gz YBNKJZLNIKMXEM-LRSLUSHPSA-N 2 0 354.538 4.263 20 0 FIADRP CC(C)Oc1cccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001648830448 1081267561 /nfs/dbraw/zinc/26/75/61/1081267561.db2.gz SYWUJCXPCQGVOX-UHFFFAOYSA-N 2 0 368.521 4.238 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)N[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[NH+](C)C ZINC000579986266 1081370947 /nfs/dbraw/zinc/37/09/47/1081370947.db2.gz XNFHXIZNXJDNHG-OHCFRWENSA-N 2 0 365.565 4.411 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H](OCc2ccccc2)c2ccc(Cl)cc2)C1 ZINC000580095127 1081589413 /nfs/dbraw/zinc/58/94/13/1081589413.db2.gz IXNWSZLXPVXFGV-QHAWAJNXSA-N 2 0 358.913 4.457 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CCC(F)(F)CC1 ZINC000656201590 1081910758 /nfs/dbraw/zinc/91/07/58/1081910758.db2.gz SDYIYIOIEGDKAO-FNHZYXHNSA-N 2 0 350.453 4.046 20 0 FIADRP Clc1ccc(-c2cc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)on2)cc1 ZINC000047972951 1082045700 /nfs/dbraw/zinc/04/57/00/1082045700.db2.gz DOMWQTRSWGRZEP-UHFFFAOYSA-N 2 0 359.901 4.303 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3cccc(OC)c3)n2)CC1 ZINC000047973722 1082047339 /nfs/dbraw/zinc/04/73/39/1082047339.db2.gz KNGUEKYZAASIEU-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C)cc2-c2ccnn2C)c1 ZINC000580900110 1082211552 /nfs/dbraw/zinc/21/15/52/1082211552.db2.gz KBVXSOJBIGZOFZ-UHFFFAOYSA-N 2 0 362.521 4.137 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCOCC2CCCC2)cc1 ZINC000656404941 1082331362 /nfs/dbraw/zinc/33/13/62/1082331362.db2.gz HIYFBLANNAOSJU-KEZOAJOQSA-N 2 0 368.565 4.036 20 0 FIADRP c1ccc(C[NH+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCOCC2CCCC2)cc1 ZINC000656404946 1082331504 /nfs/dbraw/zinc/33/15/04/1082331504.db2.gz HIYFBLANNAOSJU-XQUALCHDSA-N 2 0 368.565 4.036 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCCC2CCOCC2)cc1 ZINC000656401783 1082332980 /nfs/dbraw/zinc/33/29/80/1082332980.db2.gz JBKMPKFAUYAPGF-KEZOAJOQSA-N 2 0 368.565 4.036 20 0 FIADRP Brc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000393736052 1082484384 /nfs/dbraw/zinc/48/43/84/1082484384.db2.gz BNSHMXNFNOMVEX-IBGZPJMESA-N 2 0 373.338 4.451 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc2c(n1)CCC2 ZINC000656501824 1082500637 /nfs/dbraw/zinc/50/06/37/1082500637.db2.gz DMZFITULEOUPDV-UHFFFAOYSA-N 2 0 361.489 4.085 20 0 FIADRP CCCC[C@@H](CC)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000581384493 1082506840 /nfs/dbraw/zinc/50/68/40/1082506840.db2.gz YQJXNHNRMSTLIS-FCHUYYIVSA-N 2 0 358.570 4.474 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000581558887 1082662430 /nfs/dbraw/zinc/66/24/30/1082662430.db2.gz DXBBFTRJGWDQJG-MSOLQXFVSA-N 2 0 355.482 4.022 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc2ccccc21 ZINC000656676830 1082710962 /nfs/dbraw/zinc/71/09/62/1082710962.db2.gz KHOYHCLBRQJJMC-SFHVURJKSA-N 2 0 352.522 4.381 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000566088474 1082778145 /nfs/dbraw/zinc/77/81/45/1082778145.db2.gz SSSVORAFGSYGTB-SNVBAGLBSA-N 2 0 354.338 4.374 20 0 FIADRP CC(C)Cn1nccc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000647177223 1082866682 /nfs/dbraw/zinc/86/66/82/1082866682.db2.gz QJYBMDYSSULFFG-UHFFFAOYSA-N 2 0 354.542 4.205 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cccs1 ZINC000090971321 1083096752 /nfs/dbraw/zinc/09/67/52/1083096752.db2.gz FLTSWZBCHQVUBV-QGZVFWFLSA-N 2 0 355.551 4.131 20 0 FIADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430930255 1083240765 /nfs/dbraw/zinc/24/07/65/1083240765.db2.gz XUWSIEPSVHLUAB-SFHVURJKSA-N 3 0 361.549 4.015 20 0 FIADRP CC(C)([NH3+])c1noc(C[N@H+](Cc2cccc3ccccc32)C2CCCC2)n1 ZINC000431078280 1083329593 /nfs/dbraw/zinc/32/95/93/1083329593.db2.gz FNKBLEGLICSCNT-UHFFFAOYSA-N 2 0 364.493 4.361 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCc3ccc(O)cc32)CC1 ZINC000658237984 1083368003 /nfs/dbraw/zinc/36/80/03/1083368003.db2.gz ONLXLQWAILZHGE-YABDQXBESA-N 2 0 350.506 4.412 20 0 FIADRP Cn1cc(C[C@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000658236084 1083374624 /nfs/dbraw/zinc/37/46/24/1083374624.db2.gz SYIMPHRUPLXRRE-CTNGQTDRSA-N 2 0 374.617 4.400 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1OC(F)F ZINC000658353107 1083424633 /nfs/dbraw/zinc/42/46/33/1083424633.db2.gz BSGLWXDRTVKUSC-CYBMUJFWSA-N 2 0 356.432 4.200 20 0 FIADRP Cc1cc([C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)ccc1F ZINC000658356420 1083427818 /nfs/dbraw/zinc/42/78/18/1083427818.db2.gz NXGKBRNICQDSRP-HSZRJFAPSA-N 2 0 367.512 4.330 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658357104 1083427885 /nfs/dbraw/zinc/42/78/85/1083427885.db2.gz QZRQVHIIINLIGW-HNNXBMFYSA-N 2 0 370.566 4.286 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCc3cccnc3CC2)C[N@@H+]1Cc1ccccc1 ZINC000421836287 1083433536 /nfs/dbraw/zinc/43/35/36/1083433536.db2.gz ODSQKONXIQMAAG-UNWVZKJWSA-N 2 0 363.549 4.219 20 0 FIADRP C[N@@H+]1CCC[C@H](CNc2cc[nH+]c3c(O)cccc23)[C@H]1c1cccs1 ZINC000684575267 1083457634 /nfs/dbraw/zinc/45/76/34/1083457634.db2.gz GHFPTTIELDHMRQ-VLIAUNLRSA-N 2 0 353.491 4.497 20 0 FIADRP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]c3c(O)cccc23)[C@H]1c1cccs1 ZINC000684575269 1083457661 /nfs/dbraw/zinc/45/76/61/1083457661.db2.gz GHFPTTIELDHMRQ-XOBRGWDASA-N 2 0 353.491 4.497 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2ccccc2n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483250 1083459706 /nfs/dbraw/zinc/45/97/06/1083459706.db2.gz LDZMCXSEAWMRSX-UGKGYDQZSA-N 2 0 359.517 4.278 20 0 FIADRP CCC(=O)Nc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000548483509 1083468656 /nfs/dbraw/zinc/46/86/56/1083468656.db2.gz ATFUGWZMQXYKNF-NQIIRXRSSA-N 2 0 365.521 4.035 20 0 FIADRP CCOC(=O)CCCCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000535674389 1083570819 /nfs/dbraw/zinc/57/08/19/1083570819.db2.gz DFARYABULLYYJE-UHFFFAOYSA-N 2 0 372.553 4.098 20 0 FIADRP Cc1cn2c(n1)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc3ccccc3)CC1)CCC2 ZINC000375842753 1083675728 /nfs/dbraw/zinc/67/57/28/1083675728.db2.gz WQRBQUGVPHZGEW-ITAUSPCMSA-N 2 0 366.553 4.102 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+]CCCc3ccc4c(c3)CCO4)C2)cc1 ZINC000684614359 1083781135 /nfs/dbraw/zinc/78/11/35/1083781135.db2.gz VSGPYDSSUPZJDS-JOCHJYFZSA-N 2 0 364.533 4.056 20 0 FIADRP CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)CCO1 ZINC000181269508 1083848547 /nfs/dbraw/zinc/84/85/47/1083848547.db2.gz QOPCBIMFAYLBFT-XJABCFGWSA-N 2 0 362.558 4.261 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000545272812 1084152022 /nfs/dbraw/zinc/15/20/22/1084152022.db2.gz IQTVRPQLHITSHZ-OAQYLSRUSA-N 2 0 363.977 4.189 20 0 FIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511020374 1084205096 /nfs/dbraw/zinc/20/50/96/1084205096.db2.gz XOBAAASKWNGHEQ-HKUYNNGSSA-N 2 0 358.476 4.398 20 0 FIADRP C[C@@H]1C[C@H](N(C)Cc2sccc2NC(=O)OC(C)(C)C)CC[N@@H+]1C ZINC000892104699 1084298552 /nfs/dbraw/zinc/29/85/52/1084298552.db2.gz DPNJHZGKJYVWFZ-ZIAGYGMSSA-N 2 0 353.532 4.010 20 0 FIADRP Cc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)c(-c2ccnn2C)c1 ZINC000548984499 1084325525 /nfs/dbraw/zinc/32/55/25/1084325525.db2.gz QBZWZWGFZXIAPY-UHFFFAOYSA-N 2 0 354.542 4.141 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(-c2cnn(C)c2)c1 ZINC000548984371 1084327434 /nfs/dbraw/zinc/32/74/34/1084327434.db2.gz LBNCMPGYIFPILZ-IBGZPJMESA-N 2 0 354.542 4.140 20 0 FIADRP Clc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000531141922 1084339073 /nfs/dbraw/zinc/33/90/73/1084339073.db2.gz WQTDUFHUTULXHH-UHFFFAOYSA-N 2 0 362.901 4.094 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc2ccncc2s1 ZINC000657312126 1084424317 /nfs/dbraw/zinc/42/43/17/1084424317.db2.gz CWILDUQRYSHRQG-UHFFFAOYSA-N 2 0 369.534 4.307 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NCc2ccnn2-c2cc[nH+]cc2)cc1 ZINC000657320280 1084541267 /nfs/dbraw/zinc/54/12/67/1084541267.db2.gz CDHIFTAPIFSZGP-SFHVURJKSA-N 2 0 361.493 4.254 20 0 FIADRP CC1(C)C[C@H]([NH2+]CCCCC[NH2+][C@H]2CC(C)(C)OC2(C)C)C(C)(C)O1 ZINC000444631568 1084571302 /nfs/dbraw/zinc/57/13/02/1084571302.db2.gz MEDVFBPKALHPNQ-IRXDYDNUSA-N 2 0 354.579 4.028 20 0 FIADRP CC[C@H]([NH2+]C1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@H]1CC1(C)C ZINC000414143279 1084687189 /nfs/dbraw/zinc/68/71/89/1084687189.db2.gz IQESQNYGSMERGJ-RTWAWAEBSA-N 2 0 357.542 4.024 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)sc1Br ZINC000414163502 1084721849 /nfs/dbraw/zinc/72/18/49/1084721849.db2.gz GCBHIFOTYZYRMB-LLVKDONJSA-N 2 0 350.285 4.318 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000414183698 1084760603 /nfs/dbraw/zinc/76/06/03/1084760603.db2.gz OAXOWFHDWUTSNH-QGWWYQLQSA-N 2 0 368.924 4.062 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OCC ZINC000171126931 1084774740 /nfs/dbraw/zinc/77/47/40/1084774740.db2.gz UMPWXEQKTTVTPE-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000613491175 1084820049 /nfs/dbraw/zinc/82/00/49/1084820049.db2.gz JAQCBOVQDJHGIZ-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@H](C[NH+](C)C)C2)c1C ZINC000582313629 1084859187 /nfs/dbraw/zinc/85/91/87/1084859187.db2.gz JXJNYJAVJNWJJT-CQSZACIVSA-N 2 0 362.315 4.002 20 0 FIADRP CCC[NH+]1CCC([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)CC1 ZINC000125161283 1085054843 /nfs/dbraw/zinc/05/48/43/1085054843.db2.gz VZKWPVMJDRBGLF-UHFFFAOYSA-N 2 0 362.521 4.049 20 0 FIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+]Cc3ccnn3-c3cc[nH+]cc3)C2)c1 ZINC000657454490 1085105507 /nfs/dbraw/zinc/10/55/07/1085105507.db2.gz KFYZGKZFKRCCGY-JCNLHEQBSA-N 2 0 372.394 4.322 20 0 FIADRP CCOc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000657459688 1085115473 /nfs/dbraw/zinc/11/54/73/1085115473.db2.gz BVGXUAPIEBKDTE-UHFFFAOYSA-N 2 0 368.521 4.157 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCCCNC(=O)OC(C)(C)C)C[C@@H]1C ZINC001167589959 1085247385 /nfs/dbraw/zinc/24/73/85/1085247385.db2.gz KZHNGQVLPGPAHZ-OALUTQOASA-N 2 0 369.594 4.266 20 0 FIADRP Cn1cnc(C[N@@H+]2CCCCC[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000660765239 1085260117 /nfs/dbraw/zinc/26/01/17/1085260117.db2.gz UWMDBXJIEWILKE-HSZRJFAPSA-N 2 0 366.553 4.077 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000549528118 1085364812 /nfs/dbraw/zinc/36/48/12/1085364812.db2.gz SETIYOWSJLULMH-VXKWHMMOSA-N 2 0 366.505 4.020 20 0 FIADRP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657537413 1085453448 /nfs/dbraw/zinc/45/34/48/1085453448.db2.gz KBVYEOBKIXWBTJ-PMOQBDJRSA-N 2 0 370.581 4.439 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)C1 ZINC000563460837 1085647953 /nfs/dbraw/zinc/64/79/53/1085647953.db2.gz ZBGNTIHZZYTZFX-GHTZIAJQSA-N 2 0 374.912 4.318 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000237478710 1085662633 /nfs/dbraw/zinc/66/26/33/1085662633.db2.gz ISWTVRMLBVHAOU-KGVIQGDOSA-N 2 0 365.521 4.193 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4ccccc4)cc3)cc2)C1 ZINC000657595932 1085664321 /nfs/dbraw/zinc/66/43/21/1085664321.db2.gz SSFMWTRWLWSYKY-VWLOTQADSA-N 2 0 372.512 4.210 20 0 FIADRP Clc1cc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(Cl)s1 ZINC000657613748 1085699653 /nfs/dbraw/zinc/69/96/53/1085699653.db2.gz QRXKJJIBUDLRGW-UHFFFAOYSA-N 2 0 370.349 4.452 20 0 FIADRP CC1(C)C[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2cc(F)ccc2O1 ZINC000651949437 1085707008 /nfs/dbraw/zinc/70/70/08/1085707008.db2.gz LJEVUCCQRLMXNU-IBGZPJMESA-N 2 0 355.457 4.082 20 0 FIADRP C[C@@H](NCc1ccncc1OCCC[NH+](C)C)c1ccc(F)cc1Cl ZINC000582809267 1085746348 /nfs/dbraw/zinc/74/63/48/1085746348.db2.gz MTIJHKOMTGMNBT-CQSZACIVSA-N 2 0 365.880 4.055 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000090846583 1085898338 /nfs/dbraw/zinc/89/83/38/1085898338.db2.gz BUPCDTQZWGNQOS-WOJBJXKFSA-N 2 0 366.505 4.246 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347989 1085919093 /nfs/dbraw/zinc/91/90/93/1085919093.db2.gz QTEIBWOQEBOWEA-OYUZRVEBSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347827 1085919453 /nfs/dbraw/zinc/91/94/53/1085919453.db2.gz MVCNFROEBZHNDE-ZFHGCVPZSA-N 2 0 357.325 4.273 20 0 FIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000247133058 1086136548 /nfs/dbraw/zinc/13/65/48/1086136548.db2.gz VQXRRNULMZRFQQ-JYJNAYRXSA-N 2 0 367.603 4.289 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2OC(F)F)[C@@H](C)C1 ZINC000583174402 1086351560 /nfs/dbraw/zinc/35/15/60/1086351560.db2.gz AWZXJHNAOQRLAK-QUJHGWJTSA-N 2 0 352.469 4.353 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290897 1086398102 /nfs/dbraw/zinc/39/81/02/1086398102.db2.gz MPTLDNBMQDCZEE-UYAOXDASSA-N 2 0 371.569 4.157 20 0 FIADRP Clc1ccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)co2)cc1 ZINC000662296003 1086400763 /nfs/dbraw/zinc/40/07/63/1086400763.db2.gz JVAUOHVDEAGNKI-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]CC3)c2ccccc2)cc1 ZINC000662298342 1086401185 /nfs/dbraw/zinc/40/11/85/1086401185.db2.gz BIJBUVAGEDADNU-DEOSSOPVSA-N 2 0 358.485 4.220 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@@H]1CCOC1 ZINC000165552969 1086537337 /nfs/dbraw/zinc/53/73/37/1086537337.db2.gz ONBUONGQEPPASL-PGRDOPGGSA-N 2 0 361.489 4.113 20 0 FIADRP c1csc([C@H](Cc2ccncc2)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000663467042 1086568538 /nfs/dbraw/zinc/56/85/38/1086568538.db2.gz ZFCATSARAAPNIX-UXHICEINSA-N 2 0 355.551 4.139 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(OCc2ccc(F)cc2)CC1 ZINC001167826870 1086616220 /nfs/dbraw/zinc/61/62/20/1086616220.db2.gz RPOLTNHENOPWSM-GOSISDBHSA-N 2 0 350.522 4.317 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@@H]1c1ccc(OC)cc1 ZINC001167827192 1086620842 /nfs/dbraw/zinc/62/08/42/1086620842.db2.gz UQHJDEKRGJYCBQ-FXAWDEMLSA-N 2 0 350.572 4.296 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167833377 1086664745 /nfs/dbraw/zinc/66/47/45/1086664745.db2.gz AMOSSNKZFOOGFR-RTBURBONSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC001167836452 1086710772 /nfs/dbraw/zinc/71/07/72/1086710772.db2.gz DSFJMYNZBMYTLW-HNNXBMFYSA-N 2 0 373.372 4.021 20 0 FIADRP COc1ccccc1[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)C1CCCC1 ZINC000432407067 1086729072 /nfs/dbraw/zinc/72/90/72/1086729072.db2.gz JYTXBMDEGLXHNT-PGRDOPGGSA-N 2 0 360.542 4.017 20 0 FIADRP C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000127562306 1086733787 /nfs/dbraw/zinc/73/37/87/1086733787.db2.gz LJNILNBFIGFADB-ICSRJNTNSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CCCO1 ZINC000432416897 1086742547 /nfs/dbraw/zinc/74/25/47/1086742547.db2.gz JJMHIDIIPOLLET-CRAIPNDOSA-N 2 0 368.974 4.358 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@]2(CCCN2Cc2ccccc2)C1 ZINC001167842374 1086745069 /nfs/dbraw/zinc/74/50/69/1086745069.db2.gz WPVYFNVGUUHCDZ-GMAHTHKFSA-N 2 0 357.586 4.237 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCC[C@H]1[C@H](C(=O)OC)c1ccccc1 ZINC001167842534 1086754425 /nfs/dbraw/zinc/75/44/25/1086754425.db2.gz YJMKLDZTSYWLCP-ILWGZMRPSA-N 2 0 374.569 4.308 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H](C(=O)OC)C[C@@H]1c1ccccc1 ZINC001167842561 1086754648 /nfs/dbraw/zinc/75/46/48/1086754648.db2.gz YKLNLLKBCZTUGG-SESVDKBCSA-N 2 0 360.542 4.123 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc4occc4c3)cc2)C[C@@H](C)O1 ZINC000512089820 1086755056 /nfs/dbraw/zinc/75/50/56/1086755056.db2.gz SZDAUVXDTRZHAS-QZTJIDSGSA-N 2 0 364.489 4.332 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000650706746 1086757534 /nfs/dbraw/zinc/75/75/34/1086757534.db2.gz RRMFKVLRAHMYEY-POAQFYNOSA-N 2 0 374.525 4.273 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)N1CCCC2=C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]21 ZINC001167842927 1086759540 /nfs/dbraw/zinc/75/95/40/1086759540.db2.gz ZRXBEUOXMBUORM-DXVXXHEXSA-N 2 0 373.629 4.392 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCO1 ZINC000657771554 1086797257 /nfs/dbraw/zinc/79/72/57/1086797257.db2.gz CXZHKLKPOZPGPO-BDTNDASRSA-N 2 0 356.554 4.082 20 0 FIADRP COCc1csc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000657772303 1086813072 /nfs/dbraw/zinc/81/30/72/1086813072.db2.gz LPZFQCXEOQLKDM-HXUWFJFHSA-N 2 0 370.562 4.286 20 0 FIADRP CC(C)(C)c1n[nH]cc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657772120 1086814796 /nfs/dbraw/zinc/81/47/96/1086814796.db2.gz ROXDOIQNXJVBMX-FQEVSTJZSA-N 2 0 366.553 4.099 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000650722532 1086819405 /nfs/dbraw/zinc/81/94/05/1086819405.db2.gz WBTIGQRMYLKIHT-LSTHTHJFSA-N 2 0 374.525 4.415 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(C(C)C)cc3)cn2)CC1 ZINC000583775692 1086956413 /nfs/dbraw/zinc/95/64/13/1086956413.db2.gz YUNJAZQFTUBIKR-IBGZPJMESA-N 2 0 366.553 4.198 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(C(C)C)cc3)cn2)CC1 ZINC000583775693 1086956718 /nfs/dbraw/zinc/95/67/18/1086956718.db2.gz YUNJAZQFTUBIKR-LJQANCHMSA-N 2 0 366.553 4.198 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2cccc(Br)c21 ZINC000650753587 1086956845 /nfs/dbraw/zinc/95/68/45/1086956845.db2.gz QNFJQEZOPGYLFW-DIFFPNOSSA-N 2 0 363.274 4.385 20 0 FIADRP Cc1ccccc1NC(=O)CC[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000151140564 1086957148 /nfs/dbraw/zinc/95/71/48/1086957148.db2.gz GCFHDWTXOFXMIM-HXUWFJFHSA-N 2 0 371.569 4.300 20 0 FIADRP Cc1ccccc1NC(=O)CC[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000151140496 1086957419 /nfs/dbraw/zinc/95/74/19/1086957419.db2.gz GCFHDWTXOFXMIM-FQEVSTJZSA-N 2 0 371.569 4.300 20 0 FIADRP CSC1(C[NH2+]Cc2cnc(C3CCCCC3)s2)CC[NH+](C)CC1 ZINC000583782170 1086960336 /nfs/dbraw/zinc/96/03/36/1086960336.db2.gz YDTDQQLPAQBUOG-UHFFFAOYSA-N 2 0 353.601 4.108 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(OC(F)(F)F)c1 ZINC000151167459 1086984120 /nfs/dbraw/zinc/98/41/20/1086984120.db2.gz ICUDQPRDCKNSEZ-AWEZNQCLSA-N 2 0 352.400 4.498 20 0 FIADRP c1coc(COCc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2)c1 ZINC000583928703 1087037863 /nfs/dbraw/zinc/03/78/63/1087037863.db2.gz ABPAVJVBVYFEBO-RJGXRXQPSA-N 2 0 368.521 4.397 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000132622442 1087093870 /nfs/dbraw/zinc/09/38/70/1087093870.db2.gz XTEWCJBDOHTUBE-GOSISDBHSA-N 2 0 352.522 4.057 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000584255488 1087237879 /nfs/dbraw/zinc/23/78/79/1087237879.db2.gz LEQXDEVACRCMLO-GOSISDBHSA-N 2 0 357.517 4.046 20 0 FIADRP CCOc1ccc([C@@H]([NH2+]CCc2cncn2C)c2ccccc2Cl)cc1 ZINC000564748111 1087257528 /nfs/dbraw/zinc/25/75/28/1087257528.db2.gz LQEQLYINVFYNKC-OAQYLSRUSA-N 2 0 369.896 4.394 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CCCCn3ccnc3)cc2cc1OC ZINC000657844594 1087287881 /nfs/dbraw/zinc/28/78/81/1087287881.db2.gz OGVKVUBLEGTLMB-INIZCTEOSA-N 2 0 353.466 4.185 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]C3CC[NH+](CC4CC4)CC3)cc2cc1OC ZINC000657847778 1087294637 /nfs/dbraw/zinc/29/46/37/1087294637.db2.gz ZWUQDQZCRAGAMY-MRXNPFEDSA-N 2 0 368.521 4.382 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)C1CC1 ZINC000091265977 1087426560 /nfs/dbraw/zinc/42/65/60/1087426560.db2.gz FBCHRDXIIGJYMK-HSZRJFAPSA-N 2 0 350.506 4.068 20 0 FIADRP C[C@H]([NH2+][C@@H](c1cnn(C)c1)C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685425672 1087565472 /nfs/dbraw/zinc/56/54/72/1087565472.db2.gz UWVSWOSKRAWNSB-CUWPLCDZSA-N 2 0 354.542 4.008 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000708567391 1087586795 /nfs/dbraw/zinc/58/67/95/1087586795.db2.gz AYRDENNWAUIKEL-QTEQDKRBSA-N 2 0 366.549 4.374 20 0 FIADRP CCCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000062426804 1087599680 /nfs/dbraw/zinc/59/96/80/1087599680.db2.gz CKHASMDEQKVABT-JOCHJYFZSA-N 2 0 352.522 4.477 20 0 FIADRP COc1cccc(C2(C[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000685655479 1087660218 /nfs/dbraw/zinc/66/02/18/1087660218.db2.gz RBSSEGSCPUNFKV-FPOVZHCZSA-N 2 0 364.533 4.227 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)cc2cc1OC ZINC000657993957 1087694335 /nfs/dbraw/zinc/69/43/35/1087694335.db2.gz OOKKNEHKCYTJOR-MRXNPFEDSA-N 2 0 368.521 4.382 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCc2noc4ccccc24)C3)cc1 ZINC000658064669 1087705533 /nfs/dbraw/zinc/70/55/33/1087705533.db2.gz FZCDLLMTKDWROW-ACDBMABISA-N 2 0 361.489 4.156 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067786 1087709995 /nfs/dbraw/zinc/70/99/95/1087709995.db2.gz QTCLMCFJIMRPMH-KRWDZBQOSA-N 2 0 362.583 4.340 20 0 FIADRP Cc1cc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CC2)ccc1F ZINC000658066602 1087710111 /nfs/dbraw/zinc/71/01/11/1087710111.db2.gz CLBQMOIEKOOQMS-JOCHJYFZSA-N 2 0 360.517 4.066 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)C2CCC2)cc1 ZINC000658141949 1087734163 /nfs/dbraw/zinc/73/41/63/1087734163.db2.gz YCMFBMKFLKGGMI-ZEQRLZLVSA-N 2 0 364.533 4.193 20 0 FIADRP CCCC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccccc1 ZINC000658141741 1087734331 /nfs/dbraw/zinc/73/43/31/1087734331.db2.gz UKWXQBOTAHKLDG-PKTZIBPZSA-N 2 0 352.522 4.274 20 0 FIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658139909 1087743376 /nfs/dbraw/zinc/74/33/76/1087743376.db2.gz NZXVBPPOEODDBD-XLIONFOSSA-N 2 0 364.489 4.159 20 0 FIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658139907 1087743707 /nfs/dbraw/zinc/74/37/07/1087743707.db2.gz NZXVBPPOEODDBD-FXAWDEMLSA-N 2 0 364.489 4.159 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1nccc2ccccc21 ZINC000658164871 1087759433 /nfs/dbraw/zinc/75/94/33/1087759433.db2.gz GDNHNTDIPRXPOF-GOSISDBHSA-N 2 0 360.505 4.193 20 0 FIADRP Cc1cccc(CC[C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000658166841 1087762281 /nfs/dbraw/zinc/76/22/81/1087762281.db2.gz PZVKALCQWSMXOH-FQEVSTJZSA-N 2 0 351.538 4.213 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168879 1087764494 /nfs/dbraw/zinc/76/44/94/1087764494.db2.gz ZWFAEHZMUMCAGT-KRWDZBQOSA-N 2 0 355.551 4.366 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000424134871 1087785488 /nfs/dbraw/zinc/78/54/88/1087785488.db2.gz OEDPMICLQUUYQC-RTBURBONSA-N 2 0 354.542 4.232 20 0 FIADRP CCC1(C[NH2+]Cc2cncn2C(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000424158118 1087813989 /nfs/dbraw/zinc/81/39/89/1087813989.db2.gz OGQNQQVOLCYRBM-UHFFFAOYSA-N 2 0 354.542 4.246 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC(C)(C)c2cccnc2)CC1 ZINC000414342589 1087908463 /nfs/dbraw/zinc/90/84/63/1087908463.db2.gz XIYMKTHTQTZANH-UHFFFAOYSA-N 2 0 351.538 4.392 20 0 FIADRP C[C@@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518888 1087916563 /nfs/dbraw/zinc/91/65/63/1087916563.db2.gz LEERLPGVMBDCHA-RRENTHDGSA-N 2 0 364.574 4.130 20 0 FIADRP Cc1cc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)ccc1Oc1cccnc1 ZINC000424372402 1087961653 /nfs/dbraw/zinc/96/16/53/1087961653.db2.gz FNOUXPVWBVFKAH-SFHVURJKSA-N 2 0 351.494 4.146 20 0 FIADRP COc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(C(F)(F)F)c1 ZINC001143478455 1088189370 /nfs/dbraw/zinc/18/93/70/1088189370.db2.gz DYZYNKSEGFNIHH-UHFFFAOYSA-N 2 0 358.448 4.266 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Cl)c(Br)c2)cc1 ZINC000414811671 1088192887 /nfs/dbraw/zinc/19/28/87/1088192887.db2.gz QGLNYFAHENMGSF-NSHDSACASA-N 2 0 353.691 4.412 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000311099966 1088231075 /nfs/dbraw/zinc/23/10/75/1088231075.db2.gz HYLKCCLDMQPZMT-MVCQKVDPSA-N 2 0 367.578 4.017 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(C)CC[NH+](C(C)C)C(C)C)cc1)C(C)C ZINC000505349025 1088357227 /nfs/dbraw/zinc/35/72/27/1088357227.db2.gz BUSSVVCOWMLHBQ-UHFFFAOYSA-N 2 0 361.574 4.108 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000514093589 1088739595 /nfs/dbraw/zinc/73/95/95/1088739595.db2.gz JTYISLIFZNNKKL-CVDCTZTESA-N 2 0 367.537 4.228 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000514097757 1088767312 /nfs/dbraw/zinc/76/73/12/1088767312.db2.gz AUEJDGLTQHWANE-VQSBYGRUSA-N 2 0 360.546 4.084 20 0 FIADRP CCO[C@H](C)c1nc(CN2CCC(c3ncc4n3CCCC4)CC2)cs1 ZINC000434675413 1088941741 /nfs/dbraw/zinc/94/17/41/1088941741.db2.gz YPNGIOPKGIZDPO-OAHLLOKOSA-N 2 0 374.554 4.153 20 0 FIADRP CO[C@H](C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000514248770 1088944518 /nfs/dbraw/zinc/94/45/18/1088944518.db2.gz VOJSUKMCJHGUSZ-WRWLIDTKSA-N 2 0 350.934 4.270 20 0 FIADRP COc1ccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c(C(F)(F)F)c1 ZINC001143485157 1088964929 /nfs/dbraw/zinc/96/49/29/1088964929.db2.gz WNNXMSBQBWWOHS-UHFFFAOYSA-N 2 0 356.432 4.022 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000415015991 1089043483 /nfs/dbraw/zinc/04/34/83/1089043483.db2.gz ORWSQMSVOMHECR-HNNXBMFYSA-N 2 0 359.901 4.199 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)ccc1OCc1ccc(Cl)cc1 ZINC000415041009 1089078769 /nfs/dbraw/zinc/07/87/69/1089078769.db2.gz PJFARCVDZAIBQX-APWZRJJASA-N 2 0 374.912 4.145 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)ccc1OCc1ccc(Cl)cc1 ZINC000415041012 1089079983 /nfs/dbraw/zinc/07/99/83/1089079983.db2.gz PJFARCVDZAIBQX-VQIMIIECSA-N 2 0 374.912 4.145 20 0 FIADRP COc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415044272 1089081488 /nfs/dbraw/zinc/08/14/88/1089081488.db2.gz BONQTDIOCGJRDG-KRWDZBQOSA-N 2 0 363.299 4.028 20 0 FIADRP C[C@H](CC(=O)Nc1cccc(Cl)c1)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415057607 1089094244 /nfs/dbraw/zinc/09/42/44/1089094244.db2.gz RTWUPNPNYHSRKC-DNVCBOLYSA-N 2 0 359.901 4.127 20 0 FIADRP COc1sc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415057254 1089101164 /nfs/dbraw/zinc/10/11/64/1089101164.db2.gz RONJDIAHSXNFEC-HNNXBMFYSA-N 2 0 369.328 4.089 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1OCC ZINC000414857893 1089133349 /nfs/dbraw/zinc/13/33/49/1089133349.db2.gz QKUDYQVAFHDUDS-GOEBONIOSA-N 2 0 354.922 4.005 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCN[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000415095979 1089152110 /nfs/dbraw/zinc/15/21/10/1089152110.db2.gz AEBMWSMYHXMXKI-LPIJFZEYSA-N 2 0 355.570 4.112 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](CCCc3c(Cl)cccc3Cl)CC2)C1 ZINC000415120811 1089185019 /nfs/dbraw/zinc/18/50/19/1089185019.db2.gz HBBCEVQHWLLUHT-DNVCBOLYSA-N 2 0 371.352 4.144 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)C1 ZINC000415129586 1089192060 /nfs/dbraw/zinc/19/20/60/1089192060.db2.gz VFXSBRGNRYBAOK-QUCCMNQESA-N 2 0 374.525 4.273 20 0 FIADRP C[C@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000415127879 1089192866 /nfs/dbraw/zinc/19/28/66/1089192866.db2.gz IURLJQAFZHXQLE-GOSISDBHSA-N 2 0 371.956 4.027 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000415130704 1089198035 /nfs/dbraw/zinc/19/80/35/1089198035.db2.gz RKNOUGRCDCXFGC-PKTZIBPZSA-N 2 0 350.506 4.072 20 0 FIADRP CCOC[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549235838 1089315218 /nfs/dbraw/zinc/31/52/18/1089315218.db2.gz OYWGTUJRHNWNGU-XMMBUWISSA-N 2 0 350.934 4.269 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000514888564 1089576351 /nfs/dbraw/zinc/57/63/51/1089576351.db2.gz SMESYJKQJJUKNJ-HXUWFJFHSA-N 2 0 373.928 4.233 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H]1C(=O)Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC001625891372 1089757723 /nfs/dbraw/zinc/75/77/23/1089757723.db2.gz HGGKQQIHKCNGEN-RXVVDRJESA-N 2 0 357.542 4.120 20 0 FIADRP CC[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC000435629937 1089817840 /nfs/dbraw/zinc/81/78/40/1089817840.db2.gz VUHWWVJXWXBTLX-HXUWFJFHSA-N 2 0 365.521 4.146 20 0 FIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)CCC2 ZINC000284342875 1089834152 /nfs/dbraw/zinc/83/41/52/1089834152.db2.gz LSEZUDNGYBJHNM-IBGZPJMESA-N 2 0 371.550 4.092 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000236809619 1089975499 /nfs/dbraw/zinc/97/54/99/1089975499.db2.gz AXRWWUJUPPKNLF-CYBMUJFWSA-N 2 0 355.309 4.091 20 0 FIADRP Brc1ccc([C@H]([NH2+]CCn2ccnc2)c2ccccc2)cc1 ZINC000188097822 1090168777 /nfs/dbraw/zinc/16/87/77/1090168777.db2.gz OZZQBBVBOKGMNB-GOSISDBHSA-N 2 0 356.267 4.025 20 0 FIADRP CC[C@@H](c1ccccc1)[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)CC(C)C ZINC000511555976 1090396398 /nfs/dbraw/zinc/39/63/98/1090396398.db2.gz DUQUFJAXEHABQP-QFIPXVFZSA-N 2 0 373.585 4.085 20 0 FIADRP CC(C)(C)[C@@H](Cn1ccnc1)[NH2+][C@@H]1CCc2ccc(Br)cc21 ZINC000319351094 1091118030 /nfs/dbraw/zinc/11/80/30/1091118030.db2.gz MUBZAYWLCKKPLW-IAGOWNOFSA-N 2 0 362.315 4.337 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCCc3cc(F)ccc32)cc1 ZINC000500244696 1091146731 /nfs/dbraw/zinc/14/67/31/1091146731.db2.gz ROFMTMKIKBGHPT-QFIPXVFZSA-N 2 0 356.485 4.323 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000390559315 1091252068 /nfs/dbraw/zinc/25/20/68/1091252068.db2.gz AHFRZXFAWKDHTJ-LUQQLXLSSA-N 2 0 362.517 4.468 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000311395651 1091418349 /nfs/dbraw/zinc/41/83/49/1091418349.db2.gz OVWADUDAWLKEAT-WMZHIEFXSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCOc2ccc(F)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011718 1092207848 /nfs/dbraw/zinc/20/78/48/1092207848.db2.gz RNJYFLZXQLYKCK-RMFSNUHRSA-N 2 0 356.485 4.236 20 0 FIADRP CCCc1nc(C)c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428236206 1092305097 /nfs/dbraw/zinc/30/50/97/1092305097.db2.gz GOZYFIWTOFWOEB-FXAWDEMLSA-N 2 0 355.526 4.420 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cc1 ZINC000509528778 1092334551 /nfs/dbraw/zinc/33/45/51/1092334551.db2.gz WKXRRGXPACETNV-UHFFFAOYSA-N 2 0 368.550 4.280 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2cccc(C[NH+](C)C)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012414 1092336013 /nfs/dbraw/zinc/33/60/13/1092336013.db2.gz ZRCKQGVIRGEAFC-WOJBJXKFSA-N 3 0 365.565 4.279 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccccc2Br)C1 ZINC000520949773 1092376134 /nfs/dbraw/zinc/37/61/34/1092376134.db2.gz PZVLOTNAJKYSPM-IYBDPMFKSA-N 2 0 353.348 4.297 20 0 FIADRP C[C@@H]1CC(NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014110 1092675133 /nfs/dbraw/zinc/67/51/33/1092675133.db2.gz KABPCMNFRVRFFP-REHUZNOOSA-N 2 0 365.565 4.321 20 0 FIADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000442777666 1092758126 /nfs/dbraw/zinc/75/81/26/1092758126.db2.gz DRSDRNILTBDASW-UQPPLGOBSA-N 2 0 369.475 4.052 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]C2CCC(C(F)F)CC2)C[C@H](C)O1 ZINC000442789614 1092767638 /nfs/dbraw/zinc/76/76/38/1092767638.db2.gz YKLCNJZLBOSMCQ-HLVUACMISA-N 2 0 366.496 4.209 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000521643319 1092822461 /nfs/dbraw/zinc/82/24/61/1092822461.db2.gz BYOWAXLIJFYULI-IBGZPJMESA-N 2 0 366.553 4.171 20 0 FIADRP C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110430637 1092876110 /nfs/dbraw/zinc/87/61/10/1092876110.db2.gz BBUSTTIOUWKNMR-ZACQAIPSSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@@H]1C[C@@H](N2C[C@H](CC[NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014920 1092901116 /nfs/dbraw/zinc/90/11/16/1092901116.db2.gz NHOCLRSBQCZDSY-MXNKGDRCSA-N 2 0 363.549 4.381 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)C[N@@H+]1Cc1ccccc1 ZINC000474039832 1092950985 /nfs/dbraw/zinc/95/09/85/1092950985.db2.gz TWOLZINXHHLXJL-SQDZQZBLSA-N 2 0 370.581 4.472 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(Cn3ccnc3)cc1)CCC2 ZINC000152107337 1092994368 /nfs/dbraw/zinc/99/43/68/1092994368.db2.gz VMRGYOHSOPZSAA-KRWDZBQOSA-N 2 0 352.507 4.118 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]Cc1ccc(Cn3ccnc3)cc1)CCC2 ZINC000152107254 1092994407 /nfs/dbraw/zinc/99/44/07/1092994407.db2.gz VMRGYOHSOPZSAA-QGZVFWFLSA-N 2 0 352.507 4.118 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015284 1092998061 /nfs/dbraw/zinc/99/80/61/1092998061.db2.gz QMDRBHSAFFVSEB-HKBOAZHASA-N 2 0 357.586 4.282 20 0 FIADRP c1cn(-c2csc(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)c2)cn1 ZINC000544351859 1093036377 /nfs/dbraw/zinc/03/63/77/1093036377.db2.gz YKOOBYZTAOHWOL-GOSISDBHSA-N 2 0 358.555 4.022 20 0 FIADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512660447 1093096446 /nfs/dbraw/zinc/09/64/46/1093096446.db2.gz NGNBYEBUKUSXJH-YPAWHYETSA-N 2 0 358.570 4.066 20 0 FIADRP Cc1cc(C(F)(F)F)ccc1C[NH+]1CCC(Cc2nccn2C)CC1 ZINC000443415505 1093109716 /nfs/dbraw/zinc/10/97/16/1093109716.db2.gz IIJBZTVNVTZLLC-UHFFFAOYSA-N 2 0 351.416 4.202 20 0 FIADRP COc1c2ccccc2oc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000474074162 1093188261 /nfs/dbraw/zinc/18/82/61/1093188261.db2.gz PSUPNMORYLGMSW-MRXNPFEDSA-N 2 0 368.477 4.233 20 0 FIADRP Oc1cccc2sc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)cc21 ZINC000895252117 1093248703 /nfs/dbraw/zinc/24/87/03/1093248703.db2.gz VUKQKJASHSFKNG-UHFFFAOYSA-N 2 0 367.518 4.004 20 0 FIADRP CO[C@@H](C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccccc1 ZINC000433128125 1093311057 /nfs/dbraw/zinc/31/10/57/1093311057.db2.gz KTYZPPAWKGELJD-QHCPKHFHSA-N 2 0 364.533 4.362 20 0 FIADRP COC(=O)CC1([NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CCCCC1 ZINC001168028841 1093543231 /nfs/dbraw/zinc/54/32/31/1093543231.db2.gz QPXHVFUEEYSVMY-RTBURBONSA-N 2 0 372.553 4.284 20 0 FIADRP CC(C)C[NH+]1CCC(NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168031232 1093615986 /nfs/dbraw/zinc/61/59/86/1093615986.db2.gz YEFZJPMZTYLZBF-PMACEKPBSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)Cc2ccccn2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032461 1093654923 /nfs/dbraw/zinc/65/49/23/1093654923.db2.gz GKSQEXZNSHZJBV-HATOLVCRSA-N 2 0 351.538 4.434 20 0 FIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000513019863 1093665427 /nfs/dbraw/zinc/66/54/27/1093665427.db2.gz INYIQCBNHFAVCB-KZLRIVJYSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@H]1CC(N2CCC([NH3+])(CC3CC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032594 1093667221 /nfs/dbraw/zinc/66/72/21/1093667221.db2.gz IEZNBJONXZAFSD-OALUTQOASA-N 3 0 355.570 4.021 20 0 FIADRP c1ccc(CC[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000639363234 1093695896 /nfs/dbraw/zinc/69/58/96/1093695896.db2.gz NNWDYISOUJQRMV-XMMPIXPASA-N 2 0 372.516 4.409 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000513060656 1093712870 /nfs/dbraw/zinc/71/28/70/1093712870.db2.gz YVQILFLMFBHBHO-WZONZLPQSA-N 2 0 351.538 4.410 20 0 FIADRP CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C1 ZINC000474469306 1093806004 /nfs/dbraw/zinc/80/60/04/1093806004.db2.gz CFKAJFIALSXAPM-VXKWHMMOSA-N 2 0 358.570 4.338 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccnn2-c2ccc(F)cc2)cc1 ZINC000474475334 1093821273 /nfs/dbraw/zinc/82/12/73/1093821273.db2.gz VGZGZZWDXCXXIB-UHFFFAOYSA-N 2 0 366.484 4.143 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000474480204 1093825965 /nfs/dbraw/zinc/82/59/65/1093825965.db2.gz ZOMDBWKNXGJTCK-OTWHNJEPSA-N 2 0 362.558 4.440 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2cccc(C[NH+](CC)CC)c2)CC1 ZINC000474490764 1093841299 /nfs/dbraw/zinc/84/12/99/1093841299.db2.gz OVIPMJIHVCMXIZ-UHFFFAOYSA-N 2 0 360.542 4.130 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H](C)C3)cc12 ZINC000894180026 1093889869 /nfs/dbraw/zinc/88/98/69/1093889869.db2.gz YEXIYIHQBNSVDW-MRXNPFEDSA-N 2 0 364.493 4.053 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@H](C)C3)cc12 ZINC000894180025 1093890196 /nfs/dbraw/zinc/89/01/96/1093890196.db2.gz YEXIYIHQBNSVDW-INIZCTEOSA-N 2 0 364.493 4.053 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000509924760 1094023666 /nfs/dbraw/zinc/02/36/66/1094023666.db2.gz DKIQDUKFMVKOOX-UHFFFAOYSA-N 2 0 359.539 4.428 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1F ZINC000513494100 1094162396 /nfs/dbraw/zinc/16/23/96/1094162396.db2.gz FWRQSVDBGWEFFI-PXNSSMCTSA-N 2 0 356.485 4.225 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513500014 1094172913 /nfs/dbraw/zinc/17/29/13/1094172913.db2.gz KKGFZXOORXKSNV-PGRDOPGGSA-N 2 0 365.521 4.035 20 0 FIADRP CC(=O)Nc1ccccc1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513501973 1094174195 /nfs/dbraw/zinc/17/41/95/1094174195.db2.gz WEFQSXYXOKQWTE-RXVVDRJESA-N 2 0 365.521 4.035 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H](Cc2ccccn2)c2cccnc2)C1 ZINC000513524796 1094197662 /nfs/dbraw/zinc/19/76/62/1094197662.db2.gz ICGRAOSTCBLBHQ-MZKRTTBSSA-N 2 0 366.553 4.108 20 0 FIADRP COc1ccc(OC)c(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513544618 1094206097 /nfs/dbraw/zinc/20/60/97/1094206097.db2.gz KKUNSNOPXMVSRL-QUCCMNQESA-N 2 0 368.521 4.094 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000513545952 1094206600 /nfs/dbraw/zinc/20/66/00/1094206600.db2.gz UIFPMNYCMGPIBR-UDHFWRKXSA-N 2 0 362.945 4.101 20 0 FIADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000513679424 1094264026 /nfs/dbraw/zinc/26/40/26/1094264026.db2.gz WZYLSPHOLSKMCZ-OKKOYFSCSA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000501007335 1094416695 /nfs/dbraw/zinc/41/66/95/1094416695.db2.gz KYXJXEPMVPXNSV-OAQYLSRUSA-N 2 0 363.565 4.309 20 0 FIADRP Cc1ccccc1OCCC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501018789 1094437142 /nfs/dbraw/zinc/43/71/42/1094437142.db2.gz GSNQLCDCSVDTOB-UHFFFAOYSA-N 2 0 353.510 4.007 20 0 FIADRP C[C@H]1CC(N2CCC([NH+]3CCCCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039012 1094438914 /nfs/dbraw/zinc/43/89/14/1094438914.db2.gz AVPLUEQLBQFJNB-SFTDATJTSA-N 2 0 369.597 4.378 20 0 FIADRP C[N@@H+](Cc1cc(-c2cccs2)on1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501045473 1094451822 /nfs/dbraw/zinc/45/18/22/1094451822.db2.gz MVYLZIRXZMBDFD-UHFFFAOYSA-N 2 0 368.506 4.147 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)CC1 ZINC000501060562 1094472089 /nfs/dbraw/zinc/47/20/89/1094472089.db2.gz SWOGLLIRKPSECI-DUXKGJEZSA-N 2 0 363.977 4.043 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)CC1 ZINC000501060563 1094473085 /nfs/dbraw/zinc/47/30/85/1094473085.db2.gz SWOGLLIRKPSECI-JRGCBEDISA-N 2 0 363.977 4.043 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000501063681 1094473797 /nfs/dbraw/zinc/47/37/97/1094473797.db2.gz KLXLFZAEKUTMLE-YLJYHZDGSA-N 2 0 372.553 4.385 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]CC3=Cc4ccccc4OC3)CC2)c1 ZINC000102425639 1094542705 /nfs/dbraw/zinc/54/27/05/1094542705.db2.gz GSCOROHZEPVBOQ-UHFFFAOYSA-N 2 0 354.519 4.026 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]C[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000474811462 1094634660 /nfs/dbraw/zinc/63/46/60/1094634660.db2.gz ROVAOZNXIRUJQA-SKWUIDRYSA-N 2 0 370.459 4.103 20 0 FIADRP CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C1 ZINC000474802704 1094636507 /nfs/dbraw/zinc/63/65/07/1094636507.db2.gz YXLIWOFOMBLQEF-DENIHFKCSA-N 2 0 358.570 4.338 20 0 FIADRP COCCC[NH+]1CCC([NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)CC1 ZINC000501469640 1094723124 /nfs/dbraw/zinc/72/31/24/1094723124.db2.gz VWESEICIUSXBAJ-JQIJEIRASA-N 2 0 370.459 4.199 20 0 FIADRP COCCC[NH+]1CCC([NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)CC1 ZINC000501469641 1094723989 /nfs/dbraw/zinc/72/39/89/1094723989.db2.gz VWESEICIUSXBAJ-PEZBUJJGSA-N 2 0 370.459 4.199 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000474876636 1094839738 /nfs/dbraw/zinc/83/97/38/1094839738.db2.gz DPIRSMLFCTXFEJ-QRVBRYPASA-N 2 0 362.558 4.153 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](CCCSc3ccccc3Cl)CC2)C1 ZINC000420383127 1094907293 /nfs/dbraw/zinc/90/72/93/1094907293.db2.gz FDCUYIIJKXPWCV-FUHWJXTLSA-N 2 0 368.974 4.041 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2ccc(F)c(F)c2)CC1 ZINC000501785174 1094924590 /nfs/dbraw/zinc/92/45/90/1094924590.db2.gz KLTCLLDLSBZQPY-INIZCTEOSA-N 2 0 354.485 4.096 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474943877 1094938850 /nfs/dbraw/zinc/93/88/50/1094938850.db2.gz OEHLVGQEIDGUOR-JLHGSKIFSA-N 2 0 372.940 4.188 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421370143 1095567948 /nfs/dbraw/zinc/56/79/48/1095567948.db2.gz JDFWLJLPLDNFLJ-UHFFFAOYSA-N 2 0 360.933 4.105 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cn(C3CCCC3)nc2-c2ccccn2)CC1 ZINC000421370415 1095568991 /nfs/dbraw/zinc/56/89/91/1095568991.db2.gz IQITZOQZISWRGB-UHFFFAOYSA-N 2 0 367.541 4.023 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cccc(C4CC4)c3)cc2)CC1 ZINC000421355883 1095582702 /nfs/dbraw/zinc/58/27/02/1095582702.db2.gz JXKKLWVTRYNXNE-UHFFFAOYSA-N 2 0 350.506 4.327 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cnc(C(F)(F)F)s3)CC2)CC1 ZINC000444000881 1095596661 /nfs/dbraw/zinc/59/66/61/1095596661.db2.gz GIXJUAKZPSKQKD-UHFFFAOYSA-N 2 0 361.477 4.295 20 0 FIADRP COCc1ccccc1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000513759555 1095913407 /nfs/dbraw/zinc/91/34/07/1095913407.db2.gz GGUTUBLUKRLCGI-UHFFFAOYSA-N 2 0 352.522 4.366 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000324585886 1095915571 /nfs/dbraw/zinc/91/55/71/1095915571.db2.gz YRZKDYPDKMPRKT-RTBURBONSA-N 2 0 372.384 4.306 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CC24CCSCC4)C3)cc1 ZINC000421872280 1095980648 /nfs/dbraw/zinc/98/06/48/1095980648.db2.gz GNLOTSVIFWUHJK-XSDIEEQYSA-N 2 0 356.579 4.305 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000421873755 1095982265 /nfs/dbraw/zinc/98/22/65/1095982265.db2.gz IFCBONMMTUQQFM-ZUEPYMLJSA-N 2 0 357.361 4.424 20 0 FIADRP CC(C[NH+](C)C[C@H](C)c1nccs1)C[N@H+](C)C[C@H](C)c1nccs1 ZINC000273087628 1096233260 /nfs/dbraw/zinc/23/32/60/1096233260.db2.gz SBTZFADDVNQVQG-HOTGVXAUSA-N 2 0 366.600 4.007 20 0 FIADRP COc1ccccc1-c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000414647691 1096331942 /nfs/dbraw/zinc/33/19/42/1096331942.db2.gz AARIUIWFUPREDN-QFIPXVFZSA-N 2 0 350.506 4.326 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000422701935 1096455987 /nfs/dbraw/zinc/45/59/87/1096455987.db2.gz JNTNNCGMGAYPQS-ZDUSSCGKSA-N 2 0 363.427 4.250 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C(C)(C)c1ccccc1 ZINC000422703566 1096457925 /nfs/dbraw/zinc/45/79/25/1096457925.db2.gz IDIWDYDPHABNNX-KPDCDPCYSA-N 2 0 350.506 4.198 20 0 FIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422732374 1096465648 /nfs/dbraw/zinc/46/56/48/1096465648.db2.gz PTEPOLOLCITCRB-RBUKOAKNSA-N 2 0 370.368 4.207 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000422736269 1096476296 /nfs/dbraw/zinc/47/62/96/1096476296.db2.gz GEEWHJCEEHIFFU-YMVOAIQMSA-N 2 0 355.345 4.092 20 0 FIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422776065 1096488687 /nfs/dbraw/zinc/48/86/87/1096488687.db2.gz CBDHJEJFHPHNTB-MJGOQNOKSA-N 2 0 362.395 4.051 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422778494 1096489280 /nfs/dbraw/zinc/48/92/80/1096489280.db2.gz AQMHRVPXUANCCB-CQSZACIVSA-N 2 0 367.415 4.500 20 0 FIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000503595115 1096489763 /nfs/dbraw/zinc/48/97/63/1096489763.db2.gz WCXOONWLZMGRPA-MRXNPFEDSA-N 2 0 370.459 4.201 20 0 FIADRP c1sc(-c2ccccc2)nc1CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422781370 1096489907 /nfs/dbraw/zinc/48/99/07/1096489907.db2.gz IQTQXJMKTIUZNT-VAMGGRTRSA-N 2 0 355.551 4.253 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@H](Cc3ccccc3)[C@H](C)[NH3+])s2)cs1 ZINC000422796990 1096493573 /nfs/dbraw/zinc/49/35/73/1096493573.db2.gz KUQUIIJKMMNFRF-KBXCAEBGSA-N 2 0 371.575 4.271 20 0 FIADRP COc1cccc([C@H]([NH2+][C@H](C)CCCC[NH3+])c2cc(F)ccc2OC)c1 ZINC000422824996 1096500806 /nfs/dbraw/zinc/50/08/06/1096500806.db2.gz OVODNMHTDWURLX-VFNWGFHPSA-N 2 0 360.473 4.039 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)c(Cl)c1 ZINC000422832271 1096501606 /nfs/dbraw/zinc/50/16/06/1096501606.db2.gz FLSBEFUFSSFPCA-ZTFGCOKTSA-N 2 0 371.352 4.018 20 0 FIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422840928 1096502836 /nfs/dbraw/zinc/50/28/36/1096502836.db2.gz CIOIEOLNEXVBLE-UEXGIBASSA-N 2 0 370.493 4.208 20 0 FIADRP CCCOc1cc(C)ccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422863301 1096506586 /nfs/dbraw/zinc/50/65/86/1096506586.db2.gz RRTGNARVBGWFDB-NZQKXSOJSA-N 2 0 366.505 4.129 20 0 FIADRP Cc1ccccc1Oc1ccccc1C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000422860772 1096507045 /nfs/dbraw/zinc/50/70/45/1096507045.db2.gz MYQWPZBRWLYVOC-QHAWAJNXSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(OC(F)F)c1 ZINC000422876598 1096509841 /nfs/dbraw/zinc/50/98/41/1096509841.db2.gz GMTRUSIWBWJSRR-DHUIEDIVSA-N 2 0 374.431 4.195 20 0 FIADRP c1ccc(SC2(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422911331 1096521266 /nfs/dbraw/zinc/52/12/66/1096521266.db2.gz STNUIQFGXMMGJW-FPOVZHCZSA-N 2 0 366.530 4.157 20 0 FIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@H](C)CCCC[NH3+])c(C(F)(F)F)c2)n1 ZINC000422907567 1096521586 /nfs/dbraw/zinc/52/15/86/1096521586.db2.gz XCILMOPEHKCQOR-CYBMUJFWSA-N 2 0 368.447 4.115 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000422927347 1096527538 /nfs/dbraw/zinc/52/75/38/1096527538.db2.gz GFWUUDSXZLFIMN-VXGBXAGGSA-N 2 0 353.388 4.159 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000422936963 1096528988 /nfs/dbraw/zinc/52/89/88/1096528988.db2.gz NJCTZPFMTPGZIA-CHWSQXEVSA-N 2 0 351.416 4.149 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000422934841 1096529273 /nfs/dbraw/zinc/52/92/73/1096529273.db2.gz KGOHPKOMXRNNIN-APWZRJJASA-N 2 0 367.320 4.426 20 0 FIADRP c1sc2ccccc2c1CC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422938454 1096530164 /nfs/dbraw/zinc/53/01/64/1096530164.db2.gz POXNKGCIXNLWSC-SIKLNZKXSA-N 2 0 364.514 4.289 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1cccs1)c1ccc2c(c1)CCCC2 ZINC000422963406 1096534064 /nfs/dbraw/zinc/53/40/64/1096534064.db2.gz IMIFUKQMDMXHIC-CTNGQTDRSA-N 2 0 358.551 4.060 20 0 FIADRP CC(C)(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422945131 1096535454 /nfs/dbraw/zinc/53/54/54/1096535454.db2.gz MOSZHARRPGHZQR-YPAWHYETSA-N 2 0 370.581 4.153 20 0 FIADRP Clc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422947455 1096537215 /nfs/dbraw/zinc/53/72/15/1096537215.db2.gz QDCLOUHFSAEJKS-WAOWUJCRSA-N 2 0 370.880 4.009 20 0 FIADRP Clc1cccc(C2([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000422948582 1096537233 /nfs/dbraw/zinc/53/72/33/1096537233.db2.gz SNORQNICOFHRJP-UYAOXDASSA-N 2 0 354.881 4.175 20 0 FIADRP c1sc(CCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)nc1-c1ccncc1 ZINC000422956889 1096538745 /nfs/dbraw/zinc/53/87/45/1096538745.db2.gz RHGWZVGQSAHWJU-IPMKNSEASA-N 2 0 370.566 4.038 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422976916 1096543832 /nfs/dbraw/zinc/54/38/32/1096543832.db2.gz WAHXXKHKWNDWOZ-SFYKDHMMSA-N 2 0 366.505 4.447 20 0 FIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)OC(C)C ZINC000423047332 1096553174 /nfs/dbraw/zinc/55/31/74/1096553174.db2.gz GCYXKLXWKZRVBT-RYTRXMBJSA-N 2 0 360.542 4.062 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1 ZINC000423023960 1096554256 /nfs/dbraw/zinc/55/42/56/1096554256.db2.gz KXQCIUBCTZUJBQ-JOQOYGCGSA-N 2 0 371.352 4.147 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000423034224 1096556313 /nfs/dbraw/zinc/55/63/13/1096556313.db2.gz PPDUXJNMSKIYBD-LPHOPBHVSA-N 2 0 367.320 4.426 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](CC(F)(F)F)c2ccc(Br)cc2)CC1 ZINC000423042458 1096558412 /nfs/dbraw/zinc/55/84/12/1096558412.db2.gz ZHICFBRTQIQZGG-RUXDESIVSA-N 2 0 365.237 4.302 20 0 FIADRP C[NH+](C)[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000423057464 1096559750 /nfs/dbraw/zinc/55/97/50/1096559750.db2.gz ZVGBGKKAMFBRFC-CEXWTWQISA-N 2 0 363.427 4.043 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000423066298 1096561871 /nfs/dbraw/zinc/56/18/71/1096561871.db2.gz DKISOPDDMPOEMF-GGAORHGYSA-N 2 0 366.505 4.129 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2cccc(F)c2o1 ZINC000423074849 1096563934 /nfs/dbraw/zinc/56/39/34/1096563934.db2.gz VSDXUXQRRJLTIQ-OHOGDBNVSA-N 2 0 366.436 4.478 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423100983 1096575751 /nfs/dbraw/zinc/57/57/51/1096575751.db2.gz NFYKKZKXGFFJOD-UQASEVPWSA-N 2 0 354.519 4.315 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423115403 1096576617 /nfs/dbraw/zinc/57/66/17/1096576617.db2.gz NFYKKZKXGFFJOD-FPDPHYFHSA-N 2 0 354.519 4.315 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423115404 1096576777 /nfs/dbraw/zinc/57/67/77/1096576777.db2.gz NFYKKZKXGFFJOD-FQELHTAISA-N 2 0 354.519 4.315 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]C1CCC(c2ccc(C(C)(C)C)cc2)CC1 ZINC000423115668 1096577986 /nfs/dbraw/zinc/57/79/86/1096577986.db2.gz YGUUZKOJTFJWEU-HSQRAOAYSA-N 2 0 358.570 4.352 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423122574 1096578630 /nfs/dbraw/zinc/57/86/30/1096578630.db2.gz KAOPENDUCRXMCZ-HOTGVXAUSA-N 2 0 362.477 4.448 20 0 FIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC000423123980 1096580229 /nfs/dbraw/zinc/58/02/29/1096580229.db2.gz NUAZONLUVXHSEW-WJFTUGDTSA-N 2 0 354.460 4.308 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423130110 1096580867 /nfs/dbraw/zinc/58/08/67/1096580867.db2.gz MIZCHZCUZFBLKG-TYPHKJRUSA-N 2 0 358.913 4.315 20 0 FIADRP Clc1ccc([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)OCc2ccccc2)cc1 ZINC000423131086 1096581516 /nfs/dbraw/zinc/58/15/16/1096581516.db2.gz NPMOJHVUHTUFNL-PJEZACDQSA-N 2 0 370.924 4.471 20 0 FIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106550 1096582412 /nfs/dbraw/zinc/58/24/12/1096582412.db2.gz ZZOXYBCMXJEUHV-QMKZIPLGSA-N 2 0 366.480 4.307 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000423106710 1096583890 /nfs/dbraw/zinc/58/38/90/1096583890.db2.gz OUCBJASLRSCBPW-ZBUUHCTJSA-N 3 0 363.977 4.361 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000423113105 1096586108 /nfs/dbraw/zinc/58/61/08/1096586108.db2.gz YKDBMISFICVWQC-GFOJFJKKSA-N 2 0 364.961 4.361 20 0 FIADRP FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423153389 1096588962 /nfs/dbraw/zinc/58/89/62/1096588962.db2.gz GKVOIGFPQHLEAA-RMRDIRSESA-N 2 0 368.443 4.343 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000503925445 1096590141 /nfs/dbraw/zinc/59/01/41/1096590141.db2.gz CKHMGHVNBDUZIJ-UHFFFAOYSA-N 2 0 373.928 4.136 20 0 FIADRP Fc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423144515 1096595599 /nfs/dbraw/zinc/59/55/99/1096595599.db2.gz HHKHVYQQFBOOJY-VWPQPMDRSA-N 2 0 352.453 4.049 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000503950150 1096610235 /nfs/dbraw/zinc/61/02/35/1096610235.db2.gz SSNRVKSDAMDVOU-USYVTKNRSA-N 2 0 364.480 4.322 20 0 FIADRP C[NH2+]CCC[NH2+][C@@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000423197837 1096614079 /nfs/dbraw/zinc/61/40/79/1096614079.db2.gz BLIAIIKSYHLYHX-NSHDSACASA-N 2 0 368.344 4.141 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423256438 1096631726 /nfs/dbraw/zinc/63/17/26/1096631726.db2.gz DZZVBFLCSOVHKV-UZLBHIALSA-N 2 0 360.448 4.357 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC[C@@H]3CCC[NH2+]C3)s2)cc1 ZINC000423258372 1096632916 /nfs/dbraw/zinc/63/29/16/1096632916.db2.gz LZBQWRRWGVHNPZ-ZBFHGGJFSA-N 2 0 359.539 4.167 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423258703 1096633041 /nfs/dbraw/zinc/63/30/41/1096633041.db2.gz MMPQJPDWJSMZBN-HXOBKFHXSA-N 2 0 363.480 4.443 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000423289715 1096635062 /nfs/dbraw/zinc/63/50/62/1096635062.db2.gz BQDUETIMCGDFDO-WDGBRCNXSA-N 3 0 351.538 4.239 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000423294531 1096643300 /nfs/dbraw/zinc/64/33/00/1096643300.db2.gz UQMHCAGTXVKGDF-ZIAGYGMSSA-N 2 0 352.400 4.498 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423374383 1096653236 /nfs/dbraw/zinc/65/32/36/1096653236.db2.gz IIZSSVXMEBODJG-SFHVURJKSA-N 2 0 373.294 4.056 20 0 FIADRP CCC[C@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1cccc(C(F)(F)F)c1 ZINC000423397873 1096666156 /nfs/dbraw/zinc/66/61/56/1096666156.db2.gz CIVFSJIEVJQKOE-KRWDZBQOSA-N 2 0 358.448 4.152 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423420211 1096669403 /nfs/dbraw/zinc/66/94/03/1096669403.db2.gz AFHZRQLNFQDUCC-XFBWCDHKSA-N 2 0 363.299 4.234 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)nc1 ZINC000423406256 1096673430 /nfs/dbraw/zinc/67/34/30/1096673430.db2.gz UMYLPTRRAHIGLJ-SSKFGXFMSA-N 2 0 371.956 4.039 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCS2 ZINC000423472387 1096693806 /nfs/dbraw/zinc/69/38/06/1096693806.db2.gz FUXOJKCSKPTHEA-DZGCQCFKSA-N 2 0 355.345 4.108 20 0 FIADRP CSCC1CCC([NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)CC1 ZINC000423478546 1096696452 /nfs/dbraw/zinc/69/64/52/1096696452.db2.gz TXIIKRVRTGUPFA-DYENIDHDSA-N 2 0 350.547 4.030 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000423508624 1096702252 /nfs/dbraw/zinc/70/22/52/1096702252.db2.gz NUKXLGXCINBGPS-MDASCCDHSA-N 2 0 359.311 4.256 20 0 FIADRP COCCC[C@@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccc(F)cc1 ZINC000423521672 1096712218 /nfs/dbraw/zinc/71/22/18/1096712218.db2.gz GKIATQMWBDMDPW-RMKBDTBJSA-N 2 0 360.517 4.037 20 0 FIADRP Fc1ccc([C@H]([NH2+]CCC2=CC[NH2+]CC2)c2cnc3ccccc3c2)cc1 ZINC000423536655 1096715774 /nfs/dbraw/zinc/71/57/74/1096715774.db2.gz IBJHWAFKBSRWKP-QHCPKHFHSA-N 2 0 361.464 4.363 20 0 FIADRP COc1ccccc1[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1Cl ZINC000423554578 1096721258 /nfs/dbraw/zinc/72/12/58/1096721258.db2.gz WWOAWLSFXQQAEY-QNFHRHJVSA-N 2 0 370.924 4.416 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCOC4(CCCC4)C2)C3)cc1 ZINC000245743287 1098707832 /nfs/dbraw/zinc/70/78/32/1098707832.db2.gz RYRZWWPQBCZTIA-MYGLTJDJSA-N 2 0 354.538 4.263 20 0 FIADRP FC(F)(F)COc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000533075673 1098741586 /nfs/dbraw/zinc/74/15/86/1098741586.db2.gz WZNJINPVDNNXRH-QFBILLFUSA-N 2 0 368.443 4.076 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)cc1 ZINC000436284722 1098887817 /nfs/dbraw/zinc/88/78/17/1098887817.db2.gz YVYMIQXMERRKIE-UHFFFAOYSA-N 2 0 369.484 4.317 20 0 FIADRP CCCO[C@@H]1CCC[NH+](C[C@@H](C)C[N@H+]2CCC[C@H](OCCC)CC2)CC1 ZINC000533280627 1098945028 /nfs/dbraw/zinc/94/50/28/1098945028.db2.gz LRGIUMLOLVNAOK-DKUWSORSSA-N 2 0 368.606 4.185 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000515900792 1099020421 /nfs/dbraw/zinc/02/04/21/1099020421.db2.gz YVBVXXIVKHIQHY-PKTZIBPZSA-N 2 0 368.496 4.023 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000436470385 1099046762 /nfs/dbraw/zinc/04/67/62/1099046762.db2.gz KIRXQXCXTUJVEY-HXUWFJFHSA-N 2 0 373.447 4.319 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1OC ZINC000459388287 1099360794 /nfs/dbraw/zinc/36/07/94/1099360794.db2.gz KPBGCXXGDSDBAI-KRWDZBQOSA-N 2 0 369.509 4.199 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OCc2cccnc2)C1 ZINC000067691523 1099487221 /nfs/dbraw/zinc/48/72/21/1099487221.db2.gz WFOUENVYBXFEOT-FQEVSTJZSA-N 2 0 367.537 4.262 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162277323 1099671753 /nfs/dbraw/zinc/67/17/53/1099671753.db2.gz HTKAYFOLCTTZKV-HZPDHXFCSA-N 2 0 360.473 4.187 20 0 FIADRP C[C@@]1([NH3+])CCCC[C@@H]1c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000261891743 1099673355 /nfs/dbraw/zinc/67/33/55/1099673355.db2.gz XNVZSNAXDMJZJD-WIYYLYMNSA-N 2 0 354.498 4.098 20 0 FIADRP CC(C)C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000162499815 1099811842 /nfs/dbraw/zinc/81/18/42/1099811842.db2.gz KYRZGDWCQXOCIJ-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP CCOCc1ccccc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508694350 1099826371 /nfs/dbraw/zinc/82/63/71/1099826371.db2.gz CPYNMDKYTMWMRC-UGKGYDQZSA-N 2 0 352.522 4.223 20 0 FIADRP C[C@H](NCCC[N@H+](C)C1CCCCC1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508699237 1099832645 /nfs/dbraw/zinc/83/26/45/1099832645.db2.gz NRMSSHLNPVEMOW-RBBKRZOGSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703606 1099857776 /nfs/dbraw/zinc/85/77/76/1099857776.db2.gz ZACGRANPGKTFFA-QEFHDYNCSA-N 2 0 366.549 4.041 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(OC(F)F)cc1 ZINC000162586106 1099900596 /nfs/dbraw/zinc/90/05/96/1099900596.db2.gz SFJCSDNEAPXJGK-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000508712671 1099902615 /nfs/dbraw/zinc/90/26/15/1099902615.db2.gz RMVOUBRDVSVNQI-SXWKCWPCSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722248 1099940307 /nfs/dbraw/zinc/94/03/07/1099940307.db2.gz WWZUFQXBUHBYPC-QUCCMNQESA-N 2 0 352.497 4.358 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508723170 1099943420 /nfs/dbraw/zinc/94/34/20/1099943420.db2.gz VHPAPWKLYIFFAW-WWNPGLIZSA-N 2 0 363.549 4.013 20 0 FIADRP COc1ccc(Br)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000536652436 1100106059 /nfs/dbraw/zinc/10/60/59/1100106059.db2.gz LLWRBHUVWFMBKS-UHFFFAOYSA-N 2 0 369.347 4.010 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000414911685 1100110468 /nfs/dbraw/zinc/11/04/68/1100110468.db2.gz STCJILLDPWLPQR-UHFFFAOYSA-N 2 0 354.885 4.021 20 0 FIADRP CCOc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc(Cl)c1OC ZINC000536695716 1100199863 /nfs/dbraw/zinc/19/98/63/1100199863.db2.gz AQBMKGWHUWLYPT-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP CC[N@@H+](Cc1ccc(-n2ccnc2)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709350 1100227877 /nfs/dbraw/zinc/22/78/77/1100227877.db2.gz BMPYGWYRGWKMGX-QHCPKHFHSA-N 2 0 374.532 4.216 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(OC)ccc3ccccc32)CC1 ZINC000536709748 1100230317 /nfs/dbraw/zinc/23/03/17/1100230317.db2.gz NCDXJCPSTIVLPH-UHFFFAOYSA-N 2 0 370.537 4.171 20 0 FIADRP Cn1cc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccc(Cl)cc21 ZINC000459511788 1100265564 /nfs/dbraw/zinc/26/55/64/1100265564.db2.gz MTPNZQGYGYRSRA-UHFFFAOYSA-N 2 0 368.912 4.028 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cnccc2C)CC1 ZINC000536775416 1100296790 /nfs/dbraw/zinc/29/67/90/1100296790.db2.gz IJSRHGRYZFTWJE-ZWKOTPCHSA-N 2 0 370.516 4.083 20 0 FIADRP COc1ccc(OC)c([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000536826342 1100341705 /nfs/dbraw/zinc/34/17/05/1100341705.db2.gz KHYLLFUWEIUHCW-VIQWUECVSA-N 2 0 360.542 4.398 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccccc1C(C)(C)C ZINC000536833645 1100345288 /nfs/dbraw/zinc/34/52/88/1100345288.db2.gz NXXMHVPAVJEIEU-QGZVFWFLSA-N 2 0 355.526 4.170 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000536853251 1100366414 /nfs/dbraw/zinc/36/64/14/1100366414.db2.gz QVFMRDNKOVNWMD-ZLGUVYLKSA-N 2 0 362.583 4.216 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000536855090 1100371082 /nfs/dbraw/zinc/37/10/82/1100371082.db2.gz YHXLYEYVGOAFDR-ZLGUVYLKSA-N 2 0 362.583 4.217 20 0 FIADRP CCCCCOc1cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)ccc1OC ZINC000459663747 1100411875 /nfs/dbraw/zinc/41/18/75/1100411875.db2.gz YHLJRVKIUCJTSU-UHFFFAOYSA-N 2 0 353.466 4.202 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000414921849 1100417376 /nfs/dbraw/zinc/41/73/76/1100417376.db2.gz FAJSFYGOSPRUCQ-OUJCMCIWSA-N 2 0 361.533 4.146 20 0 FIADRP Cc1ccc2cc(C[N@H+](C)C[C@@H]3CC[NH+](Cc4ccccc4)C3)ccc2n1 ZINC000438110087 1100435175 /nfs/dbraw/zinc/43/51/75/1100435175.db2.gz NLTXICFRGHWFBD-QFIPXVFZSA-N 2 0 359.517 4.497 20 0 FIADRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426025594 1100685355 /nfs/dbraw/zinc/68/53/55/1100685355.db2.gz XIHHRLGZCXAWTB-IERDGZPVSA-N 2 0 368.912 4.450 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426036099 1100694363 /nfs/dbraw/zinc/69/43/63/1100694363.db2.gz MLZODXJDTUAPMG-FQEVSTJZSA-N 2 0 357.929 4.340 20 0 FIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000438581050 1100768265 /nfs/dbraw/zinc/76/82/65/1100768265.db2.gz PQFKGKHQQRDKQC-OAQYLSRUSA-N 2 0 355.526 4.018 20 0 FIADRP CCCOc1cc(C[NH2+]CCCN2CCc3ccccc3C2)ccc1OC ZINC000518268644 1101052976 /nfs/dbraw/zinc/05/29/76/1101052976.db2.gz OIHBWOLKSIKLDV-UHFFFAOYSA-N 2 0 368.521 4.022 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1OCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000426308178 1101240437 /nfs/dbraw/zinc/24/04/37/1101240437.db2.gz VDNJEOLFCQDSDX-CKJXQJPGSA-N 2 0 374.550 4.042 20 0 FIADRP CC1(C)Cc2ccc(Br)cc2[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000426335053 1101288480 /nfs/dbraw/zinc/28/84/80/1101288480.db2.gz NKPOUSQBKFKIPI-NUJGCVRESA-N 2 0 363.343 4.289 20 0 FIADRP CC1(C)Cc2c(cccc2Br)[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000426331139 1101292574 /nfs/dbraw/zinc/29/25/74/1101292574.db2.gz NHACVWOOGJIICH-DEYYWGMASA-N 2 0 363.343 4.289 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459724448 1101346501 /nfs/dbraw/zinc/34/65/01/1101346501.db2.gz DRXCZCWQGTXSBA-GOSISDBHSA-N 2 0 374.960 4.023 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(c2cccc(Br)c2)CC1 ZINC000439325024 1101347580 /nfs/dbraw/zinc/34/75/80/1101347580.db2.gz HRCGLBOUEZFNQV-GOSISDBHSA-N 2 0 351.332 4.113 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000536962216 1101358130 /nfs/dbraw/zinc/35/81/30/1101358130.db2.gz GEEHBCSEELEDGV-DNVCBOLYSA-N 2 0 372.384 4.306 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000536962218 1101358872 /nfs/dbraw/zinc/35/88/72/1101358872.db2.gz GEEHBCSEELEDGV-KXBFYZLASA-N 2 0 372.384 4.306 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000536958462 1101371756 /nfs/dbraw/zinc/37/17/56/1101371756.db2.gz IVCLZOOUACDARL-FQEVSTJZSA-N 2 0 353.466 4.082 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1O ZINC000426363628 1101374841 /nfs/dbraw/zinc/37/48/41/1101374841.db2.gz BUFZLMWIJMFSJQ-SFHVURJKSA-N 2 0 368.521 4.108 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000537012584 1101393558 /nfs/dbraw/zinc/39/35/58/1101393558.db2.gz XJSRFGSNIGZLAT-FQEVSTJZSA-N 2 0 361.917 4.162 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@H](C)Sc2ccc(Br)cc2)CC1 ZINC000537060210 1101416979 /nfs/dbraw/zinc/41/69/79/1101416979.db2.gz SQGTXXQJQBWDLC-AWEZNQCLSA-N 2 0 371.388 4.394 20 0 FIADRP CC(C)(C)c1ccc(-c2ccc(C[NH2+]CC3CC[NH+](CCO)CC3)o2)cc1 ZINC000439469458 1101469517 /nfs/dbraw/zinc/46/95/17/1101469517.db2.gz ADLAEVIURRHEDX-UHFFFAOYSA-N 2 0 370.537 4.038 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000518737581 1101482701 /nfs/dbraw/zinc/48/27/01/1101482701.db2.gz YRQFJMPNMRIVDF-UHFFFAOYSA-N 2 0 372.476 4.264 20 0 FIADRP Cc1ccc(-n2ccnc2)c(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)c1 ZINC000537128042 1101482824 /nfs/dbraw/zinc/48/28/24/1101482824.db2.gz QVGOSKMLKRHDNX-UHFFFAOYSA-N 2 0 374.488 4.070 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000414999988 1101514480 /nfs/dbraw/zinc/51/44/80/1101514480.db2.gz JSUFNCAXPKMUJG-KXBFYZLASA-N 2 0 371.912 4.199 20 0 FIADRP Cc1cccc(C)c1CC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537191917 1101525589 /nfs/dbraw/zinc/52/55/89/1101525589.db2.gz GYWQNOBUXIEWPA-QFIPXVFZSA-N 2 0 364.533 4.424 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+](CC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000462030446 1101525692 /nfs/dbraw/zinc/52/56/92/1101525692.db2.gz JFJNRMMONVIZSI-LJQANCHMSA-N 2 0 371.491 4.162 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3cccc(F)c3)o2)CC1 ZINC000475754006 1101604195 /nfs/dbraw/zinc/60/41/95/1101604195.db2.gz IRNLBXFFCITPMM-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537303988 1101628166 /nfs/dbraw/zinc/62/81/66/1101628166.db2.gz LVKNXDGZEBQMIU-JKSBSHDWSA-N 2 0 374.500 4.193 20 0 FIADRP CC[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CCO1 ZINC000648446706 1101706326 /nfs/dbraw/zinc/70/63/26/1101706326.db2.gz PQTKYSUARUHPTN-OALUTQOASA-N 2 0 350.934 4.099 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168168722 1101828349 /nfs/dbraw/zinc/82/83/49/1101828349.db2.gz UTSMHIZLCMMOGJ-MAODMQOUSA-N 2 0 357.929 4.438 20 0 FIADRP CO[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC001168170302 1101888989 /nfs/dbraw/zinc/88/89/89/1101888989.db2.gz JHKVAUHEZZTYSH-ZPMCFJSWSA-N 2 0 372.940 4.150 20 0 FIADRP CO[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC001168170299 1101890445 /nfs/dbraw/zinc/89/04/45/1101890445.db2.gz JHKVAUHEZZTYSH-BULFRSBZSA-N 2 0 372.940 4.150 20 0 FIADRP Cc1cc(N2CCC(OCC[NH+](C)C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000476205917 1102040889 /nfs/dbraw/zinc/04/08/89/1102040889.db2.gz TYXBPODTENPTRC-UHFFFAOYSA-N 2 0 361.917 4.052 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001168183353 1102088524 /nfs/dbraw/zinc/08/85/24/1102088524.db2.gz PRBVIPKZWMSDIA-LPHOPBHVSA-N 2 0 364.961 4.283 20 0 FIADRP C[N@@H+](Cc1ccccc1)C[C@H](C[NH+]1CC[C@]2(CCOC2)C1)c1ccccc1 ZINC001168184414 1102106782 /nfs/dbraw/zinc/10/67/82/1102106782.db2.gz PIAJMEMUOIXWFE-RPWUZVMVSA-N 2 0 364.533 4.015 20 0 FIADRP COc1ccccc1C(C)(C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000103171932 1102125020 /nfs/dbraw/zinc/12/50/20/1102125020.db2.gz NNRCPNXLBDEXTE-UHFFFAOYSA-N 2 0 368.521 4.195 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000415011775 1102249854 /nfs/dbraw/zinc/24/98/54/1102249854.db2.gz IGVLHQCRXLDPAC-IBGZPJMESA-N 2 0 362.521 4.206 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C2CCC2)cc1 ZINC000187536686 1102277270 /nfs/dbraw/zinc/27/72/70/1102277270.db2.gz GVKGZISPZPPPQK-ZEQRLZLVSA-N 2 0 364.533 4.193 20 0 FIADRP c1c[nH]c([C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)n1 ZINC000187837099 1102321859 /nfs/dbraw/zinc/32/18/59/1102321859.db2.gz YFHBSYAMDRMZBI-QFIPXVFZSA-N 2 0 360.505 4.001 20 0 FIADRP Brc1cc2c(s1)CC[C@H]2NC1CC([NH+]2CCCCC2)C1 ZINC000550797030 1102326447 /nfs/dbraw/zinc/32/64/47/1102326447.db2.gz JSQGDKUSNXJAOI-ORHYLEIMSA-N 2 0 355.345 4.104 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](C[C@H](O)c2ccc(Cl)c(Cl)c2)CC1 ZINC001168200018 1102364690 /nfs/dbraw/zinc/36/46/90/1102364690.db2.gz DOSWVKJYEBOMPK-SFHVURJKSA-N 2 0 359.341 4.081 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000519540607 1102368445 /nfs/dbraw/zinc/36/84/45/1102368445.db2.gz LPIUDSLAYWCMMO-ROUUACIJSA-N 2 0 365.521 4.011 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c(C)s1 ZINC000532497863 1102440647 /nfs/dbraw/zinc/44/06/47/1102440647.db2.gz UTWODYXGGTULQY-UWJYYQICSA-N 2 0 357.567 4.004 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cccc(CO)c1 ZINC000121812444 1102475238 /nfs/dbraw/zinc/47/52/38/1102475238.db2.gz AYEUNDSHXHNQHF-LJQANCHMSA-N 2 0 352.522 4.406 20 0 FIADRP CC1CCC([NH+]2CCC3(C[C@@H]([N@H+](C)Cc4ccccc4)CO3)CC2)CC1 ZINC001168214779 1102495249 /nfs/dbraw/zinc/49/52/49/1102495249.db2.gz FRUFUDOBKJLZKX-KITAHSCOSA-N 2 0 356.554 4.321 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000122271719 1102555386 /nfs/dbraw/zinc/55/53/86/1102555386.db2.gz KFORIZXMPLCQHJ-GOSISDBHSA-N 2 0 360.498 4.093 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(C(F)(F)F)c1 ZINC000122364540 1102579029 /nfs/dbraw/zinc/57/90/29/1102579029.db2.gz CACIYSNCDLLOPT-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)ccn1 ZINC000550885012 1102656238 /nfs/dbraw/zinc/65/62/38/1102656238.db2.gz BCHDUIVSWYMRGK-SFHVURJKSA-N 2 0 353.510 4.173 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)ccn1 ZINC000550889753 1102661196 /nfs/dbraw/zinc/66/11/96/1102661196.db2.gz CZSLAWDJDWZNAK-CEXWTWQISA-N 2 0 367.537 4.419 20 0 FIADRP COc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)cc1 ZINC001167978145 1102740890 /nfs/dbraw/zinc/74/08/90/1102740890.db2.gz KSOXIYKUITVIAI-FRIKZZABSA-N 2 0 368.565 4.403 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCCO2 ZINC000123012976 1102745163 /nfs/dbraw/zinc/74/51/63/1102745163.db2.gz MBVYEGUYLPRKJR-OAQYLSRUSA-N 2 0 354.469 4.425 20 0 FIADRP Clc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCOCC2)c1 ZINC001167979055 1102747797 /nfs/dbraw/zinc/74/77/97/1102747797.db2.gz UGCZQCVZRIEDCJ-SEJPIABJSA-N 2 0 374.956 4.341 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000123036865 1102750963 /nfs/dbraw/zinc/75/09/63/1102750963.db2.gz VJHPKNDVXRWPGT-SFHVURJKSA-N 2 0 355.551 4.469 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)OCCCO2 ZINC000123074673 1102765014 /nfs/dbraw/zinc/76/50/14/1102765014.db2.gz GWMVNEWBMUWBPP-SFHVURJKSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cc1N(C)C ZINC000123055065 1102775083 /nfs/dbraw/zinc/77/50/83/1102775083.db2.gz RQMUDZPIXDGQTA-QGZVFWFLSA-N 2 0 355.501 4.338 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[NH+](C)C)cc1 ZINC000551014269 1102790496 /nfs/dbraw/zinc/79/04/96/1102790496.db2.gz QVTVMSDUIKGDRF-ZLNRFVROSA-N 2 0 351.538 4.023 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550263040 1102883684 /nfs/dbraw/zinc/88/36/84/1102883684.db2.gz TXJDBJUKPQNNND-BAGYTPMASA-N 2 0 356.554 4.084 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(OC)ccc2Br)CC1 ZINC000506861649 1102923430 /nfs/dbraw/zinc/92/34/30/1102923430.db2.gz MHFIIBJLHJKJFL-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP Brc1ccc(C2(C[NH2+]C3CCN(C4CC4)CC3)CCC2)cc1 ZINC000459366034 1102930938 /nfs/dbraw/zinc/93/09/38/1102930938.db2.gz COLOYLLXDDIFSW-UHFFFAOYSA-N 2 0 363.343 4.087 20 0 FIADRP Cc1ccc2nc(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cn2c1 ZINC000551246035 1103000856 /nfs/dbraw/zinc/00/08/56/1103000856.db2.gz PUUSGNMGPZUZDC-CTNGQTDRSA-N 2 0 362.521 4.033 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CC[C@@H]3C3CCC3)C3(C2)CCOCC3)cc1 ZINC000551265621 1103023996 /nfs/dbraw/zinc/02/39/96/1103023996.db2.gz WZSJKWBFFVXCFF-ZRBLBEILSA-N 2 0 368.565 4.084 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)ccn1 ZINC000551270091 1103031829 /nfs/dbraw/zinc/03/18/29/1103031829.db2.gz KTORZXXQLMZOPE-OTWHNJEPSA-N 2 0 367.537 4.419 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000729682373 1103035652 /nfs/dbraw/zinc/03/56/52/1103035652.db2.gz UMMLHZRGYNIOTO-UHFFFAOYSA-N 2 0 374.960 4.471 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)ccc1O ZINC000459380527 1103038983 /nfs/dbraw/zinc/03/89/83/1103038983.db2.gz TUSNBESFMOHDHF-GOSISDBHSA-N 2 0 368.521 4.313 20 0 FIADRP COc1ccc(-c2nc(C[NH2+][C@@H](CCC[NH3+])c3ccccc3)cs2)cc1 ZINC000666975982 1103042828 /nfs/dbraw/zinc/04/28/28/1103042828.db2.gz QACYNZRNZNZKJE-FQEVSTJZSA-N 2 0 367.518 4.389 20 0 FIADRP CC1(C)Cc2cc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)ccc2O1 ZINC000729679739 1103043672 /nfs/dbraw/zinc/04/36/72/1103043672.db2.gz NSNVMNIQHYASST-UHFFFAOYSA-N 2 0 370.562 4.463 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000459380164 1103048391 /nfs/dbraw/zinc/04/83/91/1103048391.db2.gz BSRUCKHAFLJMMT-AWEZNQCLSA-N 2 0 365.399 4.300 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccccc2C(F)(F)F)CC1 ZINC000509680074 1103136419 /nfs/dbraw/zinc/13/64/19/1103136419.db2.gz AEMRONLPXSDMQG-UHFFFAOYSA-N 2 0 358.448 4.028 20 0 FIADRP CC[C@@H](Cc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001203214044 1103254096 /nfs/dbraw/zinc/25/40/96/1103254096.db2.gz BBZBVTZYTLUCDO-IRXDYDNUSA-N 2 0 353.348 4.233 20 0 FIADRP COc1ncc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl ZINC000551539827 1103317914 /nfs/dbraw/zinc/31/79/14/1103317914.db2.gz HBBSMKMJCUFRLK-OAGGEKHMSA-N 2 0 353.938 4.152 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000507459371 1103404748 /nfs/dbraw/zinc/40/47/48/1103404748.db2.gz FUGPYZVKESFTKZ-ODGPQVTHSA-N 2 0 359.517 4.211 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3sccc3Cl)cc2)CC1 ZINC000551580695 1103409161 /nfs/dbraw/zinc/40/91/61/1103409161.db2.gz VDPZXFHVWSSGDX-UHFFFAOYSA-N 2 0 350.915 4.164 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000507470839 1103417617 /nfs/dbraw/zinc/41/76/17/1103417617.db2.gz NXJLELMOVWEUMG-FHWLQOOXSA-N 2 0 367.537 4.104 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)[C@@H]1COc2ccccc21 ZINC000507485312 1103433430 /nfs/dbraw/zinc/43/34/30/1103433430.db2.gz LKOTXXATFBUPDU-FOGFPEBHSA-N 2 0 362.517 4.051 20 0 FIADRP COc1ccc(C2([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)CC2)cc1 ZINC000507519399 1103443755 /nfs/dbraw/zinc/44/37/55/1103443755.db2.gz IEXYWXKDJFBEKV-UEVCKROQSA-N 2 0 362.517 4.185 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000551787840 1103658478 /nfs/dbraw/zinc/65/84/78/1103658478.db2.gz MOXBOTYGBNJCJR-JJEOQYAHSA-N 2 0 365.521 4.088 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCc4cc(F)ccc43)cc2)CC1 ZINC000551812612 1103693308 /nfs/dbraw/zinc/69/33/08/1103693308.db2.gz NYKCMFURBCRZBA-JOCHJYFZSA-N 2 0 354.469 4.076 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000187996943 1103732871 /nfs/dbraw/zinc/73/28/71/1103732871.db2.gz QVUGGMKIAPWIIX-XNJGSVPQSA-N 2 0 358.423 4.194 20 0 FIADRP Fc1cc(C(F)(F)F)cc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000187996545 1103733091 /nfs/dbraw/zinc/73/30/91/1103733091.db2.gz SMNVHPMCUHJNRA-IAGOWNOFSA-N 2 0 356.407 4.093 20 0 FIADRP Fc1cc(C(F)(F)F)cc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c1 ZINC000187996572 1103734124 /nfs/dbraw/zinc/73/41/24/1103734124.db2.gz SMNVHPMCUHJNRA-DLBZAZTESA-N 2 0 356.407 4.093 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+]CC1(N[C@H](C)c2ccccc2)CCOCC1 ZINC000188047380 1103807535 /nfs/dbraw/zinc/80/75/35/1103807535.db2.gz NMFZWHPXQDWGPK-RTBURBONSA-N 2 0 370.512 4.246 20 0 FIADRP Oc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000312010644 1103831390 /nfs/dbraw/zinc/83/13/90/1103831390.db2.gz RSYITHVEBYTHCC-WMZHIEFXSA-N 2 0 350.506 4.271 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000461085682 1104069234 /nfs/dbraw/zinc/06/92/34/1104069234.db2.gz GEBOKSOQUFIWTK-ZIFCJYIRSA-N 2 0 362.558 4.080 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(CC)(CC)c2ccc(OC)c(OC)c2)[C@H](C)C1 ZINC000461081810 1104082002 /nfs/dbraw/zinc/08/20/02/1104082002.db2.gz BOIFXYPHOITUCJ-MJGOQNOKSA-N 2 0 362.558 4.082 20 0 FIADRP CCC[C@H](C[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000538305270 1104124961 /nfs/dbraw/zinc/12/49/61/1104124961.db2.gz QZQDDNIQJDKYDF-JOCHJYFZSA-N 2 0 357.586 4.061 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000520210968 1104187325 /nfs/dbraw/zinc/18/73/25/1104187325.db2.gz HRQVXEWJNBSIBW-MRXNPFEDSA-N 2 0 374.960 4.390 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)C1 ZINC000520391826 1104320409 /nfs/dbraw/zinc/32/04/09/1104320409.db2.gz SLPPMXFEFROAIU-JOCHJYFZSA-N 2 0 352.522 4.130 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cccc4ccccc43)cn2)CC1 ZINC000112529185 1104374207 /nfs/dbraw/zinc/37/42/07/1104374207.db2.gz YPPUMDWXARKFRG-LJQANCHMSA-N 2 0 374.532 4.228 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCOC4(CCSCC4)C3)CC2)C1 ZINC000537963319 1104450584 /nfs/dbraw/zinc/45/05/84/1104450584.db2.gz HTBSKINLGKUBDO-YZGWKJHDSA-N 2 0 366.615 4.064 20 0 FIADRP c1nn(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c2ccccc12 ZINC001167994755 1104484225 /nfs/dbraw/zinc/48/42/25/1104484225.db2.gz NHYWVWSNPCUNRK-CBQGHPETSA-N 2 0 364.537 4.079 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnn(-c3ccc(F)cc3)c2)c1 ZINC000077403058 1104889749 /nfs/dbraw/zinc/88/97/49/1104889749.db2.gz FZCIJUZYQRYBSG-UHFFFAOYSA-N 2 0 366.484 4.141 20 0 FIADRP COc1ccc(C2=CC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)CC2)cc1 ZINC001168001857 1104954818 /nfs/dbraw/zinc/95/48/18/1104954818.db2.gz JOAXESQWMKZRMP-CBQGHPETSA-N 2 0 352.522 4.190 20 0 FIADRP COc1cc(CN[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc(OC)c1 ZINC001168005162 1105071789 /nfs/dbraw/zinc/07/17/89/1105071789.db2.gz HDLGRZKDLOZUIN-RMFSNUHRSA-N 2 0 368.521 4.235 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152396461 1105082626 /nfs/dbraw/zinc/08/26/26/1105082626.db2.gz CIESYYXQQVODRH-UKRRQHHQSA-N 2 0 359.514 4.393 20 0 FIADRP CC(C)[NH+]1CCC(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168008174 1105171278 /nfs/dbraw/zinc/17/12/78/1105171278.db2.gz CYAGCHROUWFXSQ-WOJBJXKFSA-N 3 0 357.586 4.138 20 0 FIADRP C[C@@H]1C[C@@H](n2c3ccccc3nc2CC[NH3+])C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008452 1105192464 /nfs/dbraw/zinc/19/24/64/1105192464.db2.gz DYWHMRVAPDHWAO-OPVJXMOQSA-N 2 0 362.521 4.152 20 0 FIADRP COc1ccccc1OCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168009070 1105207207 /nfs/dbraw/zinc/20/72/07/1105207207.db2.gz GOSXZIYDQGZSJC-CEQLMSFQSA-N 2 0 368.521 4.105 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2-c2ccnn2C)C1 ZINC000507834399 1105240695 /nfs/dbraw/zinc/24/06/95/1105240695.db2.gz UPTNRNGDGHWFCB-UXHICEINSA-N 2 0 366.553 4.174 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](COCC3CC3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168064250 1106855347 /nfs/dbraw/zinc/85/53/47/1106855347.db2.gz PLVFFGSHRNMPML-IYRWYFENSA-N 2 0 356.554 4.177 20 0 FIADRP CCOC(=O)[C@@H]1CCCC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168064978 1106890194 /nfs/dbraw/zinc/89/01/94/1106890194.db2.gz TWJZFLFPKJVHDT-IRFCIJBXSA-N 2 0 372.553 4.093 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c2ccccc21 ZINC000530209556 1106913374 /nfs/dbraw/zinc/91/33/74/1106913374.db2.gz IQJYJOGXNSFYNN-UXHICEINSA-N 2 0 366.509 4.127 20 0 FIADRP CC(=O)c1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000451066063 1106917459 /nfs/dbraw/zinc/91/74/59/1106917459.db2.gz MOOVFAIJEUPXTH-UHFFFAOYSA-N 2 0 362.517 4.377 20 0 FIADRP Cc1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301717554 1107120634 /nfs/dbraw/zinc/12/06/34/1107120634.db2.gz ODMBNSLSMVARSU-KSSFIOAISA-N 2 0 361.436 4.065 20 0 FIADRP C[C@H](C[NH+]1CCC[C@@]2(CCSC2)C1)C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000451980250 1107410675 /nfs/dbraw/zinc/41/06/75/1107410675.db2.gz QXCVPTKGQGGVFZ-OWZKRDHZSA-N 2 0 368.656 4.061 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)nc2)cc1 ZINC000179106688 1107874570 /nfs/dbraw/zinc/87/45/70/1107874570.db2.gz GDNBFHWUXCPSOH-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1sccc1Br ZINC000531688353 1108053642 /nfs/dbraw/zinc/05/36/42/1108053642.db2.gz OEGFCASTNGJQDE-GFCCVEGCSA-N 2 0 353.329 4.423 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc(C)c1F ZINC000531709791 1108089817 /nfs/dbraw/zinc/08/98/17/1108089817.db2.gz YMNCDMOFXRGEPQ-DENIHFKCSA-N 2 0 369.528 4.082 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)cs1 ZINC000453071148 1108122693 /nfs/dbraw/zinc/12/26/93/1108122693.db2.gz CVARKYKNBJJPMX-HBMCJLEFSA-N 2 0 355.551 4.027 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c2nccn21 ZINC000453105698 1108174131 /nfs/dbraw/zinc/17/41/31/1108174131.db2.gz FWKNQNOPFCLPQF-SIKLNZKXSA-N 2 0 366.553 4.213 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c2sccc21 ZINC000453122987 1108190266 /nfs/dbraw/zinc/19/02/66/1108190266.db2.gz FLOUBWVQRUGDRX-IIBYNOLFSA-N 2 0 370.562 4.433 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453127597 1108205714 /nfs/dbraw/zinc/20/57/14/1108205714.db2.gz PPGBOQLOEPGLFB-ZRBLBEILSA-N 2 0 366.553 4.005 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC(C[NH+](C)C(C)C)CC2)cc1 ZINC000523420651 1108208886 /nfs/dbraw/zinc/20/88/86/1108208886.db2.gz DPNVMJXTTLKPBA-UHFFFAOYSA-N 2 0 373.585 4.111 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453171631 1108245976 /nfs/dbraw/zinc/24/59/76/1108245976.db2.gz MNZCYZXXGGYSMO-XUFNMVPLSA-N 2 0 367.537 4.428 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc(-c2ccccc2)nn1C ZINC000453197594 1108267117 /nfs/dbraw/zinc/26/71/17/1108267117.db2.gz NLIHLQDPXQGPOW-BJLQDIEVSA-N 2 0 366.553 4.391 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)c1nccs1 ZINC000453204122 1108275432 /nfs/dbraw/zinc/27/54/32/1108275432.db2.gz VTZSLLVIJNCCBA-VBSBHUPXSA-N 2 0 355.551 4.279 20 0 FIADRP C[N@H+](Cc1ccccc1)C1(CN[C@@H]2CC[NH+]3CCC[C@H]3C2)CCCCC1 ZINC000714226703 1108401327 /nfs/dbraw/zinc/40/13/27/1108401327.db2.gz OAWUAYHBLAJUKD-YADHBBJMSA-N 2 0 355.570 4.038 20 0 FIADRP CC(C)[C@H]1C[C@@H](C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000453313933 1108402503 /nfs/dbraw/zinc/40/25/03/1108402503.db2.gz DYMKUZNZCHRMJW-SCZRWQTQSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2cccnc21 ZINC000531941919 1108420785 /nfs/dbraw/zinc/42/07/85/1108420785.db2.gz UDABSPUSPICMEQ-XXBNENTESA-N 2 0 359.517 4.278 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(Br)cc2)CCC1 ZINC000531956393 1108445405 /nfs/dbraw/zinc/44/54/05/1108445405.db2.gz GVHXFIUSJUPEFV-IIDMSEBBSA-N 2 0 365.359 4.189 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@@]4(CCSC4)C2)C3)cc1 ZINC000453353462 1108452964 /nfs/dbraw/zinc/45/29/64/1108452964.db2.gz JEPVYILWXPZJAY-CLAROIROSA-N 2 0 356.579 4.401 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1)C1CC1 ZINC000453386342 1108471924 /nfs/dbraw/zinc/47/19/24/1108471924.db2.gz AOWPLSMJDIAHEV-OAQYLSRUSA-N 2 0 357.929 4.483 20 0 FIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000453375628 1108493263 /nfs/dbraw/zinc/49/32/63/1108493263.db2.gz XYUFOVXBZZLOOD-ZPGBFPTHSA-N 2 0 357.325 4.364 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000532210719 1108712603 /nfs/dbraw/zinc/71/26/03/1108712603.db2.gz MUIDJHWWHGKEBL-QGZVFWFLSA-N 2 0 365.521 4.264 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000532215510 1108717293 /nfs/dbraw/zinc/71/72/93/1108717293.db2.gz BFIZLBVIFCTQDK-ZWKOTPCHSA-N 2 0 355.501 4.379 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000532215509 1108717352 /nfs/dbraw/zinc/71/73/52/1108717352.db2.gz BFIZLBVIFCTQDK-ROUUACIJSA-N 2 0 355.501 4.379 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)CCCC2)cc1C ZINC000532249243 1108727173 /nfs/dbraw/zinc/72/71/73/1108727173.db2.gz ROTPBWMSZQUJSY-QKNQBKEWSA-N 2 0 371.569 4.121 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532234417 1108730272 /nfs/dbraw/zinc/73/02/72/1108730272.db2.gz FXTRGQYMSJRDIZ-FFZOFVMBSA-N 2 0 357.542 4.123 20 0 FIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)o2)cc1C ZINC000532344235 1108771822 /nfs/dbraw/zinc/77/18/22/1108771822.db2.gz RJKXLYFICWPBSS-SFHVURJKSA-N 2 0 370.541 4.467 20 0 FIADRP c1ccc(COc2ccccc2C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446891082 1109379162 /nfs/dbraw/zinc/37/91/62/1109379162.db2.gz TXTMJWFEPXBRJK-UHFFFAOYSA-N 2 0 350.506 4.230 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446886430 1109383321 /nfs/dbraw/zinc/38/33/21/1109383321.db2.gz GMNCOTPAOGGZBR-UHFFFAOYSA-N 2 0 369.372 4.135 20 0 FIADRP Brc1cccc(C2CC([NH2+]CC3CC[NH+](C4CC4)CC3)C2)c1 ZINC000446887909 1109383350 /nfs/dbraw/zinc/38/33/50/1109383350.db2.gz ZZFNOHDWFCRCFJ-UHFFFAOYSA-N 2 0 363.343 4.159 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cccc(C[NH+](C)C)c2)cc1 ZINC000525490154 1109400638 /nfs/dbraw/zinc/40/06/38/1109400638.db2.gz GXNCYBSPTXDQNF-SFHVURJKSA-N 2 0 365.521 4.375 20 0 FIADRP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)CC1(C)C ZINC000623386565 1109469943 /nfs/dbraw/zinc/46/99/43/1109469943.db2.gz ZVOKHWYXIBQYCQ-HXUWFJFHSA-N 2 0 362.521 4.047 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@@H](C)c3cccc4ccccc43)C2)CC1 ZINC000525779470 1109515970 /nfs/dbraw/zinc/51/59/70/1109515970.db2.gz RRDRXWIPBGAYKG-PZJWPPBQSA-N 2 0 351.538 4.001 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@H]1CCOc2ccc(F)cc21 ZINC000525858455 1109541113 /nfs/dbraw/zinc/54/11/13/1109541113.db2.gz PMIUEFAWHVRUAM-HBGVWJBISA-N 2 0 354.469 4.150 20 0 FIADRP CCCOc1ccc(OCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000544419282 1109545833 /nfs/dbraw/zinc/54/58/33/1109545833.db2.gz AZBBBDAYOMQXBN-RBUKOAKNSA-N 2 0 360.542 4.097 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cc(C)oc3C)CC2)cc1 ZINC000447526096 1109561960 /nfs/dbraw/zinc/56/19/60/1109561960.db2.gz ANLTVDSAFAIQLN-KRWDZBQOSA-N 2 0 356.510 4.468 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1OC(F)F ZINC000447570783 1109577015 /nfs/dbraw/zinc/57/70/15/1109577015.db2.gz VORODBBOLPJCSR-GFCCVEGCSA-N 2 0 358.860 4.466 20 0 FIADRP Clc1ccc([C@@H](Cc2cccnc2)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447565837 1109584301 /nfs/dbraw/zinc/58/43/01/1109584301.db2.gz OCFNLJBHOHIYDI-JOCHJYFZSA-N 2 0 369.940 4.483 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1F ZINC000447582583 1109585389 /nfs/dbraw/zinc/58/53/89/1109585389.db2.gz XEGJWSVZJSNHCI-GFCCVEGCSA-N 2 0 355.295 4.113 20 0 FIADRP COC(=O)c1coc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000447587041 1109587342 /nfs/dbraw/zinc/58/73/42/1109587342.db2.gz PYENBPMAUKTDRD-AOIWGVFYSA-N 2 0 370.493 4.018 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[NH+]1[C@H](C)CC[C@H]1C ZINC000508605167 1109605640 /nfs/dbraw/zinc/60/56/40/1109605640.db2.gz RXVRMVURJYRYFV-QRVBRYPASA-N 2 0 357.542 4.118 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1nc(-c2ccccc2)c[nH]1 ZINC000447849473 1109658870 /nfs/dbraw/zinc/65/88/70/1109658870.db2.gz IAPGSUIAOQCWRK-GHTZIAJQSA-N 2 0 360.505 4.077 20 0 FIADRP CC(C)(C)c1cnc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000447943051 1109677660 /nfs/dbraw/zinc/67/76/60/1109677660.db2.gz WPAZGHDNAIKCTL-UHFFFAOYSA-N 2 0 357.567 4.442 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@@H](c4ccnn4C)C3)CC2)CC1 ZINC000448027299 1109697607 /nfs/dbraw/zinc/69/76/07/1109697607.db2.gz MKLNHNHDDYDNSN-NFYVFUGESA-N 2 0 358.574 4.079 20 0 FIADRP C[C@@H](N[C@H]1CCOc2c(F)cccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527197742 1109717620 /nfs/dbraw/zinc/71/76/20/1109717620.db2.gz ZSDIKLDKLJXOMM-BLIXFSHQSA-N 2 0 354.469 4.150 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCSc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000527298595 1109735219 /nfs/dbraw/zinc/73/52/19/1109735219.db2.gz PIMPSLYCXXGGES-CTNGQTDRSA-N 2 0 364.599 4.122 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2cc(F)c(Cl)cc21 ZINC000527856281 1109839568 /nfs/dbraw/zinc/83/95/68/1109839568.db2.gz PXRQIOOGLNXSRI-LJQANCHMSA-N 2 0 362.876 4.197 20 0 FIADRP CC(C)c1cccc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000527859751 1109840941 /nfs/dbraw/zinc/84/09/41/1109840941.db2.gz QKJZGNOWUSRFIM-YKSBVNFPSA-N 2 0 365.565 4.449 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCc3cc(F)c(Cl)cc32)ccc1F ZINC000527867038 1109844285 /nfs/dbraw/zinc/84/42/85/1109844285.db2.gz QQAVZAQXCZSLEA-IBGZPJMESA-N 2 0 350.840 4.457 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(F)c(Br)cc1F ZINC000527900186 1109857453 /nfs/dbraw/zinc/85/74/53/1109857453.db2.gz XNQBQGIITGQQDB-NSHDSACASA-N 2 0 373.285 4.252 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000527948476 1109866926 /nfs/dbraw/zinc/86/69/26/1109866926.db2.gz LOSPRMZETFXKHA-KKSFZXQISA-N 2 0 370.541 4.028 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCN2C2CCCC2)CC1 ZINC000527999163 1109881286 /nfs/dbraw/zinc/88/12/86/1109881286.db2.gz FOAIMIZCOASFDK-YDPRHXJPSA-N 2 0 355.570 4.036 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC(Nc2cccc(C[NH+](C)C)c2)CC1 ZINC000449040105 1109962999 /nfs/dbraw/zinc/96/29/99/1109962999.db2.gz GILHLXFAIBXXBI-IBGZPJMESA-N 2 0 351.538 4.256 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnc(-c3c(F)cccc3F)s2)cc1 ZINC000449062289 1109964882 /nfs/dbraw/zinc/96/48/82/1109964882.db2.gz KYDXMWWZHKBGHE-UHFFFAOYSA-N 2 0 373.472 4.440 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)CC1 ZINC000449071728 1109972862 /nfs/dbraw/zinc/97/28/62/1109972862.db2.gz OKWPXOGXZHXCEY-GOSISDBHSA-N 2 0 359.558 4.433 20 0 FIADRP C[C@@H](COCC(F)(F)F)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449098548 1109975421 /nfs/dbraw/zinc/97/54/21/1109975421.db2.gz JQNUIPSCTZDMNO-AWEZNQCLSA-N 2 0 352.485 4.223 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccccc2-c2ccccc2C)CC1 ZINC000449129773 1109981891 /nfs/dbraw/zinc/98/18/91/1109981891.db2.gz DGFYZLNSNAXMCX-HXUWFJFHSA-N 2 0 365.565 4.025 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2coc3ccccc23)[C@H](C)C1 ZINC000449143861 1109985106 /nfs/dbraw/zinc/98/51/06/1109985106.db2.gz XXCJBXMDBNSNOS-LQWHRVPQSA-N 2 0 358.526 4.090 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCOc3ccccc32)CC1 ZINC000449145499 1109985115 /nfs/dbraw/zinc/98/51/15/1109985115.db2.gz LMHQJZVSWLJYGM-CTNGQTDRSA-N 2 0 364.533 4.238 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)CC1 ZINC000449216077 1109999249 /nfs/dbraw/zinc/99/92/49/1109999249.db2.gz ZZGSZAHLQKZQFQ-HWHRFOGPSA-N 2 0 368.565 4.019 20 0 FIADRP C[C@H](CCO)C1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCC1 ZINC000449255009 1110007100 /nfs/dbraw/zinc/00/71/00/1110007100.db2.gz ZINFJFPLQRYKOR-GOSISDBHSA-N 2 0 352.607 4.444 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)CC1 ZINC000449247459 1110011508 /nfs/dbraw/zinc/01/15/08/1110011508.db2.gz GIZDJKLDOPSHNV-SIKLNZKXSA-N 2 0 350.591 4.460 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000449305230 1110022355 /nfs/dbraw/zinc/02/23/55/1110022355.db2.gz FJKOQXMIAPSDPB-HKUYNNGSSA-N 2 0 350.497 4.497 20 0 FIADRP CSC1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC[NH+](C)CC1 ZINC000449340340 1110032635 /nfs/dbraw/zinc/03/26/35/1110032635.db2.gz WBDODYLXRIFBMI-UHFFFAOYSA-N 3 0 369.663 4.083 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCC34CCC4)C3(C2)CCOCC3)cc1 ZINC000449343624 1110035092 /nfs/dbraw/zinc/03/50/92/1110035092.db2.gz LXEBUXIIVXIMIV-FCHUYYIVSA-N 2 0 368.565 4.228 20 0 FIADRP CC1(C)C[N@H+](CC[C@H]2CCOC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449414243 1110055654 /nfs/dbraw/zinc/05/56/54/1110055654.db2.gz LRRNHBRZZNUNIZ-UNMCSNQZSA-N 2 0 356.554 4.036 20 0 FIADRP CC1(C)C[N@H+](CC[C@H]2CCOC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449414242 1110055862 /nfs/dbraw/zinc/05/58/62/1110055862.db2.gz LRRNHBRZZNUNIZ-RBBKRZOGSA-N 2 0 356.554 4.036 20 0 FIADRP Cc1noc(C)c1C[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413880 1110056087 /nfs/dbraw/zinc/05/60/87/1110056087.db2.gz KMEOUSCMYXOVCF-QFIPXVFZSA-N 2 0 367.537 4.414 20 0 FIADRP CC1(C)C[N@H+](C[C@H]2CCCOC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449416285 1110056391 /nfs/dbraw/zinc/05/63/91/1110056391.db2.gz SQPOOKRHOLIBJF-IFMALSPDSA-N 2 0 356.554 4.036 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCOC3(CCC3)C2)CC1 ZINC000449480504 1110084974 /nfs/dbraw/zinc/08/49/74/1110084974.db2.gz OQKFAQPRNGOVOK-CTNGQTDRSA-N 2 0 356.554 4.021 20 0 FIADRP Cc1cc(OCCC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1Cl ZINC000449561486 1110110925 /nfs/dbraw/zinc/11/09/25/1110110925.db2.gz VPNZGKZFYFWUIN-OOKSDGMUSA-N 2 0 350.934 4.411 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449634257 1110135963 /nfs/dbraw/zinc/13/59/63/1110135963.db2.gz ZVPOXAYAMHNDOD-MJUUVYJYSA-N 2 0 370.562 4.468 20 0 FIADRP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@@H]4CCO[C@@H](C)C4)CC3)C2)cc1 ZINC001168114900 1110238969 /nfs/dbraw/zinc/23/89/69/1110238969.db2.gz FLAZJRONNWRNIU-RBBKRZOGSA-N 2 0 356.554 4.241 20 0 FIADRP Fc1cc2nccc(NCC3([NH+]4CCCC4)CCOCC3)c2cc1Cl ZINC000450316623 1110280952 /nfs/dbraw/zinc/28/09/52/1110280952.db2.gz ZJCBXDXUSWYEDI-UHFFFAOYSA-N 2 0 363.864 4.084 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)C2CC(F)(F)C2)CC1 ZINC000529541047 1110285203 /nfs/dbraw/zinc/28/52/03/1110285203.db2.gz ZVDHXEDWIUVNBG-LSDHHAIUSA-N 2 0 369.475 4.052 20 0 FIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000538396375 1111123044 /nfs/dbraw/zinc/12/30/44/1111123044.db2.gz RCUJQYSXDUVERK-LPHOPBHVSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1cccc(Cl)c1 ZINC000538589350 1111210667 /nfs/dbraw/zinc/21/06/67/1111210667.db2.gz ZGEHZJIFZMYONG-OAHLLOKOSA-N 2 0 358.917 4.439 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2)c1 ZINC000538709422 1111256278 /nfs/dbraw/zinc/25/62/78/1111256278.db2.gz JHOFVRWLPMMRDG-DEOSSOPVSA-N 2 0 365.565 4.010 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2Cc1ccc(F)c(-c2cccs2)c1 ZINC000538799091 1111295483 /nfs/dbraw/zinc/29/54/83/1111295483.db2.gz MMWQXXMXTUHTMH-UXPWSPDFSA-N 2 0 374.525 4.238 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000461794488 1111358775 /nfs/dbraw/zinc/35/87/75/1111358775.db2.gz GXSCATROTUREIH-QRVBRYPASA-N 2 0 365.359 4.377 20 0 FIADRP CC(C)[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159459 1111454291 /nfs/dbraw/zinc/45/42/91/1111454291.db2.gz RVAGBTAFSSDQQO-YRNRMSPPSA-N 2 0 359.514 4.188 20 0 FIADRP Cc1ccc2c(CC[NH2+]C3CCN(CCc4ccccc4)CC3)c[nH]c2c1 ZINC000462040448 1111470403 /nfs/dbraw/zinc/47/04/03/1111470403.db2.gz NOHOWCIXOSXIOT-UHFFFAOYSA-N 2 0 361.533 4.316 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc(Br)cc2)[C@@H](C)C1 ZINC000468964792 1111511260 /nfs/dbraw/zinc/51/12/60/1111511260.db2.gz KJTCPVCMGAUCQA-WMLDXEAASA-N 2 0 353.348 4.047 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c(C)c1 ZINC000539395847 1111541762 /nfs/dbraw/zinc/54/17/62/1111541762.db2.gz GXCAVKSCBGTMBQ-OAQYLSRUSA-N 2 0 366.505 4.081 20 0 FIADRP COCC[C@@H](Cc1ccco1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552065465 1111564586 /nfs/dbraw/zinc/56/45/86/1111564586.db2.gz AGRNMIRKRFTCSD-ORFBVSJDSA-N 2 0 370.537 4.260 20 0 FIADRP COCCC[C@H](C[NH2+]C1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000552091715 1111571301 /nfs/dbraw/zinc/57/13/01/1111571301.db2.gz WIEAQGMWDWCQCY-GOSISDBHSA-N 2 0 352.950 4.313 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC000477950937 1111611735 /nfs/dbraw/zinc/61/17/35/1111611735.db2.gz VBDXZJTYVXSOGN-GOSISDBHSA-N 2 0 374.573 4.333 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)CC1 ZINC000477945670 1111618094 /nfs/dbraw/zinc/61/80/94/1111618094.db2.gz YLGWZTLKVIWUEB-KPUOSGPGSA-N 2 0 356.554 4.397 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1 ZINC000552224170 1111623457 /nfs/dbraw/zinc/62/34/57/1111623457.db2.gz LVYRVQNTIGRCPE-AUSIDOKSSA-N 2 0 367.537 4.086 20 0 FIADRP FC(F)(F)Oc1cccc([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000552224314 1111624192 /nfs/dbraw/zinc/62/41/92/1111624192.db2.gz SPQWFENRFPKGPB-ACJLOTCBSA-N 2 0 354.416 4.110 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H]2CCC[C@@H]21 ZINC000552259547 1111638936 /nfs/dbraw/zinc/63/89/36/1111638936.db2.gz KSQCGVLKMKLHLB-BZSNNMDCSA-N 2 0 361.942 4.426 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC000552266426 1111642346 /nfs/dbraw/zinc/64/23/46/1111642346.db2.gz MCXDBVRUASHWAI-JOCHJYFZSA-N 2 0 367.537 4.086 20 0 FIADRP Fc1ccc([C@@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2cnc3ccccc3c2)cc1 ZINC000643536996 1111774265 /nfs/dbraw/zinc/77/42/65/1111774265.db2.gz XUDOVRQUSCAYMV-FGZHOGPDSA-N 2 0 361.464 4.195 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1C(F)(F)F ZINC000479296456 1111987632 /nfs/dbraw/zinc/98/76/32/1111987632.db2.gz NMIPLLNWVLOYHN-LLVKDONJSA-N 2 0 367.253 4.460 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298070 1111988512 /nfs/dbraw/zinc/98/85/12/1111988512.db2.gz UAUTXGNDPVMMKA-LJQANCHMSA-N 2 0 361.327 4.470 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000479365633 1112001232 /nfs/dbraw/zinc/00/12/32/1112001232.db2.gz KXUVEFOBZSRCKV-UHFFFAOYSA-N 2 0 369.347 4.204 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(F)ccc1F ZINC000479438048 1112023525 /nfs/dbraw/zinc/02/35/25/1112023525.db2.gz NRSRHHFKXQTKGD-KNQAVFIVSA-N 2 0 374.475 4.018 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000479441353 1112024650 /nfs/dbraw/zinc/02/46/50/1112024650.db2.gz BFFLLMVLAPRKMJ-XUZZJYLKSA-N 2 0 364.533 4.128 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000479463558 1112033603 /nfs/dbraw/zinc/03/36/03/1112033603.db2.gz IPRVUYDLNSKAJR-PKOBYXMFSA-N 2 0 355.501 4.064 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000479466313 1112041634 /nfs/dbraw/zinc/04/16/34/1112041634.db2.gz RLQLWBDPXIQRPN-FXAWDEMLSA-N 2 0 356.510 4.474 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)[C@H](C)C1 ZINC000479525677 1112052470 /nfs/dbraw/zinc/05/24/70/1112052470.db2.gz IFIZLZVYNVTENJ-UIAACRFSSA-N 2 0 350.934 4.054 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@H](NC1CC([NH+]3CCCCC3)C1)CCC2 ZINC000479528659 1112053705 /nfs/dbraw/zinc/05/37/05/1112053705.db2.gz QCAWJALHVCMEAU-JTTJXQCZSA-N 2 0 353.432 4.084 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000479557908 1112071084 /nfs/dbraw/zinc/07/10/84/1112071084.db2.gz YTJGHOUKHDFSCM-LJQANCHMSA-N 2 0 367.537 4.359 20 0 FIADRP COc1cc([C@H](C)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c(F)cn1 ZINC000554049918 1112175441 /nfs/dbraw/zinc/17/54/41/1112175441.db2.gz YDJVFMZEKIRKSW-IRXDYDNUSA-N 2 0 371.500 4.312 20 0 FIADRP CC(C)Oc1ccc([C@H](CNC2CC[NH+](C3CCCC3)CC2)[NH+](C)C)cc1 ZINC000554086032 1112197895 /nfs/dbraw/zinc/19/78/95/1112197895.db2.gz SIXDPXUHIUPNGJ-QHCPKHFHSA-N 2 0 373.585 4.073 20 0 FIADRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1cccc(OCc2ccccn2)c1 ZINC000479969344 1112217294 /nfs/dbraw/zinc/21/72/94/1112217294.db2.gz WYSBBTAQINLIJZ-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000480022874 1112235501 /nfs/dbraw/zinc/23/55/01/1112235501.db2.gz VZMOFSKHZKPDOL-UFYCRDLUSA-N 2 0 352.522 4.455 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCC[NH+](C)Cc1ccccc1 ZINC000480148051 1112302390 /nfs/dbraw/zinc/30/23/90/1112302390.db2.gz PQIWXWQFOQNZJG-URXFXBBRSA-N 2 0 365.565 4.009 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)c3cccs3)CC2)c1 ZINC000480218515 1112336182 /nfs/dbraw/zinc/33/61/82/1112336182.db2.gz DBBSSXXXRXFYMR-LJQANCHMSA-N 2 0 357.567 4.310 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000480234556 1112343914 /nfs/dbraw/zinc/34/39/14/1112343914.db2.gz SCVHGKBTFZVFIX-YDIMBITNSA-N 2 0 364.533 4.381 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000480234547 1112344211 /nfs/dbraw/zinc/34/42/11/1112344211.db2.gz SCVHGKBTFZVFIX-AXHZCLLHSA-N 2 0 364.533 4.381 20 0 FIADRP COC1(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCCCC1 ZINC000480375096 1112409522 /nfs/dbraw/zinc/40/95/22/1112409522.db2.gz FKBAJLXJDKOJQH-UHFFFAOYSA-N 2 0 356.510 4.351 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)nnn1-c1ccc(C)cc1 ZINC000480612900 1112501039 /nfs/dbraw/zinc/50/10/39/1112501039.db2.gz ODDCVVXQHBKVJU-RTBURBONSA-N 2 0 369.557 4.189 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000480604875 1112505255 /nfs/dbraw/zinc/50/52/55/1112505255.db2.gz GCOFDOOYFDFTKW-CVEARBPZSA-N 2 0 352.494 4.148 20 0 FIADRP COc1cccc(CCC[N@H+](C)C[C@H]2CC[NH+](Cc3ccc(C)s3)C2)c1 ZINC000554852107 1112529755 /nfs/dbraw/zinc/52/97/55/1112529755.db2.gz RWEWZDVUXZRVCI-HXUWFJFHSA-N 2 0 372.578 4.452 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)c(C)n1 ZINC000480717227 1112567440 /nfs/dbraw/zinc/56/74/40/1112567440.db2.gz BEDDPYORIFOCRJ-KURKYZTESA-N 2 0 366.553 4.422 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC000481241244 1112823633 /nfs/dbraw/zinc/82/36/33/1112823633.db2.gz JZRKZDHLFZPZDN-HNAYVOBHSA-N 2 0 373.368 4.263 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cccc(Br)c21 ZINC000481308808 1112882744 /nfs/dbraw/zinc/88/27/44/1112882744.db2.gz GNNWPALDWSHHQY-ACJLOTCBSA-N 2 0 363.343 4.461 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000481309996 1112885068 /nfs/dbraw/zinc/88/50/68/1112885068.db2.gz STBPYJMMWUQHBP-AOMKIAJQSA-N 2 0 356.485 4.179 20 0 FIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CCCO2 ZINC000481327490 1112901505 /nfs/dbraw/zinc/90/15/05/1112901505.db2.gz INEYAQIJBLOSJP-JOCHJYFZSA-N 2 0 368.521 4.247 20 0 FIADRP COCCc1ccc(OC[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000667891131 1112959749 /nfs/dbraw/zinc/95/97/49/1112959749.db2.gz BIUKBLUGGBQNTK-IBGZPJMESA-N 2 0 374.569 4.030 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000481538881 1112972704 /nfs/dbraw/zinc/97/27/04/1112972704.db2.gz CTISHCSNEXWZRM-HXUWFJFHSA-N 2 0 374.532 4.435 20 0 FIADRP FC(F)(F)Oc1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000899874706 1113037441 /nfs/dbraw/zinc/03/74/41/1113037441.db2.gz JFZQEDPRACKMBC-STQMWFEESA-N 2 0 351.372 4.172 20 0 FIADRP C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1cc[nH+]c2cc(OC(F)(F)F)ccc21 ZINC000899877858 1113040787 /nfs/dbraw/zinc/04/07/87/1113040787.db2.gz JXZQXCSZNDSYBO-KBPBESRZSA-N 2 0 365.399 4.196 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2ccccc2n1 ZINC000481724323 1113055487 /nfs/dbraw/zinc/05/54/87/1113055487.db2.gz HCDHCLYXIZTPKB-CVDCTZTESA-N 2 0 359.517 4.278 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000481731887 1113059072 /nfs/dbraw/zinc/05/90/72/1113059072.db2.gz GCZOFFFLXXLBBV-PXNSSMCTSA-N 2 0 366.977 4.344 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)[NH+](C)C)cc1 ZINC000481947675 1113142366 /nfs/dbraw/zinc/14/23/66/1113142366.db2.gz NFGVAJLGMKAEGI-OYDLWJJNSA-N 2 0 365.565 4.098 20 0 FIADRP Cc1ccc2c(CC[NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)c[nH]c2c1 ZINC000482139557 1113179593 /nfs/dbraw/zinc/17/95/93/1113179593.db2.gz USVZFTDCVBTUTR-GOSISDBHSA-N 2 0 365.521 4.310 20 0 FIADRP CC(C)C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@@H]1CCCc2cccnc21 ZINC000668003224 1113223603 /nfs/dbraw/zinc/22/36/03/1113223603.db2.gz LKJREJMFGCXUKN-OAQYLSRUSA-N 2 0 361.493 4.198 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)OCCO2 ZINC000162911426 1113225280 /nfs/dbraw/zinc/22/52/80/1113225280.db2.gz CYUKORWOOPFWJS-NRFANRHFSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000482438630 1113255279 /nfs/dbraw/zinc/25/52/79/1113255279.db2.gz MTPPNJBBWAZZIL-QUCCMNQESA-N 2 0 369.528 4.107 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CCCO2 ZINC000482438994 1113259950 /nfs/dbraw/zinc/25/99/50/1113259950.db2.gz NWLQIUWJEUXNBY-FYYLOGMGSA-N 2 0 364.533 4.363 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000482494437 1113278031 /nfs/dbraw/zinc/27/80/31/1113278031.db2.gz CQPOAMJNMXIYHO-RTWAWAEBSA-N 2 0 365.565 4.278 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cnc2ccsc2c1 ZINC000482550416 1113291838 /nfs/dbraw/zinc/29/18/38/1113291838.db2.gz FRDPJQDARFNZTI-MRXNPFEDSA-N 2 0 369.534 4.130 20 0 FIADRP CC(C)CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482626460 1113313606 /nfs/dbraw/zinc/31/36/06/1113313606.db2.gz CNQOSGVGVROUBA-YLJYHZDGSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@@H]([NH2+]CCCc1c[nH]c2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000482640865 1113317750 /nfs/dbraw/zinc/31/77/50/1113317750.db2.gz WUAPIBHCVGTJCR-GOSISDBHSA-N 2 0 365.521 4.392 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000482651318 1113323308 /nfs/dbraw/zinc/32/33/08/1113323308.db2.gz WGFUEIRWTJIXIH-UHFFFAOYSA-N 2 0 368.569 4.050 20 0 FIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000482873127 1113385580 /nfs/dbraw/zinc/38/55/80/1113385580.db2.gz KELPWFXHHMLAIO-RTWAWAEBSA-N 2 0 372.578 4.167 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000482907817 1113396733 /nfs/dbraw/zinc/39/67/33/1113396733.db2.gz ZDWINZXQEXRWAC-OFNKIYASSA-N 2 0 366.549 4.313 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(-c2cnn(C)c2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486489871 1113577151 /nfs/dbraw/zinc/57/71/51/1113577151.db2.gz PFPCJMJRTUMCPP-XXBNENTESA-N 2 0 374.532 4.087 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000486717114 1113628232 /nfs/dbraw/zinc/62/82/32/1113628232.db2.gz MZQHMMYSCUNQFB-UZLBHIALSA-N 2 0 351.469 4.450 20 0 FIADRP C[C@H]1CSCC[N@H+](Cc2ccccc2C[NH+]2CCSC[C@@H](C)C2)C1 ZINC000488157973 1113864905 /nfs/dbraw/zinc/86/49/05/1113864905.db2.gz FVRNLBKSCUONJU-HDICACEKSA-N 2 0 364.624 4.056 20 0 FIADRP CCC[C@@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1)c1ccccc1 ZINC000488329250 1113909208 /nfs/dbraw/zinc/90/92/08/1113909208.db2.gz WLQRJODWOCVJRK-SIKLNZKXSA-N 2 0 373.585 4.086 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cc4ccc(F)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000488349226 1113913276 /nfs/dbraw/zinc/91/32/76/1113913276.db2.gz BXHRHWCMKXUNHX-IRXDYDNUSA-N 2 0 373.516 4.018 20 0 FIADRP CC(C)(C)[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488408250 1113921255 /nfs/dbraw/zinc/92/12/55/1113921255.db2.gz GUZPCYPGFJTBQE-FUHWJXTLSA-N 2 0 352.613 4.470 20 0 FIADRP Cc1cc(C[NH2+]CCC[NH+]2CCC(C)CC2)ccc1Oc1cccnc1 ZINC000489136220 1114057384 /nfs/dbraw/zinc/05/73/84/1114057384.db2.gz IHWMOXNAMWHYIJ-UHFFFAOYSA-N 2 0 353.510 4.394 20 0 FIADRP COC[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000658355701 1114074249 /nfs/dbraw/zinc/07/42/49/1114074249.db2.gz KIJZPZQHJLORSL-IBGZPJMESA-N 2 0 370.459 4.105 20 0 FIADRP COc1cc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])ccc1OCc1cccs1 ZINC000490088875 1114217087 /nfs/dbraw/zinc/21/70/87/1114217087.db2.gz MOFNBPHGIVYGCE-QGZVFWFLSA-N 2 0 360.523 4.039 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cn1 ZINC000490120709 1114220488 /nfs/dbraw/zinc/22/04/88/1114220488.db2.gz WHTOZNPJXKEUIK-LLGFUMIMSA-N 2 0 371.500 4.071 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccccc1F ZINC000490131002 1114221998 /nfs/dbraw/zinc/22/19/98/1114221998.db2.gz RNRYONGSUQFMHE-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)c(OC)c2)C1 ZINC000151135991 1114299841 /nfs/dbraw/zinc/29/98/41/1114299841.db2.gz MCZIQFHHLPOOFH-UONOGXRCSA-N 2 0 358.498 4.392 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490961372 1114356199 /nfs/dbraw/zinc/35/61/99/1114356199.db2.gz BRHDVZLQKYXIAV-GBXCKJPGSA-N 2 0 369.597 4.192 20 0 FIADRP CSCc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000586795512 1114395063 /nfs/dbraw/zinc/39/50/63/1114395063.db2.gz FSXDZJKWCKTRLN-QGZVFWFLSA-N 2 0 358.551 4.341 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(N2CCCC2=O)cc1 ZINC000156788537 1114564270 /nfs/dbraw/zinc/56/42/70/1114564270.db2.gz VHENBCIBCYLWPG-GOSISDBHSA-N 2 0 369.553 4.261 20 0 FIADRP CCCc1nc(C)c(CN(C)C[C@H]2CC[N@H+](Cc3ccc(C)s3)C2)o1 ZINC000572487641 1114650010 /nfs/dbraw/zinc/65/00/10/1114650010.db2.gz MPPZPXAODJEZJE-QGZVFWFLSA-N 2 0 361.555 4.259 20 0 FIADRP c1ccc(N2CC[C@@H](C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)C2)cc1 ZINC000589640859 1114819451 /nfs/dbraw/zinc/81/94/51/1114819451.db2.gz CMHGFUKBZLZAMI-NRFANRHFSA-N 2 0 363.549 4.289 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641843 1114819872 /nfs/dbraw/zinc/81/98/72/1114819872.db2.gz QKRNCHBBTYRXJQ-QZTJIDSGSA-N 2 0 362.521 4.331 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)cc1 ZINC000589950674 1114866674 /nfs/dbraw/zinc/86/66/74/1114866674.db2.gz BIGFOYBXRHEPBD-JOCHJYFZSA-N 2 0 371.569 4.009 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2cccc(F)c2)CC1 ZINC000589999855 1114873091 /nfs/dbraw/zinc/87/30/91/1114873091.db2.gz ZKPRVZZVOMHKTE-UHFFFAOYSA-N 2 0 356.485 4.049 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000590786933 1114974270 /nfs/dbraw/zinc/97/42/70/1114974270.db2.gz WFUKAUSWVOKKJZ-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP FC(F)(F)[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000573034444 1115002597 /nfs/dbraw/zinc/00/25/97/1115002597.db2.gz WJJGRLVCUCEBCE-RTBURBONSA-N 2 0 370.459 4.262 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)CC1 ZINC000591708115 1115125788 /nfs/dbraw/zinc/12/57/88/1115125788.db2.gz OQTIJIOQFRHMJK-UHFFFAOYSA-N 2 0 356.485 4.226 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2cc(OC)c(OC)cc2-c2ccccc2)CC1 ZINC000591708147 1115125922 /nfs/dbraw/zinc/12/59/22/1115125922.db2.gz YUFZCRIDRDAHSN-UHFFFAOYSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCC(O)(c4ccccc4)CC3)CC2)C1 ZINC000760908702 1115170349 /nfs/dbraw/zinc/17/03/49/1115170349.db2.gz QJCPUEOEEOVRHB-BXDDPRONSA-N 2 0 370.581 4.450 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)cc1C[NH+]1CCCCC1 ZINC000157768155 1115293533 /nfs/dbraw/zinc/29/35/33/1115293533.db2.gz ABXCCODDBOCTJK-LXBDKUERSA-N 2 0 372.553 4.289 20 0 FIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@@H](c2ccccc2)[NH+](CC)CC)CC1 ZINC000597225865 1115651001 /nfs/dbraw/zinc/65/10/01/1115651001.db2.gz MFVWZUREPPECDX-JOCHJYFZSA-N 2 0 373.585 4.040 20 0 FIADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000669614552 1115667778 /nfs/dbraw/zinc/66/77/78/1115667778.db2.gz YLSRVWJVXMPCTO-OFNKIYASSA-N 2 0 364.533 4.227 20 0 FIADRP COc1cc(OC)cc(Oc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000608061463 1116079723 /nfs/dbraw/zinc/07/97/23/1116079723.db2.gz DZYBTZVTNFSIIU-AEFFLSMTSA-N 2 0 370.493 4.068 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC[N@@H+]1C ZINC000608061477 1116079775 /nfs/dbraw/zinc/07/97/75/1116079775.db2.gz FMQIQWJMYVKTHX-APWZRJJASA-N 2 0 358.913 4.491 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000608061243 1116079798 /nfs/dbraw/zinc/07/97/98/1116079798.db2.gz JBWNQVXVKUBLBM-KNQAVFIVSA-N 2 0 374.532 4.420 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)Cc1cccs1 ZINC000608062593 1116080206 /nfs/dbraw/zinc/08/02/06/1116080206.db2.gz WUNKCBLQMDLZME-GOSISDBHSA-N 2 0 358.551 4.191 20 0 FIADRP Cc1ccccc1O[C@@H](C)C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000608065440 1116080659 /nfs/dbraw/zinc/08/06/59/1116080659.db2.gz QICOWEYXDIVRJG-FQEVSTJZSA-N 2 0 368.521 4.027 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1 ZINC000608746877 1116125711 /nfs/dbraw/zinc/12/57/11/1116125711.db2.gz HCOPCUCHHQCCFY-UHFFFAOYSA-N 2 0 358.448 4.028 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509165 1116313755 /nfs/dbraw/zinc/31/37/55/1116313755.db2.gz YPCXXDFXVZXQCU-ZBEGNZNMSA-N 2 0 357.723 4.021 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3cc(-c4ccccc4)cs3)C2)CC1 ZINC000539861712 1116391931 /nfs/dbraw/zinc/39/19/31/1116391931.db2.gz JAKGFZCPNDCFMA-NRFANRHFSA-N 2 0 369.578 4.015 20 0 FIADRP Fc1ccccc1N1CC[C@@H](C[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000462801313 1117785136 /nfs/dbraw/zinc/78/51/36/1117785136.db2.gz BYUTYXTZNLYIBP-SFHVURJKSA-N 2 0 359.533 4.039 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H]2CCN(c3ccccc3F)C2)CC1 ZINC000462801558 1117785198 /nfs/dbraw/zinc/78/51/98/1117785198.db2.gz CKQSURSHAWEUPS-WOIUINJBSA-N 2 0 373.560 4.285 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)[C@H](C)C1 ZINC000540141167 1117893549 /nfs/dbraw/zinc/89/35/49/1117893549.db2.gz FIABDWFHQDPNLS-VGOFRKELSA-N 2 0 356.485 4.225 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1C(F)(F)F ZINC000540170499 1117912748 /nfs/dbraw/zinc/91/27/48/1117912748.db2.gz ITRZJMXBZFVSLQ-OWCLPIDISA-N 2 0 358.448 4.245 20 0 FIADRP CC(C)[C@@H](CNC1CC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000540188423 1117920319 /nfs/dbraw/zinc/92/03/19/1117920319.db2.gz OLULPDIDSDGHET-XMMPIXPASA-N 2 0 369.597 4.066 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCCCC[NH+]2CCCCC2)CCN1Cc1ccccc1 ZINC000463132614 1117983476 /nfs/dbraw/zinc/98/34/76/1117983476.db2.gz SLZFKAAHHDAHAM-JTHBVZDNSA-N 2 0 357.586 4.285 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000540418062 1118044316 /nfs/dbraw/zinc/04/43/16/1118044316.db2.gz TXQDGDQRDZSYSU-YVEFUNNKSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@@H]1C[C@H](N[C@@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463279885 1118067320 /nfs/dbraw/zinc/06/73/20/1118067320.db2.gz KIIMKFKCLGHTJJ-OTUUDDROSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475539 1118077799 /nfs/dbraw/zinc/07/77/99/1118077799.db2.gz NUQIKHOWSDQYTG-NRSPTQNISA-N 2 0 372.553 4.160 20 0 FIADRP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc3c(c2)ncn3C)CCN1Cc1ccccc1 ZINC000540482644 1118081820 /nfs/dbraw/zinc/08/18/20/1118081820.db2.gz AXFIFSDFLDTXFF-NQIIRXRSSA-N 2 0 362.521 4.058 20 0 FIADRP C[C@H](C[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000540595037 1118138865 /nfs/dbraw/zinc/13/88/65/1118138865.db2.gz SLFRICRCRKOGHY-VQIMIIECSA-N 2 0 351.966 4.043 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000540992088 1118341775 /nfs/dbraw/zinc/34/17/75/1118341775.db2.gz UVJQBSCUYXWKME-DNQXCXABSA-N 2 0 366.549 4.447 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)ccc2OC2CCCC2)CC1 ZINC000464048198 1118412993 /nfs/dbraw/zinc/41/29/93/1118412993.db2.gz IOEXOCZRTPOPBE-UHFFFAOYSA-N 2 0 350.934 4.483 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000541215501 1118431064 /nfs/dbraw/zinc/43/10/64/1118431064.db2.gz DVNKLMSHNCLXKQ-URVUXULASA-N 2 0 368.569 4.285 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2C[C@H](c3ccccc3)C2(C)C)(N2CCCCC2)CC1 ZINC000464080166 1118435040 /nfs/dbraw/zinc/43/50/40/1118435040.db2.gz XRKKKNNWTGDYBM-YADHBBJMSA-N 2 0 369.597 4.109 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000541557810 1118562382 /nfs/dbraw/zinc/56/23/82/1118562382.db2.gz JKLKYYJNIXYIOB-MOPGFXCFSA-N 2 0 374.573 4.475 20 0 FIADRP C[N@H+](CCOc1ccc(Cl)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831350 1118715458 /nfs/dbraw/zinc/71/54/58/1118715458.db2.gz ACKVFBHQBXBGMZ-IBGZPJMESA-N 2 0 358.913 4.173 20 0 FIADRP CSc1ccc(OCC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000464846976 1118720283 /nfs/dbraw/zinc/72/02/83/1118720283.db2.gz KQOIMBOJSCMWCS-FQEVSTJZSA-N 2 0 370.562 4.241 20 0 FIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCOCCc3ccccc3)C2)CC1 ZINC000303036466 1118776518 /nfs/dbraw/zinc/77/65/18/1118776518.db2.gz RCHUUKQMPDXZRB-QHCPKHFHSA-N 2 0 358.570 4.080 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc([C@H]3CCCO3)s2)CC1 ZINC000542176609 1118836423 /nfs/dbraw/zinc/83/64/23/1118836423.db2.gz DSMRWFNLCGSOAH-LJQANCHMSA-N 2 0 365.587 4.329 20 0 FIADRP Clc1ccc2c(c1Cl)OC[C@H]2[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC000542302256 1118901121 /nfs/dbraw/zinc/90/11/21/1118901121.db2.gz IADDJRVVMRTMPV-CQSZACIVSA-N 2 0 366.273 4.464 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)ccc1SC(F)F ZINC000152467477 1119322207 /nfs/dbraw/zinc/32/22/07/1119322207.db2.gz LJSOIKOKYZOFKG-OLZOCXBDSA-N 2 0 356.482 4.145 20 0 FIADRP Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000178134503 1119373206 /nfs/dbraw/zinc/37/32/06/1119373206.db2.gz VSMYYTMQGZMOCK-FGTMMUONSA-N 2 0 354.542 4.057 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000311493617 1119376999 /nfs/dbraw/zinc/37/69/99/1119376999.db2.gz KDEPGAVFBZOWDW-AUSIDOKSSA-N 2 0 350.506 4.184 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000178215771 1119377840 /nfs/dbraw/zinc/37/78/40/1119377840.db2.gz SWCXFEUAANDTLB-AQEOSJORSA-N 2 0 364.496 4.082 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311859756 1119392683 /nfs/dbraw/zinc/39/26/83/1119392683.db2.gz UXICNPXCASZHOC-IPJJNNNSSA-N 2 0 352.522 4.126 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000178618455 1119398792 /nfs/dbraw/zinc/39/87/92/1119398792.db2.gz RUFISDMBTVUSIO-SFHVURJKSA-N 2 0 363.505 4.416 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccnn1-c1ccccc1 ZINC000467311242 1119407277 /nfs/dbraw/zinc/40/72/77/1119407277.db2.gz OEVAPBJOZGSQTP-IBGZPJMESA-N 2 0 360.505 4.319 20 0 FIADRP CCc1ccc([C@@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000493247979 1119434280 /nfs/dbraw/zinc/43/42/80/1119434280.db2.gz MQADCPUUSOOFNC-OAQYLSRUSA-N 2 0 372.940 4.038 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493923714 1119509938 /nfs/dbraw/zinc/50/99/38/1119509938.db2.gz DKJNDPWZBOCARB-ZLGJRNTRSA-N 2 0 351.332 4.158 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)c1 ZINC000493929433 1119510458 /nfs/dbraw/zinc/51/04/58/1119510458.db2.gz YKMYDLIEXXDRED-BHIFYINESA-N 2 0 354.538 4.110 20 0 FIADRP CCCc1csc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000494177103 1119551491 /nfs/dbraw/zinc/55/14/91/1119551491.db2.gz UNCODCHYXALAQJ-MJGOQNOKSA-N 2 0 357.567 4.486 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cncc(C)c2)CC1 ZINC000184346431 1119604453 /nfs/dbraw/zinc/60/44/53/1119604453.db2.gz XMGCDKIBFUJQFM-QZTJIDSGSA-N 2 0 370.516 4.083 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)C1 ZINC000542477005 1119636258 /nfs/dbraw/zinc/63/62/58/1119636258.db2.gz AVUMZDCPNXEHDQ-AVRDEDQJSA-N 2 0 355.501 4.412 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000186594433 1119739152 /nfs/dbraw/zinc/73/91/52/1119739152.db2.gz MBBCBSJLJGKBQF-PMACEKPBSA-N 2 0 351.538 4.030 20 0 FIADRP Cc1nc2ccc(C[NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)cc2s1 ZINC000494340294 1119828130 /nfs/dbraw/zinc/82/81/30/1119828130.db2.gz RYNKNIUUVPHUBI-HXUWFJFHSA-N 2 0 365.546 4.259 20 0 FIADRP CCN(CCC[NH+](C)C)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000190952718 1119955642 /nfs/dbraw/zinc/95/56/42/1119955642.db2.gz NGXVYWLGLPOESQ-UHFFFAOYSA-N 2 0 374.573 4.257 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cnn1C(C)(C)C ZINC000191144875 1119962872 /nfs/dbraw/zinc/96/28/72/1119962872.db2.gz PVYCEVBEIFOCLA-KRWDZBQOSA-N 2 0 354.542 4.393 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cnn1C(C)C ZINC000191244744 1119967134 /nfs/dbraw/zinc/96/71/34/1119967134.db2.gz ZFVQPBAIVKGPMA-MRXNPFEDSA-N 2 0 360.571 4.397 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@H]2c2cccc3ccccc32)CC1 ZINC000191460575 1119978216 /nfs/dbraw/zinc/97/82/16/1119978216.db2.gz MBYHUTSWQHLPDB-DEOSSOPVSA-N 2 0 365.565 4.393 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000195132606 1120119662 /nfs/dbraw/zinc/11/96/62/1120119662.db2.gz TYQIFNHIGDIPTK-AZUAARDMSA-N 2 0 368.521 4.185 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000494879721 1120354539 /nfs/dbraw/zinc/35/45/39/1120354539.db2.gz QPWUYJIFMSYSNO-DENIHFKCSA-N 2 0 356.485 4.145 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494891610 1120358986 /nfs/dbraw/zinc/35/89/86/1120358986.db2.gz QLUSPRISNMCVPB-XQBPLPMBSA-N 2 0 362.533 4.395 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494916442 1120369211 /nfs/dbraw/zinc/36/92/11/1120369211.db2.gz IGHNLULHMGKCEP-UGKGYDQZSA-N 2 0 362.533 4.395 20 0 FIADRP Cc1noc(C2CCC([NH2+]C[C@@H]3CCC[N@@H+]3CC3CCCCC3)CC2)n1 ZINC000495069796 1120460566 /nfs/dbraw/zinc/46/05/66/1120460566.db2.gz UEAXRCWQMXNFSC-MHJFOBGBSA-N 2 0 360.546 4.039 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)C2CCC2)cc1 ZINC000250099359 1120475218 /nfs/dbraw/zinc/47/52/18/1120475218.db2.gz REHGVGJTALBYSB-YTFSRNRJSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ncc(Br)cc1F ZINC000250125581 1120477359 /nfs/dbraw/zinc/47/73/59/1120477359.db2.gz WCQOLIVQUUFHNC-UONOGXRCSA-N 2 0 372.326 4.146 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2ccnc2)cc1 ZINC000495431938 1120817432 /nfs/dbraw/zinc/81/74/32/1120817432.db2.gz GALCVQMOGDVRFX-JTAQYXEDSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000495443814 1120818293 /nfs/dbraw/zinc/81/82/93/1120818293.db2.gz FHZXCRXAFPTHML-JAXLGGSGSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4ccccc43)cc2)C[C@H](C)O1 ZINC000495547030 1120882088 /nfs/dbraw/zinc/88/20/88/1120882088.db2.gz KTJZRJXPKCGOMJ-GLDPYIMESA-N 2 0 364.533 4.463 20 0 FIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+]C3CCCC3)CC2)c1 ZINC000915229800 1120889120 /nfs/dbraw/zinc/88/91/20/1120889120.db2.gz SFYWSIFCHHMWBO-UHFFFAOYSA-N 2 0 369.475 4.140 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000237067420 1120973089 /nfs/dbraw/zinc/97/30/89/1120973089.db2.gz NEZRVDBVMSBKME-UHFFFAOYSA-N 2 0 374.532 4.030 20 0 FIADRP COc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c(-c2ccccc2)cc1OC ZINC000237447730 1120977888 /nfs/dbraw/zinc/97/78/88/1120977888.db2.gz FMMIMCBJTTWVHE-SFHVURJKSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4cc[nH]c43)cc2)C[C@@H](C)O1 ZINC000237577800 1120980087 /nfs/dbraw/zinc/98/00/87/1120980087.db2.gz XTXOIJPLMXXBCI-QZTJIDSGSA-N 2 0 363.505 4.067 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2)C[C@H](C)O1 ZINC000237621985 1120980524 /nfs/dbraw/zinc/98/05/24/1120980524.db2.gz IRVMEVAEDKZYQN-IRXDYDNUSA-N 2 0 358.913 4.239 20 0 FIADRP C[C@H]([NH2+]C1CCC(OC(F)F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000648818080 1121002846 /nfs/dbraw/zinc/00/28/46/1121002846.db2.gz KJWRZAKYXVSQOJ-XMZVIZOASA-N 2 0 352.469 4.037 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCc3c(Cl)cccc32)c1 ZINC000542670370 1121167576 /nfs/dbraw/zinc/16/75/76/1121167576.db2.gz DSXBKBDZTQJQLW-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCc3c(Cl)cccc32)c1 ZINC000542670181 1121169077 /nfs/dbraw/zinc/16/90/77/1121169077.db2.gz DSXBKBDZTQJQLW-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP C[C@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC001649048814 1121316812 /nfs/dbraw/zinc/31/68/12/1121316812.db2.gz ZZQYNTSRPSDYTG-PZJWPPBQSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccccc1-c1nc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cs1 ZINC000123322381 1121395707 /nfs/dbraw/zinc/39/57/07/1121395707.db2.gz BBVAPAHGVJCALA-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@@H](CC[NH+](C)C)c3ccccc3)CCO2)cc1 ZINC001168585273 1121518516 /nfs/dbraw/zinc/51/85/16/1121518516.db2.gz GYWROEFWBTWCPT-PUHATCMVSA-N 2 0 368.521 4.198 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(OC)c(OC)cc2C)c1 ZINC000123908077 1121644622 /nfs/dbraw/zinc/64/46/22/1121644622.db2.gz UFXAFWUESLENKC-QGZVFWFLSA-N 2 0 356.510 4.315 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc3[nH]c(=O)oc3c2)c1 ZINC000671741769 1121646906 /nfs/dbraw/zinc/64/69/06/1121646906.db2.gz XVUUCYWYBUKCME-HNNXBMFYSA-N 2 0 353.466 4.226 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1 ZINC000124732119 1121716310 /nfs/dbraw/zinc/71/63/10/1121716310.db2.gz MFNJPIDZEVRZEK-FQEVSTJZSA-N 2 0 373.585 4.075 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C[C@H]4CC45CCOCC5)[C@@H]3C2)cc1 ZINC000671761457 1121790640 /nfs/dbraw/zinc/79/06/40/1121790640.db2.gz VDZKCPJRRYHFBK-AFXVXQJMSA-N 2 0 368.565 4.084 20 0 FIADRP CCCN(C)[C@@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764439 1121798165 /nfs/dbraw/zinc/79/81/65/1121798165.db2.gz IWQIVHGFKUOXPP-JXFKEZNVSA-N 2 0 351.966 4.043 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1Br ZINC000125724435 1121816297 /nfs/dbraw/zinc/81/62/97/1121816297.db2.gz JUKPZXDQHUNNHO-LSDHHAIUSA-N 2 0 369.347 4.229 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCc2ccccc2F)cc1)C[NH+]1CCCC1 ZINC000916836560 1121877840 /nfs/dbraw/zinc/87/78/40/1121877840.db2.gz LTSQOFZDRHZFMJ-GOSISDBHSA-N 2 0 356.485 4.226 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126703439 1121978383 /nfs/dbraw/zinc/97/83/83/1121978383.db2.gz XEJQCRCDKYLYEF-HZPDHXFCSA-N 2 0 361.530 4.359 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126703214 1121978454 /nfs/dbraw/zinc/97/84/54/1121978454.db2.gz XEJQCRCDKYLYEF-HOTGVXAUSA-N 2 0 361.530 4.359 20 0 FIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765780620 1121991923 /nfs/dbraw/zinc/99/19/23/1121991923.db2.gz RKKBPHPQUGNVBP-VGOFRKELSA-N 2 0 367.512 4.224 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001168611645 1122009131 /nfs/dbraw/zinc/00/91/31/1122009131.db2.gz WJOYKVYUNLVRHQ-XLIONFOSSA-N 2 0 360.542 4.156 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cccs2)CC1 ZINC000127236323 1122067097 /nfs/dbraw/zinc/06/70/97/1122067097.db2.gz WLAYFJHSUULOBQ-HOTGVXAUSA-N 2 0 361.530 4.441 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@H](O)c2ccc3ccccc3c2)CC1 ZINC000917069746 1122075855 /nfs/dbraw/zinc/07/58/55/1122075855.db2.gz ZXLHCJLWKFPOJC-QHCPKHFHSA-N 2 0 354.538 4.317 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc4c(c3)COC(C)(C)O4)CC2)CC1 ZINC000186398990 1122090334 /nfs/dbraw/zinc/09/03/34/1122090334.db2.gz YVENZDHLJYDVDX-UHFFFAOYSA-N 2 0 372.553 4.464 20 0 FIADRP COc1ccc([C@H]2C[C@H]([N@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168616156 1122103957 /nfs/dbraw/zinc/10/39/57/1122103957.db2.gz LOCDVNJJSBKPGN-JWUVWSEFSA-N 2 0 358.526 4.040 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000128148474 1122196744 /nfs/dbraw/zinc/19/67/44/1122196744.db2.gz MMROEJMQVDPKEK-FUHWJXTLSA-N 2 0 374.916 4.054 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000262667282 1122410234 /nfs/dbraw/zinc/41/02/34/1122410234.db2.gz KUKFMOXPYXAXCX-KGVIQGDOSA-N 2 0 365.521 4.336 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](c1cc2ccccc2o1)C(C)(C)C)N1CC[NH+](C)CC1 ZINC000497833592 1122430310 /nfs/dbraw/zinc/43/03/10/1122430310.db2.gz WHCJECCXGDAWKR-DENIHFKCSA-N 2 0 371.569 4.382 20 0 FIADRP CN1CC[C@@H]([NH2+]CCc2ccc(Br)cc2)C[C@H]1c1ccccc1 ZINC000556093700 1122647579 /nfs/dbraw/zinc/64/75/79/1122647579.db2.gz KLCLANQIJBUZTQ-UXHICEINSA-N 2 0 373.338 4.417 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)s2)C[C@@H](C)O1 ZINC000069833381 1122690196 /nfs/dbraw/zinc/69/01/96/1122690196.db2.gz KCPGUUBYAZTRNO-HUUCEWRRSA-N 2 0 364.942 4.301 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cn2ccccc2n1 ZINC000556232816 1122749612 /nfs/dbraw/zinc/74/96/12/1122749612.db2.gz CQXJOHLZHBBNLV-IBGZPJMESA-N 2 0 362.521 4.417 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000130165819 1122767338 /nfs/dbraw/zinc/76/73/38/1122767338.db2.gz GEKYWHCESGIEIE-CTNGQTDRSA-N 2 0 372.553 4.040 20 0 FIADRP CCCC[N@H+](C)CC1CCN(CC(=O)Nc2c(C)cccc2Cl)CC1 ZINC000130549590 1122868246 /nfs/dbraw/zinc/86/82/46/1122868246.db2.gz REQHDZJQEFAOLK-UHFFFAOYSA-N 2 0 365.949 4.031 20 0 FIADRP CCc1noc(C2CCC([NH2+][C@H]3CCCC[C@@H]3C[NH+](CC)CC)CC2)n1 ZINC000498920937 1123078013 /nfs/dbraw/zinc/07/80/13/1123078013.db2.gz WYPAMCAGUKCEAZ-CHPDAQJUSA-N 2 0 362.562 4.148 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000498945225 1123094409 /nfs/dbraw/zinc/09/44/09/1123094409.db2.gz WWHTWZHPESBRQK-OAQYLSRUSA-N 2 0 357.542 4.136 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)[C@H]2CCC[C@@H]21 ZINC000556870151 1123151809 /nfs/dbraw/zinc/15/18/09/1123151809.db2.gz DAOWEFUOAKGFJA-YRXWBPOGSA-N 2 0 350.453 4.128 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556890430 1123176594 /nfs/dbraw/zinc/17/65/94/1123176594.db2.gz LKHDNBQLJQVCJZ-FMTHBJFDSA-N 2 0 370.581 4.472 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000131740989 1123177400 /nfs/dbraw/zinc/17/74/00/1123177400.db2.gz RNVFCHYFWGXLNM-DSKINZAPSA-N 2 0 362.558 4.119 20 0 FIADRP CC(C)OCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556891905 1123179622 /nfs/dbraw/zinc/17/96/22/1123179622.db2.gz HHVRNECLRFAXGC-DNVJHFABSA-N 2 0 358.570 4.472 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)CC1 ZINC000132002329 1123208663 /nfs/dbraw/zinc/20/86/63/1123208663.db2.gz GCQCNQRISKZQLG-NZQKXSOJSA-N 2 0 364.533 4.069 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+]CC4(c5ccccn5)CCC4)[C@@H]3C2)cc1 ZINC000556925575 1123226350 /nfs/dbraw/zinc/22/63/50/1123226350.db2.gz VGDWAZLWPUJYIH-BHDDXSALSA-N 2 0 361.533 4.004 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)cc1 ZINC000132500887 1123273859 /nfs/dbraw/zinc/27/38/59/1123273859.db2.gz XCHKSSNQEXYBCN-GHTZIAJQSA-N 2 0 363.615 4.110 20 0 FIADRP CCC(CC)[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)C ZINC000499146320 1123288050 /nfs/dbraw/zinc/28/80/50/1123288050.db2.gz KUOQYSVYUBGFKU-KAOXLYBCSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCC[C@H]1C ZINC000499148765 1123293261 /nfs/dbraw/zinc/29/32/61/1123293261.db2.gz DOJJNUPSXXVEJD-MRWXXAKJSA-N 2 0 355.570 4.035 20 0 FIADRP COc1cccc2c1CC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499196130 1123315454 /nfs/dbraw/zinc/31/54/54/1123315454.db2.gz RGVQFYGICYSSBU-ISHFTEKXSA-N 2 0 362.517 4.468 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000132688116 1123333635 /nfs/dbraw/zinc/33/36/35/1123333635.db2.gz BVGTYZVVHISSAH-XMMPIXPASA-N 2 0 366.549 4.447 20 0 FIADRP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1c(C)nn(C)c1C ZINC000499245970 1123363303 /nfs/dbraw/zinc/36/33/03/1123363303.db2.gz BQVRPDHXXTYRTJ-LRSLUSHPSA-N 2 0 366.553 4.273 20 0 FIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccccc2)cc1 ZINC000132827438 1123366066 /nfs/dbraw/zinc/36/60/66/1123366066.db2.gz UPFIRKHZLRPZRD-XUZZJYLKSA-N 2 0 364.533 4.061 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000074982096 1123437280 /nfs/dbraw/zinc/43/72/80/1123437280.db2.gz ARGPKGQMDLZAOP-AWEZNQCLSA-N 2 0 362.905 4.115 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCCCSc2ccccc2Br)CC[N@@H+]1C ZINC000133419773 1123485878 /nfs/dbraw/zinc/48/58/78/1123485878.db2.gz VQMSTUMUBOUYCH-LSDHHAIUSA-N 2 0 371.388 4.394 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000133466116 1123489793 /nfs/dbraw/zinc/48/97/93/1123489793.db2.gz USXJYDMYFNPYRR-UTKZUKDTSA-N 2 0 354.494 4.192 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(F)c1 ZINC000921069471 1123555201 /nfs/dbraw/zinc/55/52/01/1123555201.db2.gz LKLQYQRLWOIZAG-GOSISDBHSA-N 2 0 356.485 4.194 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cc3ccccc3o2)CC1 ZINC000236814288 1123568561 /nfs/dbraw/zinc/56/85/61/1123568561.db2.gz SRJYWWDBYHLZJQ-UHFFFAOYSA-N 2 0 363.505 4.255 20 0 FIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1ccc(-c2ccccc2Cl)o1 ZINC000237046883 1123591728 /nfs/dbraw/zinc/59/17/28/1123591728.db2.gz NJKGUVHBTHJYFV-HNNXBMFYSA-N 2 0 350.890 4.046 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(CO)c1 ZINC000245549866 1124118021 /nfs/dbraw/zinc/11/80/21/1124118021.db2.gz GYZATURYCFVEKU-RTBURBONSA-N 2 0 352.522 4.262 20 0 FIADRP COc1ccccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245689300 1124201232 /nfs/dbraw/zinc/20/12/32/1124201232.db2.gz KBBYHZGCHCPMMX-DKUWSORSSA-N 2 0 350.506 4.023 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1COc2ccccc21 ZINC000245738052 1124231964 /nfs/dbraw/zinc/23/19/64/1124231964.db2.gz RCPYBGDKNOFTEY-IWDBHXEASA-N 2 0 362.517 4.336 20 0 FIADRP CC(C)[NH+](CCC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)C(C)C ZINC000180273449 1124279639 /nfs/dbraw/zinc/27/96/39/1124279639.db2.gz ASQMPQCTRLIGPE-YQQQUEKLSA-N 2 0 367.578 4.015 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)C1 ZINC000246316855 1124443295 /nfs/dbraw/zinc/44/32/95/1124443295.db2.gz FAEZXDOOQXNMOI-KBXCAEBGSA-N 2 0 363.958 4.326 20 0 FIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccs1 ZINC000246541129 1124527609 /nfs/dbraw/zinc/52/76/09/1124527609.db2.gz VXFZUAIGDOGFTA-GBESFXJTSA-N 2 0 350.572 4.193 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1Br ZINC000246976176 1124578041 /nfs/dbraw/zinc/57/80/41/1124578041.db2.gz JUKPZXDQHUNNHO-HUUCEWRRSA-N 2 0 369.347 4.229 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000247177514 1124596059 /nfs/dbraw/zinc/59/60/59/1124596059.db2.gz SWCXFEUAANDTLB-FCCDEINASA-N 2 0 364.496 4.082 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3c2cnn3C)C1 ZINC000247183235 1124598046 /nfs/dbraw/zinc/59/80/46/1124598046.db2.gz VHAUQHVAIAGUQI-SVMVAKDDSA-N 2 0 366.553 4.065 20 0 FIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000248161992 1124747730 /nfs/dbraw/zinc/74/77/30/1124747730.db2.gz SGYHSOYJXZZQMG-APWZRJJASA-N 2 0 373.566 4.006 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(N2CCCC2=O)c1 ZINC000248409585 1124765383 /nfs/dbraw/zinc/76/53/83/1124765383.db2.gz WUFXWSIDAOHZKB-BJLQDIEVSA-N 2 0 369.553 4.117 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC000248432109 1124767105 /nfs/dbraw/zinc/76/71/05/1124767105.db2.gz CNMVMILHGIRBSW-IRLDBZIGSA-N 2 0 370.562 4.336 20 0 FIADRP c1ccc(CN2CCCO[C@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000248744928 1124808427 /nfs/dbraw/zinc/80/84/27/1124808427.db2.gz FHYUHVLWIDXNBR-CTNGQTDRSA-N 2 0 368.546 4.104 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)cn1 ZINC000249341975 1124854775 /nfs/dbraw/zinc/85/47/75/1124854775.db2.gz DOERPFFXKBJUNF-LJQANCHMSA-N 2 0 366.553 4.059 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215053 1124891108 /nfs/dbraw/zinc/89/11/08/1124891108.db2.gz YDYJDAKIGCXANJ-NRFANRHFSA-N 2 0 351.494 4.110 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215496 1124891601 /nfs/dbraw/zinc/89/16/01/1124891601.db2.gz BLVASNLZFMQCKW-ZWKOTPCHSA-N 2 0 353.510 4.088 20 0 FIADRP CC(C)[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091283723 1125060819 /nfs/dbraw/zinc/06/08/19/1125060819.db2.gz GCEPLOFFEUXGAZ-LJQANCHMSA-N 2 0 371.491 4.018 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285597 1125062310 /nfs/dbraw/zinc/06/23/10/1125062310.db2.gz ZIBDMCHFEGEQOX-QFBILLFUSA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000310897686 1125079118 /nfs/dbraw/zinc/07/91/18/1125079118.db2.gz MDKUPGTUWCQAHO-IBGZPJMESA-N 2 0 358.913 4.350 20 0 FIADRP Fc1ccc(-c2nc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)co2)cc1 ZINC000091739265 1125090755 /nfs/dbraw/zinc/09/07/55/1125090755.db2.gz SQGINXNOQHSFBN-UHFFFAOYSA-N 2 0 371.500 4.410 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000069711374 1125121099 /nfs/dbraw/zinc/12/10/99/1125121099.db2.gz RUAQDMLPYFPRTL-UHFFFAOYSA-N 2 0 350.462 4.177 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4cccs4)cc3)C2)CC1 ZINC000618283293 1125131618 /nfs/dbraw/zinc/13/16/18/1125131618.db2.gz GVXNMXXYRKXOMD-NRFANRHFSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H](CO)c3ccc(Cl)cc3)CC2)C1 ZINC000672619106 1125195911 /nfs/dbraw/zinc/19/59/11/1125195911.db2.gz IOBFRPLVQVSKPP-PLMTUMEDSA-N 2 0 364.961 4.049 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H](CO)c2ccc(Cl)cc2)CC1 ZINC000672620775 1125197697 /nfs/dbraw/zinc/19/76/97/1125197697.db2.gz ZFHKECPGXNUSJB-BLIXFSHQSA-N 2 0 364.961 4.049 20 0 FIADRP CC(C)c1ccc(C2(O)CCC([NH2+]C3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000182127140 1125250115 /nfs/dbraw/zinc/25/01/15/1125250115.db2.gz XYRNESMCRLCTCF-UHFFFAOYSA-N 2 0 358.570 4.403 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)ccc1OC ZINC000182123119 1125254187 /nfs/dbraw/zinc/25/41/87/1125254187.db2.gz BXMMFXDKSBHZTF-HNNXBMFYSA-N 2 0 361.917 4.436 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ncc(Br)cc1F ZINC000187010848 568044571 /nfs/dbraw/zinc/04/45/71/568044571.db2.gz WCQOLIVQUUFHNC-KGLIPLIRSA-N 2 0 372.326 4.146 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C)c(C)c2)CC1 ZINC000521431762 568047949 /nfs/dbraw/zinc/04/79/49/568047949.db2.gz RTCDMRCLXQBJDT-IBGZPJMESA-N 2 0 359.558 4.074 20 0 FIADRP COc1ccc(C2([NH2+]Cc3ccc(OCC[NH+](C)C)cc3)CCCC2)cc1 ZINC000604765537 568361885 /nfs/dbraw/zinc/36/18/85/568361885.db2.gz SIJRNKBPCZXFFX-UHFFFAOYSA-N 2 0 368.521 4.195 20 0 FIADRP Cc1cc2[nH]ccc2c(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)[nH+]1 ZINC001164995521 722202048 /nfs/dbraw/zinc/20/20/48/722202048.db2.gz NYCROGQOYDDIRW-JOCHJYFZSA-N 2 0 364.468 4.255 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)ccc1OC ZINC000182574612 1125572982 /nfs/dbraw/zinc/57/29/82/1125572982.db2.gz KSYDHQWNRWIWNX-QZTJIDSGSA-N 2 0 370.537 4.441 20 0 FIADRP Cc1cccc(OC[C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000619766609 1125687960 /nfs/dbraw/zinc/68/79/60/1125687960.db2.gz JYCYHHHTFPLFGS-FQEVSTJZSA-N 2 0 368.521 4.027 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000619822291 1125710035 /nfs/dbraw/zinc/71/00/35/1125710035.db2.gz KGBMONAHSDRMMU-VQTJNVASSA-N 2 0 358.526 4.021 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001648785949 1079583373 /nfs/dbraw/zinc/58/33/73/1079583373.db2.gz NCEKPRJJHFRPGE-HDICACEKSA-N 2 0 356.485 4.033 20 0 FIADRP Cc1cc(Cl)ccc1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000533409045 1080124403 /nfs/dbraw/zinc/12/44/03/1080124403.db2.gz QDAAOPGQCWBZTH-INIZCTEOSA-N 2 0 365.949 4.028 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[C@H]3COCC[C@H]3C2)cc1 ZINC001648795412 1080794589 /nfs/dbraw/zinc/79/45/89/1080794589.db2.gz OGUORQJEHUUYKZ-HGSOSGBHSA-N 2 0 356.554 4.356 20 0 FIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)o2)cc1C ZINC000123642109 1080929205 /nfs/dbraw/zinc/92/92/05/1080929205.db2.gz WNZDZRGPLLUBEN-SFHVURJKSA-N 2 0 370.541 4.468 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001648811443 1081126790 /nfs/dbraw/zinc/12/67/90/1081126790.db2.gz NXKCKGNBBGCZSW-IYBDPMFKSA-N 2 0 361.480 4.361 20 0 FIADRP Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000655719416 1081137927 /nfs/dbraw/zinc/13/79/27/1081137927.db2.gz SSOLZSGTNWGYOQ-HSZRJFAPSA-N 2 0 364.533 4.037 20 0 FIADRP Clc1ccc(C2([NH2+]C3CCN(C[C@@H]4CCCO4)CC3)CC2)cc1Cl ZINC000655741010 1081158541 /nfs/dbraw/zinc/15/85/41/1081158541.db2.gz BPMUXVKYUPSPEO-INIZCTEOSA-N 2 0 369.336 4.216 20 0 FIADRP COc1ccc([C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c2ccccc2Cl)cc1 ZINC000655804910 1081211456 /nfs/dbraw/zinc/21/14/56/1081211456.db2.gz FWMMZQZVRRXNIZ-LDBYXDLTSA-N 2 0 358.913 4.368 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cc2cc(Br)ccc2o1 ZINC000655805192 1081211682 /nfs/dbraw/zinc/21/16/82/1081211682.db2.gz KKPMGDHKBCYOFX-SLEUVZQESA-N 2 0 351.288 4.186 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806214 1081214484 /nfs/dbraw/zinc/21/44/84/1081214484.db2.gz RNXPQCMHPRBKJP-NXHRZFHOSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(CO)c1 ZINC000121235921 1081241076 /nfs/dbraw/zinc/24/10/76/1081241076.db2.gz AEDTZSVKENXPTR-LJQANCHMSA-N 2 0 352.522 4.262 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCC3(CCCC3)O2)CC1 ZINC000655851243 1081260276 /nfs/dbraw/zinc/26/02/76/1081260276.db2.gz CPDTVCHVGUKXQV-DENIHFKCSA-N 2 0 356.554 4.163 20 0 FIADRP COc1cccc(COc2ccc(C[NH2+]C[C@H](C)C[NH+]3CCCC3)cc2)c1 ZINC001648832900 1081272130 /nfs/dbraw/zinc/27/21/30/1081272130.db2.gz RNCLNUQAYHLPOV-IBGZPJMESA-N 2 0 368.521 4.096 20 0 FIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000397623089 1081327873 /nfs/dbraw/zinc/32/78/73/1081327873.db2.gz JPSCRMJIPSAQRR-QFIPXVFZSA-N 2 0 354.925 4.309 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@@H](C)Cc2ccccc2F)CC1 ZINC001648898389 1081355163 /nfs/dbraw/zinc/35/51/63/1081355163.db2.gz MVCNHOMQZPYUPP-IBGZPJMESA-N 2 0 369.528 4.079 20 0 FIADRP OC1(C[NH2+][C@H]2CCCCc3ccccc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397628048 1081360703 /nfs/dbraw/zinc/36/07/03/1081360703.db2.gz YWSIZYDDRAOZJG-QHCPKHFHSA-N 2 0 364.533 4.071 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2OCCc4ccccc42)C3)cc1 ZINC000683692375 1081390742 /nfs/dbraw/zinc/39/07/42/1081390742.db2.gz PQIIPDWDWGNWIU-KHUIQGCPSA-N 2 0 362.517 4.086 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H](OCc2ccccc2)c2ccc(Cl)cc2)C1 ZINC000580095126 1081588991 /nfs/dbraw/zinc/58/89/91/1081588991.db2.gz IXNWSZLXPVXFGV-NJYVYQBISA-N 2 0 358.913 4.457 20 0 FIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2ccncc2OCC[NH+](C)C)c1 ZINC000580240227 1081768833 /nfs/dbraw/zinc/76/88/33/1081768833.db2.gz GYVSUJRKIIGRBM-SFHVURJKSA-N 2 0 355.526 4.071 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3ccc(OC)cc3)n2)CC1 ZINC000047978071 1082065204 /nfs/dbraw/zinc/06/52/04/1082065204.db2.gz XIPFVDWJEDNXNA-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP C[NH2+]CCc1ccccc1C(=O)Nc1cccc2c1C[N@H+](CCC(C)C)C2 ZINC000580837796 1082182822 /nfs/dbraw/zinc/18/28/22/1082182822.db2.gz ZTINUYZKJZBQFJ-UHFFFAOYSA-N 2 0 365.521 4.063 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)CC[NH+](C)CC1 ZINC000581041607 1082287020 /nfs/dbraw/zinc/28/70/20/1082287020.db2.gz BOSUMGBFFZIQIY-CYBMUJFWSA-N 2 0 362.461 4.063 20 0 FIADRP CSc1ccc2c(c1)[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)CCC2 ZINC000581131714 1082335420 /nfs/dbraw/zinc/33/54/20/1082335420.db2.gz OVKDKVLWDAJFPB-GOSISDBHSA-N 2 0 350.597 4.203 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccncc2OCC[NH+](C)C)C[C@@H](c2ccccc2)C1 ZINC000581570561 1082670199 /nfs/dbraw/zinc/67/01/99/1082670199.db2.gz BCWBRBAGQHQLHQ-NYVOZVTQSA-N 2 0 367.537 4.084 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc2ccccc2c1 ZINC000656676182 1082709833 /nfs/dbraw/zinc/70/98/33/1082709833.db2.gz FZVKUKWXJDOUCD-GOSISDBHSA-N 2 0 352.522 4.381 20 0 FIADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000684367038 1082768382 /nfs/dbraw/zinc/76/83/82/1082768382.db2.gz KQOFVJILNXFVFS-YADHBBJMSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)C1 ZINC000647171286 1082772473 /nfs/dbraw/zinc/77/24/73/1082772473.db2.gz DWSYSRXXEMEJEB-GMAHTHKFSA-N 2 0 369.597 4.285 20 0 FIADRP CO[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000684378132 1082793781 /nfs/dbraw/zinc/79/37/81/1082793781.db2.gz ZBNCPVHJRHBYKW-OALUTQOASA-N 2 0 350.934 4.099 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCc3ccc(F)cc3F)c2)CC[N@@H+]1C ZINC000647186123 1082940679 /nfs/dbraw/zinc/94/06/79/1082940679.db2.gz CVRJZXHPDMJGKL-BEFAXECRSA-N 2 0 360.448 4.116 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccccc2OC(F)F)CC1 ZINC000471764511 1082961061 /nfs/dbraw/zinc/96/10/61/1082961061.db2.gz YHJOXLNJVLOMIF-LPHOPBHVSA-N 2 0 366.496 4.463 20 0 FIADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000510686178 1083238634 /nfs/dbraw/zinc/23/86/34/1083238634.db2.gz UOEKMHJPBBWAJD-IRLDBZIGSA-N 2 0 361.549 4.097 20 0 FIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1Cl ZINC000510739275 1083288798 /nfs/dbraw/zinc/28/87/98/1083288798.db2.gz XBLLKBYCOVIBGQ-OKZBNKHCSA-N 2 0 350.934 4.412 20 0 FIADRP COc1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c(-c2ccccc2)cc1OC ZINC000092253550 1083367615 /nfs/dbraw/zinc/36/76/15/1083367615.db2.gz FZBFSQDMFIJSQN-SFHVURJKSA-N 2 0 368.521 4.144 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2-n2ccnc2)cc1 ZINC000510902017 1083370014 /nfs/dbraw/zinc/37/00/14/1083370014.db2.gz XAQQXSMKHQXDLL-UHFFFAOYSA-N 2 0 362.477 4.357 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]C3CCC4(CCCO4)CC3)C3(CCC3)C2)cc1 ZINC000658318917 1083406410 /nfs/dbraw/zinc/40/64/10/1083406410.db2.gz UXEGCWXXHFVRBI-YNEXMFEJSA-N 2 0 368.565 4.370 20 0 FIADRP Brc1cc2c(s1)CC[C@@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353561 1083425340 /nfs/dbraw/zinc/42/53/40/1083425340.db2.gz OVDQTBYGEOYOHL-HNNXBMFYSA-N 2 0 369.372 4.210 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCc1ccc(Br)cc1)C1CC[NH+](C)CC1 ZINC000132527422 1083436261 /nfs/dbraw/zinc/43/62/61/1083436261.db2.gz XXWXOEUGSKVUJS-LSDHHAIUSA-N 2 0 353.348 4.090 20 0 FIADRP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]c3c(O)cccc23)[C@@H]1c1cccs1 ZINC000684575265 1083458230 /nfs/dbraw/zinc/45/82/30/1083458230.db2.gz GHFPTTIELDHMRQ-VBKZILBWSA-N 2 0 353.491 4.497 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000548483604 1083466502 /nfs/dbraw/zinc/46/65/02/1083466502.db2.gz VLXBSXCSTKXHLL-XLIONFOSSA-N 2 0 356.485 4.225 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)c1ccccc1 ZINC000548483541 1083468388 /nfs/dbraw/zinc/46/83/88/1083468388.db2.gz GOBWWXLAMJMSNF-RZUBCFFCSA-N 2 0 351.538 4.012 20 0 FIADRP CC(=O)Nc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000093844542 1083500896 /nfs/dbraw/zinc/50/08/96/1083500896.db2.gz YHJQSTZFHAEVDM-GOSISDBHSA-N 2 0 357.542 4.122 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000535808496 1083693416 /nfs/dbraw/zinc/69/34/16/1083693416.db2.gz IKYBXVNTYPRJTK-RBBKRZOGSA-N 2 0 360.505 4.049 20 0 FIADRP C[NH2+]CC1CC[NH+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000647494182 1084061469 /nfs/dbraw/zinc/06/14/69/1084061469.db2.gz BEAMPNCIOYUMBJ-UHFFFAOYSA-N 2 0 374.532 4.030 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+][C@H]2CCCOC2)c1 ZINC000133445393 1084132739 /nfs/dbraw/zinc/13/27/39/1084132739.db2.gz NMYMKRKUCGYXDQ-QFIPXVFZSA-N 2 0 350.506 4.218 20 0 FIADRP CCn1nc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c2ccccc21 ZINC000472042773 1084160957 /nfs/dbraw/zinc/16/09/57/1084160957.db2.gz RGONUCUDACCDHZ-UHFFFAOYSA-N 2 0 362.521 4.332 20 0 FIADRP c1cn(-c2csc(C[NH2+]CC3(CCOCc4ccccc4)CC3)c2)cn1 ZINC000472054285 1084196259 /nfs/dbraw/zinc/19/62/59/1084196259.db2.gz QXCPNVYQCGOAAK-UHFFFAOYSA-N 2 0 367.518 4.411 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)C1CC[NH+](C)CC1 ZINC000684677896 1084200371 /nfs/dbraw/zinc/20/03/71/1084200371.db2.gz IULDLAWAFHSFEC-DAXOMENPSA-N 2 0 369.322 4.154 20 0 FIADRP Oc1cc(F)cc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)c1 ZINC000472074034 1084243374 /nfs/dbraw/zinc/24/33/74/1084243374.db2.gz PMYYCORSGXQRLB-UHFFFAOYSA-N 2 0 362.876 4.187 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000537960153 1084255174 /nfs/dbraw/zinc/25/51/74/1084255174.db2.gz KISUAMZQIMKWJK-BULFRSBZSA-N 2 0 358.570 4.403 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)CC[C@@H]3CCCC[N@@H+]3C)cc2)CC1 ZINC000431730526 1084322231 /nfs/dbraw/zinc/32/22/31/1084322231.db2.gz VQUJZRQDXJTLJA-NRFANRHFSA-N 2 0 357.542 4.122 20 0 FIADRP C(=C\c1ccccc1)\C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531142184 1084361766 /nfs/dbraw/zinc/36/17/66/1084361766.db2.gz VQBQGWGAFDDWFA-QPEQYQDCSA-N 2 0 364.533 4.361 20 0 FIADRP C[C@@H](NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cc2n(n1)CCC2 ZINC000414055559 1084377833 /nfs/dbraw/zinc/37/78/33/1084377833.db2.gz CQORJYUSHVHLJY-ZWKOTPCHSA-N 2 0 352.526 4.055 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2c3ccccc3-c3ccccc32)cc1 ZINC000048683134 1084618688 /nfs/dbraw/zinc/61/86/88/1084618688.db2.gz VEUYVJFTSSKOMD-UHFFFAOYSA-N 2 0 358.485 4.487 20 0 FIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)[nH]c2c1 ZINC000657356250 1084706580 /nfs/dbraw/zinc/70/65/80/1084706580.db2.gz DDEQVGXTRRELGF-UHFFFAOYSA-N 2 0 363.505 4.241 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CC2 ZINC000414189865 1084777328 /nfs/dbraw/zinc/77/73/28/1084777328.db2.gz RMFRYKLIBNTATR-QGZVFWFLSA-N 2 0 356.267 4.182 20 0 FIADRP O=C(Nc1ccccc1Nc1cc[nH+]cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000684850872 1084949668 /nfs/dbraw/zinc/94/96/68/1084949668.db2.gz SIKQCYUKAMYBAT-UHFFFAOYSA-N 2 0 372.472 4.095 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000132737266 1085015671 /nfs/dbraw/zinc/01/56/71/1085015671.db2.gz WYNZUMZLTDMZTC-JXFKEZNVSA-N 2 0 351.519 4.297 20 0 FIADRP CC1=C[C@@H](C)C[C@H](C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)C1 ZINC000582577924 1085186513 /nfs/dbraw/zinc/18/65/13/1085186513.db2.gz FKVJNRAJCMCGMQ-KNQAVFIVSA-N 2 0 361.618 4.107 20 0 FIADRP Clc1ccc(-c2nc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)cs2)cc1 ZINC000564973401 1085225412 /nfs/dbraw/zinc/22/54/12/1085225412.db2.gz HMGKDMGFBZAZRM-INIZCTEOSA-N 2 0 361.942 4.285 20 0 FIADRP Cc1ncncc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000563415147 1085244952 /nfs/dbraw/zinc/24/49/52/1085244952.db2.gz BXNJTNDGAWQBAS-FGTMMUONSA-N 2 0 352.526 4.114 20 0 FIADRP Fc1cncc([C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000684955562 1085300700 /nfs/dbraw/zinc/30/07/00/1085300700.db2.gz QABUXRGNORKVOL-GCJKJVERSA-N 2 0 353.485 4.174 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2cc3cnccc3o2)CC1 ZINC000651703219 1085392780 /nfs/dbraw/zinc/39/27/80/1085392780.db2.gz RDIDKTHPKSBQDS-UHFFFAOYSA-N 2 0 369.896 4.483 20 0 FIADRP Cc1ncc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)cn1 ZINC000613776763 1085479423 /nfs/dbraw/zinc/47/94/23/1085479423.db2.gz LCLAVVDAJQTZRM-UHFFFAOYSA-N 2 0 372.516 4.338 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2csc(Cl)c2Cl)C[C@@H](C)O1 ZINC000432229643 1085686863 /nfs/dbraw/zinc/68/68/63/1085686863.db2.gz SPHSWGFJXDZCSO-VXGBXAGGSA-N 2 0 351.343 4.034 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000657612362 1085687910 /nfs/dbraw/zinc/68/79/10/1085687910.db2.gz MVPADZVUXDIGML-UHFFFAOYSA-N 2 0 363.427 4.102 20 0 FIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)c1 ZINC000657613727 1085700000 /nfs/dbraw/zinc/70/00/00/1085700000.db2.gz PYLJUQIYBFOHJW-GGAORHGYSA-N 2 0 364.537 4.005 20 0 FIADRP COc1ccc(OC)c(CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000090888401 1085906123 /nfs/dbraw/zinc/90/61/23/1085906123.db2.gz RYASCVAZRNIMLN-UHFFFAOYSA-N 2 0 360.542 4.023 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC000652348696 1085923704 /nfs/dbraw/zinc/92/37/04/1085923704.db2.gz NVZVQCSMMNRVLT-ZLNRFVROSA-N 2 0 356.554 4.453 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000652348450 1085927338 /nfs/dbraw/zinc/92/73/38/1085927338.db2.gz FESKZTPOJRTARD-JZXOWHBKSA-N 2 0 368.974 4.041 20 0 FIADRP FC(F)(F)C[C@H]1CC[NH+](CCCC[N@H+]2CC[C@H](CC(F)(F)F)C2)C1 ZINC000583063575 1086130221 /nfs/dbraw/zinc/13/02/21/1086130221.db2.gz AXECKMVWUJXTNF-ZIAGYGMSSA-N 2 0 360.386 4.315 20 0 FIADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000583063421 1086131846 /nfs/dbraw/zinc/13/18/46/1086131846.db2.gz SQKIQLDLPRJDCW-SIKLNZKXSA-N 2 0 350.506 4.184 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC(C)C)cc2)[C@@H](C)C1 ZINC000247167391 1086150994 /nfs/dbraw/zinc/15/09/94/1086150994.db2.gz UMKVFLYSISMJED-JQVVWYNYSA-N 2 0 362.558 4.261 20 0 FIADRP C[C@@](O)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000248880244 1086178026 /nfs/dbraw/zinc/17/80/26/1086178026.db2.gz KLYRBXOUCDBINF-KAOXLYBCSA-N 2 0 356.554 4.103 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@@H](C(=O)OC(C)(C)C)C2CC2)CC1 ZINC001167658710 1086387471 /nfs/dbraw/zinc/38/74/71/1086387471.db2.gz KOWORSNPDQJQNL-YLJYHZDGSA-N 2 0 364.574 4.083 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc(OC(F)(F)F)c1 ZINC000662281079 1086390439 /nfs/dbraw/zinc/39/04/39/1086390439.db2.gz IDPLNHWYVBDGRN-CYBMUJFWSA-N 2 0 350.384 4.082 20 0 FIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(OC(F)(F)F)cc1 ZINC000662283191 1086393509 /nfs/dbraw/zinc/39/35/09/1086393509.db2.gz RVDROEOIHAYEFA-ZDUSSCGKSA-N 2 0 350.384 4.082 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290895 1086396947 /nfs/dbraw/zinc/39/69/47/1086396947.db2.gz MPTLDNBMQDCZEE-ICSRJNTNSA-N 2 0 371.569 4.157 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297818 1086401170 /nfs/dbraw/zinc/40/11/70/1086401170.db2.gz SGXWCTUGXKNSKY-ICSRJNTNSA-N 2 0 371.569 4.157 20 0 FIADRP CCOC(=O)C1CCC([NH2+][C@@H]2CCCCCN(Cc3ccccc3)C2)CC1 ZINC000709645376 1086462924 /nfs/dbraw/zinc/46/29/24/1086462924.db2.gz KUGFNLYWMSWYMV-LZBANZJXSA-N 2 0 372.553 4.143 20 0 FIADRP Cc1nccc([C@H]2CCC[N@H+](Cc3cccc(C[NH+]4CCCCC4)c3)C2)n1 ZINC000662504901 1086475073 /nfs/dbraw/zinc/47/50/73/1086475073.db2.gz HEVXDLUWURVTAP-QFIPXVFZSA-N 2 0 364.537 4.151 20 0 FIADRP CN(c1ccccc1C[NH2+]CC1CCC(F)(F)CC1)C1CC[NH+](C)CC1 ZINC000500442266 1086477516 /nfs/dbraw/zinc/47/75/16/1086477516.db2.gz SUBSOEYOUOPDTD-UHFFFAOYSA-N 2 0 365.512 4.132 20 0 FIADRP C[C@H](C[NH2+]Cc1ncc(CN(C)C)s1)c1ccc(C(F)(F)F)cc1 ZINC000511979652 1086526873 /nfs/dbraw/zinc/52/68/73/1086526873.db2.gz YCMZQKLLMLGGDY-GFCCVEGCSA-N 2 0 357.445 4.117 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@H]1CCOC1 ZINC000165553361 1086536627 /nfs/dbraw/zinc/53/66/27/1086536627.db2.gz ONBUONGQEPPASL-GCJKJVERSA-N 2 0 361.489 4.113 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@H]1CCOC1 ZINC000165553216 1086536646 /nfs/dbraw/zinc/53/66/46/1086536646.db2.gz ONBUONGQEPPASL-AVRDEDQJSA-N 2 0 361.489 4.113 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000663466295 1086563764 /nfs/dbraw/zinc/56/37/64/1086563764.db2.gz QPCUAOJBWIOXRU-YJBOKZPZSA-N 2 0 367.459 4.189 20 0 FIADRP C[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1sccc1Br ZINC000663468940 1086570153 /nfs/dbraw/zinc/57/01/53/1086570153.db2.gz NOIAPLAPBRNZQX-TZMCWYRMSA-N 2 0 357.361 4.283 20 0 FIADRP COc1cc(OC)c([C@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663470150 1086573534 /nfs/dbraw/zinc/57/35/34/1086573534.db2.gz SLVMTBFLJAEBOB-GOEBONIOSA-N 2 0 366.933 4.130 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC001167823888 1086603867 /nfs/dbraw/zinc/60/38/67/1086603867.db2.gz AEJMRYPSSBJNPN-GOSISDBHSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@H]1c1ccc(OC)cc1 ZINC001167827196 1086620702 /nfs/dbraw/zinc/62/07/02/1086620702.db2.gz UQHJDEKRGJYCBQ-XLIONFOSSA-N 2 0 350.572 4.296 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167833456 1086665757 /nfs/dbraw/zinc/66/57/57/1086665757.db2.gz BHTZUCORNZFWOM-GGAORHGYSA-N 3 0 357.586 4.095 20 0 FIADRP CCOC(=O)CCC[N@H+](Cc1ccccc1)[C@H](C)CCC[NH+](CC)CC ZINC001167833641 1086665813 /nfs/dbraw/zinc/66/58/13/1086665813.db2.gz CTOPISOBMPLKES-HXUWFJFHSA-N 2 0 362.558 4.342 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-n3cccn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000080338781 1086675607 /nfs/dbraw/zinc/67/56/07/1086675607.db2.gz UCPFJBOKVJZOSK-DENIHFKCSA-N 2 0 360.505 4.015 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCC2(CN(Cc3ccccc3)C2)C1 ZINC001167834818 1086690270 /nfs/dbraw/zinc/69/02/70/1086690270.db2.gz NAUKWMRHAVEVRJ-NRFANRHFSA-N 2 0 357.586 4.095 20 0 FIADRP COc1cccc(OC)c1C[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000512044827 1086699168 /nfs/dbraw/zinc/69/91/68/1086699168.db2.gz ICOXYVGPPOBXJR-QUCCMNQESA-N 2 0 368.521 4.094 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccccc1-c1ccnn1C ZINC000512047270 1086705986 /nfs/dbraw/zinc/70/59/86/1086705986.db2.gz YPHJLYBNTVJJIF-UHFFFAOYSA-N 2 0 362.521 4.217 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001167835582 1086706139 /nfs/dbraw/zinc/70/61/39/1086706139.db2.gz RRRKYDVKVODTSI-QPTUXGOLSA-N 3 0 371.613 4.341 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001167838208 1086712046 /nfs/dbraw/zinc/71/20/46/1086712046.db2.gz RPEVCQAYSATKFC-OAQYLSRUSA-N 3 0 357.586 4.095 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427670398 1086748172 /nfs/dbraw/zinc/74/81/72/1086748172.db2.gz DXOWZCVLJYMPSN-QAPCUYQASA-N 2 0 369.475 4.435 20 0 FIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)CCCO2 ZINC000432426089 1086754447 /nfs/dbraw/zinc/75/44/47/1086754447.db2.gz YACSNAJLEVTGSM-NQIIRXRSSA-N 2 0 360.542 4.114 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccc(Cl)cc4)o3)C2)C1 ZINC000650706235 1086754608 /nfs/dbraw/zinc/75/46/08/1086754608.db2.gz GUOVMBVTCCDVLQ-BLIXFSHQSA-N 2 0 374.912 4.318 20 0 FIADRP Cc1ccccc1-c1cccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1 ZINC000650706564 1086756219 /nfs/dbraw/zinc/75/62/19/1086756219.db2.gz NMAHMVCEEYDXKL-WPFOTENUSA-N 2 0 364.533 4.380 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](CC3CCC(c4ccccc4)CC3)C2)C1 ZINC000650708991 1086763073 /nfs/dbraw/zinc/76/30/73/1086763073.db2.gz XVCTYWYQXNSJGK-VIKOFABESA-N 2 0 356.554 4.179 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432438975 1086770086 /nfs/dbraw/zinc/77/00/86/1086770086.db2.gz DYVYDLPALHEXSN-STCOUPBVSA-N 2 0 351.332 4.158 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000650722571 1086821492 /nfs/dbraw/zinc/82/14/92/1086821492.db2.gz WRNDGROPTKXVQS-QFUCXCTJSA-N 2 0 374.912 4.461 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000583588194 1086827124 /nfs/dbraw/zinc/82/71/24/1086827124.db2.gz TXXJYLXQMWARLS-NRFANRHFSA-N 2 0 373.928 4.306 20 0 FIADRP CCO[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000583660779 1086902779 /nfs/dbraw/zinc/90/27/79/1086902779.db2.gz MDMYYOSXXNQVBZ-WTIAFYNJSA-N 2 0 352.522 4.264 20 0 FIADRP c1[nH]nc2cc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)ccc12 ZINC000583709121 1086925634 /nfs/dbraw/zinc/92/56/34/1086925634.db2.gz JEBDLZSPMKSGQF-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650752465 1086951396 /nfs/dbraw/zinc/95/13/96/1086951396.db2.gz RDCMSRUAMLOMRG-HNNXBMFYSA-N 2 0 372.488 4.009 20 0 FIADRP CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000583780699 1086960198 /nfs/dbraw/zinc/96/01/98/1086960198.db2.gz ZCPIJJJMMANDGA-FQEVSTJZSA-N 2 0 350.466 4.167 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Br)c(F)c1 ZINC000650756499 1086968321 /nfs/dbraw/zinc/96/83/21/1086968321.db2.gz BXRNYXJQEOBWBF-LBPRGKRZSA-N 2 0 351.263 4.158 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(-n3ccnc3)cc2)CC1)CC1CC1 ZINC000536141628 1086986860 /nfs/dbraw/zinc/98/68/60/1086986860.db2.gz WMMDBMVEOTXQLF-UHFFFAOYSA-N 2 0 366.553 4.206 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000657815914 1087097363 /nfs/dbraw/zinc/09/73/63/1087097363.db2.gz RRNDJVLOMZUMSZ-UHFFFAOYSA-N 2 0 355.551 4.330 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000151796340 1087260177 /nfs/dbraw/zinc/26/01/77/1087260177.db2.gz GHUSDDDHAMNRAX-NSHDSACASA-N 2 0 365.732 4.002 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000080974189 1087290160 /nfs/dbraw/zinc/29/01/60/1087290160.db2.gz QINWVJWLMPBRCD-JSGCOSHPSA-N 2 0 357.845 4.054 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccnc1 ZINC000091281604 1087426214 /nfs/dbraw/zinc/42/62/14/1087426214.db2.gz KAHSHLYBPHXVAN-SELNLUPBSA-N 2 0 367.537 4.178 20 0 FIADRP C[C@H](NCc1ccccc1C[NH+]1CCCCC1)c1nc2ccccc2n1C ZINC000091267670 1087426272 /nfs/dbraw/zinc/42/62/72/1087426272.db2.gz DCWSNTCZYPSFQI-SFHVURJKSA-N 2 0 362.521 4.410 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cc2cnccc2o1 ZINC000657879778 1087522120 /nfs/dbraw/zinc/52/21/20/1087522120.db2.gz SZFOULLCWFNFCV-KRWDZBQOSA-N 2 0 365.477 4.153 20 0 FIADRP C[C@H]([NH2+][C@H](c1cnn(C)c1)C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685425675 1087565452 /nfs/dbraw/zinc/56/54/52/1087565452.db2.gz UWVSWOSKRAWNSB-HFSMHLIXSA-N 2 0 354.542 4.008 20 0 FIADRP C[C@H](CCSc1ccccc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000431599828 1087597296 /nfs/dbraw/zinc/59/72/96/1087597296.db2.gz KBAUVHMERLCHJZ-LJQANCHMSA-N 2 0 362.583 4.134 20 0 FIADRP CCOc1ccccc1CC[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508720460 1087622445 /nfs/dbraw/zinc/62/24/45/1087622445.db2.gz MSZNWCUQRTZMQK-SIKLNZKXSA-N 2 0 352.522 4.128 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccc(Cl)c1 ZINC000685644044 1087655119 /nfs/dbraw/zinc/65/51/19/1087655119.db2.gz HHUJHVRUDBZRAG-NRFANRHFSA-N 2 0 358.913 4.413 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000685662365 1087668219 /nfs/dbraw/zinc/66/82/19/1087668219.db2.gz FSDWPRMQGKBZJU-JPYJTQIMSA-N 2 0 352.522 4.299 20 0 FIADRP CCOC1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000657970520 1087682931 /nfs/dbraw/zinc/68/29/31/1087682931.db2.gz FNEOXJNFXCLEER-FQUXPLTJSA-N 2 0 356.554 4.224 20 0 FIADRP CCOC1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000657970519 1087683226 /nfs/dbraw/zinc/68/32/26/1087683226.db2.gz FNEOXJNFXCLEER-DSKNIHGZSA-N 2 0 356.554 4.224 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(F)cc1 ZINC000658142486 1087735404 /nfs/dbraw/zinc/73/54/04/1087735404.db2.gz ZNCFVNOYZLQGNA-GOTSBHOMSA-N 2 0 370.512 4.269 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](CC3CCC3)c3ccccc3)cc2)C1 ZINC000658136282 1087741805 /nfs/dbraw/zinc/74/18/05/1087741805.db2.gz GMMGYRRLRAIDNE-ZEQRLZLVSA-N 2 0 364.533 4.274 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](c3cccs3)C3CCCC3)cc2)C1 ZINC000658140664 1087745381 /nfs/dbraw/zinc/74/53/81/1087745381.db2.gz QOBDEHGQNQIKBY-UNMCSNQZSA-N 2 0 370.562 4.336 20 0 FIADRP Clc1ccc(C2CC([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000658168054 1087761652 /nfs/dbraw/zinc/76/16/52/1087761652.db2.gz VHOJHQZIMCTVMY-UHFFFAOYSA-N 2 0 369.940 4.483 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(F)c(F)c(F)c1 ZINC000658167761 1087764858 /nfs/dbraw/zinc/76/48/58/1087764858.db2.gz UGNFDNNANMGIBW-AWEZNQCLSA-N 2 0 363.427 4.062 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000424134866 1087785655 /nfs/dbraw/zinc/78/56/55/1087785655.db2.gz OEDPMICLQUUYQC-KDURUIRLSA-N 2 0 354.542 4.232 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000424299408 1087904500 /nfs/dbraw/zinc/90/45/00/1087904500.db2.gz JCRPPWDSRJOLEJ-OAHLLOKOSA-N 2 0 359.901 4.311 20 0 FIADRP COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000414342935 1087910402 /nfs/dbraw/zinc/91/04/02/1087910402.db2.gz PUYMWSBCMPBUMS-MWIHYIROSA-N 2 0 364.533 4.299 20 0 FIADRP Brc1cccc(-c2ccc(C[NH2+]C3CC[NH2+]CC3)s2)c1 ZINC000414783096 1087951152 /nfs/dbraw/zinc/95/11/52/1087951152.db2.gz GCRAIQAJBCSGRZ-UHFFFAOYSA-N 2 0 351.313 4.019 20 0 FIADRP C[C@@H](C[N@@H+]1CCCC12CC[NH+](C)CC2)c1cccc(Br)c1 ZINC000472598534 1087990979 /nfs/dbraw/zinc/99/09/79/1087990979.db2.gz LVUVOCSSFGFZMG-HNNXBMFYSA-N 2 0 351.332 4.113 20 0 FIADRP CC[N@H+](Cc1ccoc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000414385064 1088081723 /nfs/dbraw/zinc/08/17/23/1088081723.db2.gz DRCBTROVAVIBIZ-UHFFFAOYSA-N 2 0 356.514 4.301 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Cl)cc2Br)cc1 ZINC000414806209 1088151553 /nfs/dbraw/zinc/15/15/53/1088151553.db2.gz HKPKFZDDPRJCJN-NSHDSACASA-N 2 0 353.691 4.412 20 0 FIADRP COc1ccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c(C(F)(F)F)c1 ZINC001143478708 1088207682 /nfs/dbraw/zinc/20/76/82/1088207682.db2.gz KZJKHRCHJUHJFN-UHFFFAOYSA-N 2 0 370.459 4.268 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000163558478 1088211810 /nfs/dbraw/zinc/21/18/10/1088211810.db2.gz INUUZNMBMPZSOD-NSYGIPOTSA-N 2 0 358.551 4.117 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(OCC(F)(F)F)c(F)c2)cc1 ZINC000414813232 1088231172 /nfs/dbraw/zinc/23/11/72/1088231172.db2.gz SWODHYQIIRMFNJ-GFCCVEGCSA-N 2 0 356.363 4.076 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)C1(c2ccccc2)CCCC1 ZINC000472625953 1088490396 /nfs/dbraw/zinc/49/03/96/1088490396.db2.gz ZNGCWUCDRKFJBG-PMOQBDJRSA-N 2 0 370.581 4.244 20 0 FIADRP COc1cccc(Cl)c1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000514146356 1088796532 /nfs/dbraw/zinc/79/65/32/1088796532.db2.gz XCWVIHJHQPJODC-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP CCCC[N@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)[C@@H](CC)c1ccccc1 ZINC000514175275 1088861141 /nfs/dbraw/zinc/86/11/41/1088861141.db2.gz XFGXLQICXLDQRK-QFIPXVFZSA-N 2 0 373.585 4.229 20 0 FIADRP CO[C@H](C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000514248768 1088944965 /nfs/dbraw/zinc/94/49/65/1088944965.db2.gz VOJSUKMCJHGUSZ-OXFYSEKESA-N 2 0 350.934 4.270 20 0 FIADRP CCOc1cc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)ccc1OC ZINC000394415779 1088949564 /nfs/dbraw/zinc/94/95/64/1088949564.db2.gz ZEZLIGSMGLNRQR-HSZRJFAPSA-N 2 0 368.521 4.096 20 0 FIADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC(c3ccc(F)cc3)c3ccc(F)cc3)C2)C1 ZINC000430117392 1089006667 /nfs/dbraw/zinc/00/66/67/1089006667.db2.gz CPOPSKWHBYDQPI-JOCHJYFZSA-N 2 0 356.460 4.124 20 0 FIADRP Cc1cccc(NC(=O)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1C ZINC000415055386 1089099146 /nfs/dbraw/zinc/09/91/46/1089099146.db2.gz ORDRDRBNUXOTKQ-UTKZUKDTSA-N 2 0 353.510 4.090 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(OCc2ccncc2)cc1)c1ccccc1 ZINC000415054872 1089101022 /nfs/dbraw/zinc/10/10/22/1089101022.db2.gz NYARAZMILSBUNA-QHCPKHFHSA-N 2 0 361.489 4.230 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]C1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000415059686 1089109818 /nfs/dbraw/zinc/10/98/18/1089109818.db2.gz VJUHOJXVKATEQX-JOCHJYFZSA-N 2 0 371.956 4.374 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)c1 ZINC000415117149 1089178192 /nfs/dbraw/zinc/17/81/92/1089178192.db2.gz BTNFINSPIUISRM-VWNXMTODSA-N 2 0 364.533 4.380 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)s3)CC2)C1 ZINC000415119905 1089183132 /nfs/dbraw/zinc/18/31/32/1089183132.db2.gz FUHFNWSEDOPCCM-UYAOXDASSA-N 2 0 356.535 4.133 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1cccc2c1OCC[C@@H]2[NH+](C)C ZINC000435041539 1089220238 /nfs/dbraw/zinc/22/02/38/1089220238.db2.gz JOQKLURLHLTZOX-WTNAPCKOSA-N 2 0 365.521 4.004 20 0 FIADRP CCn1nccc1C1CC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000435024686 1089220675 /nfs/dbraw/zinc/22/06/75/1089220675.db2.gz FOIIQBVTJYFVDK-UHFFFAOYSA-N 2 0 368.569 4.241 20 0 FIADRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000514820713 1089498709 /nfs/dbraw/zinc/49/87/09/1089498709.db2.gz NUKURJMGPFZKNO-OAHLLOKOSA-N 2 0 358.498 4.156 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000580315329 1089547671 /nfs/dbraw/zinc/54/76/71/1089547671.db2.gz COQPSPCVPFXZLE-VQIMIIECSA-N 2 0 367.518 4.184 20 0 FIADRP C[C@@H]1C[C@@H](C[NH3+])CN1Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435374806 1089567215 /nfs/dbraw/zinc/56/72/15/1089567215.db2.gz YOWMZTHOFFTAGI-CABCVRRESA-N 2 0 360.933 4.128 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000514888563 1089576316 /nfs/dbraw/zinc/57/63/16/1089576316.db2.gz SMESYJKQJJUKNJ-FQEVSTJZSA-N 2 0 373.928 4.233 20 0 FIADRP c1cc(C[N@H+](Cc2ccc3ccccc3n2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000435681017 1089840641 /nfs/dbraw/zinc/84/06/41/1089840641.db2.gz JBLDUDNDCCOFKD-NRFANRHFSA-N 2 0 363.530 4.441 20 0 FIADRP Cc1ccccc1CCC[N@H+](Cc1nccs1)[C@H]1CC12CC[NH2+]CC2 ZINC000435694551 1089878374 /nfs/dbraw/zinc/87/83/74/1089878374.db2.gz LWHKUSJVAWGDJQ-IBGZPJMESA-N 2 0 355.551 4.028 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000314555394 1089966037 /nfs/dbraw/zinc/96/60/37/1089966037.db2.gz SMCALHDNXBEMKY-KRWDZBQOSA-N 2 0 351.332 4.289 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1 ZINC000415949830 1090027701 /nfs/dbraw/zinc/02/77/01/1090027701.db2.gz GQLZBQLYHUIIBW-KRWDZBQOSA-N 2 0 368.525 4.047 20 0 FIADRP CC(C)C[C@@H](CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000415968596 1090050037 /nfs/dbraw/zinc/05/00/37/1090050037.db2.gz CPHPYCKSNUWDLJ-UTKZUKDTSA-N 2 0 368.525 4.032 20 0 FIADRP CC[NH+](CC)CCCC1CCN(C(=O)C[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000416207613 1090255229 /nfs/dbraw/zinc/25/52/29/1090255229.db2.gz WKVSPEBSXFKSIW-QFIPXVFZSA-N 2 0 373.585 4.040 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)C1CC[NH+](C)CC1 ZINC000312267201 1090466918 /nfs/dbraw/zinc/46/69/18/1090466918.db2.gz GELREKUOGJLAJN-QRWLVFNGSA-N 2 0 373.541 4.341 20 0 FIADRP CCn1cncc1C[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000418076484 1091048170 /nfs/dbraw/zinc/04/81/70/1091048170.db2.gz JOIPEZQWNAUSHL-JOCHJYFZSA-N 2 0 366.553 4.026 20 0 FIADRP C[C@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500124698 1091051278 /nfs/dbraw/zinc/05/12/78/1091051278.db2.gz NSNYGCLCRVTKBK-WBVHZDCISA-N 2 0 354.460 4.473 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(OC(F)F)CC1 ZINC000651469312 1091052106 /nfs/dbraw/zinc/05/21/06/1091052106.db2.gz JWTIQTHWIHXUHE-HJZRJOMTSA-N 2 0 352.469 4.037 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000500244694 1091146565 /nfs/dbraw/zinc/14/65/65/1091146565.db2.gz ROFMTMKIKBGHPT-JOCHJYFZSA-N 2 0 356.485 4.323 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000390525830 1091182111 /nfs/dbraw/zinc/18/21/11/1091182111.db2.gz IYXDJGQIIOCBCY-ZJSXRUAMSA-N 2 0 365.565 4.009 20 0 FIADRP Cn1c(=O)ccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000652074988 1091326179 /nfs/dbraw/zinc/32/61/79/1091326179.db2.gz WZNWHNVHUQGPNR-IBGZPJMESA-N 2 0 373.585 4.032 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[NH+]1[C@H](C)CC[C@H]1C ZINC000511766247 1091651361 /nfs/dbraw/zinc/65/13/61/1091651361.db2.gz DGSYISHTLVXBEG-GUDVDZBRSA-N 2 0 357.542 4.262 20 0 FIADRP [NH2+]=C(NCCCC[NH3+])Nc1ccccc1-n1c2ccccc2c2ccccc21 ZINC001167884546 1091957726 /nfs/dbraw/zinc/95/77/26/1091957726.db2.gz WUCJJVGMYZHSQS-UHFFFAOYSA-N 2 0 371.488 4.459 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000512286059 1092010198 /nfs/dbraw/zinc/01/01/98/1092010198.db2.gz ADOCEWMLFDBZRI-ZSXJVMONSA-N 2 0 370.581 4.470 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512345380 1092091480 /nfs/dbraw/zinc/09/14/80/1092091480.db2.gz GJPRSEWLEJCQHF-XLUNNXEJSA-N 2 0 356.554 4.479 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccc(-n3ccnc3)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168011987 1092315429 /nfs/dbraw/zinc/31/54/29/1092315429.db2.gz USULPXHOVNEIBZ-PMACEKPBSA-N 2 0 374.532 4.404 20 0 FIADRP C[C@H]1CC([NH2+]CCOc2ccccc2F)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012042 1092332156 /nfs/dbraw/zinc/33/21/56/1092332156.db2.gz VEEQKGGUFFDLGM-ROUUACIJSA-N 2 0 356.485 4.236 20 0 FIADRP C[C@H]1CC([NH2+]CC2CCC3(COC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012826 1092376814 /nfs/dbraw/zinc/37/68/14/1092376814.db2.gz FOWGVZDJIPYLLS-OALUTQOASA-N 2 0 356.554 4.224 20 0 FIADRP C(=C/c1ccccc1)\C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000236709583 1092414328 /nfs/dbraw/zinc/41/43/28/1092414328.db2.gz VQBQGWGAFDDWFA-NTUHNPAUSA-N 2 0 364.533 4.361 20 0 FIADRP COc1ccc(F)c(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000549711149 1092710439 /nfs/dbraw/zinc/71/04/39/1092710439.db2.gz JSNDUFCGBSOKLZ-QGZVFWFLSA-N 2 0 356.485 4.356 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000549726897 1092723585 /nfs/dbraw/zinc/72/35/85/1092723585.db2.gz OOVTUCSVMSVAJG-RXVVDRJESA-N 2 0 364.574 4.133 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442782360 1092760373 /nfs/dbraw/zinc/76/03/73/1092760373.db2.gz PXBTWDHFFZQEPR-KHVVASAOSA-N 2 0 373.544 4.381 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](CCC(C)(C)C)CC2)cc1)C(C)C ZINC000110171486 1092787021 /nfs/dbraw/zinc/78/70/21/1092787021.db2.gz GXMYKEQIQPMOLJ-UHFFFAOYSA-N 2 0 373.585 4.111 20 0 FIADRP c1cc2cc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)ccc2[nH]1 ZINC000442820258 1092788941 /nfs/dbraw/zinc/78/89/41/1092788941.db2.gz KFBODLBSQYMZQM-WMTXJRDZSA-N 2 0 359.517 4.211 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC000575816320 1093063818 /nfs/dbraw/zinc/06/38/18/1093063818.db2.gz PCFUTSZBRATCPZ-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512660442 1093096774 /nfs/dbraw/zinc/09/67/74/1093096774.db2.gz NGNBYEBUKUSXJH-BHDDXSALSA-N 2 0 358.570 4.066 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]CC3CCCCCC3)C3(C2)CCOCC3)cc1 ZINC000549867914 1093104520 /nfs/dbraw/zinc/10/45/20/1093104520.db2.gz HQZBXOGGMDJKOD-QHCPKHFHSA-N 2 0 370.581 4.475 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@@H]1C ZINC000512673411 1093121130 /nfs/dbraw/zinc/12/11/30/1093121130.db2.gz QMTNXSCQHGAOBH-DNVFCKCGSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)N(O)C2(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168018834 1093173597 /nfs/dbraw/zinc/17/35/97/1093173597.db2.gz FLPXBCVMHYSHSA-HNJRGHQBSA-N 2 0 359.558 4.038 20 0 FIADRP C[C@@H]1CC(n2cc(CC[NH3+])c3ncccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168019203 1093180909 /nfs/dbraw/zinc/18/09/09/1093180909.db2.gz HMWRQVVKCRYHFA-QZTJIDSGSA-N 2 0 362.521 4.152 20 0 FIADRP Cc1ccnc(CCC[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168020392 1093211869 /nfs/dbraw/zinc/21/18/69/1093211869.db2.gz MXWBVSYTRNDVBR-JHDGKUDLSA-N 2 0 351.538 4.354 20 0 FIADRP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000443584874 1093285190 /nfs/dbraw/zinc/28/51/90/1093285190.db2.gz TXGNBUYMPFWZCA-BFUOFWGJSA-N 2 0 371.352 4.005 20 0 FIADRP OCCC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1ccccc1 ZINC000411470481 1093323540 /nfs/dbraw/zinc/32/35/40/1093323540.db2.gz JBVMFXQSIFAKDV-QHCPKHFHSA-N 2 0 352.522 4.276 20 0 FIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647788466 1093348196 /nfs/dbraw/zinc/34/81/96/1093348196.db2.gz JYRYOZPLWRTQBS-RRFJBIMHSA-N 2 0 353.491 4.034 20 0 FIADRP C[C@H](C[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)CC(C)(C)CC[NH3+] ZINC001168028055 1093529327 /nfs/dbraw/zinc/52/93/27/1093529327.db2.gz ODKYILOMBLEUOK-XUVXKRRUSA-N 3 0 359.602 4.419 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000433322022 1093583692 /nfs/dbraw/zinc/58/36/92/1093583692.db2.gz OXKOXTVABFRDBX-KRWDZBQOSA-N 2 0 364.493 4.334 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CC2(C(F)(F)F)CCC2)CC1 ZINC000512995417 1093645017 /nfs/dbraw/zinc/64/50/17/1093645017.db2.gz BRLRQINZOWHGFG-UHFFFAOYSA-N 2 0 369.475 4.041 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc4ccccc4n3)CC2)C1 ZINC000513052516 1093697524 /nfs/dbraw/zinc/69/75/24/1093697524.db2.gz RERTWTHWKWBPER-GCJKJVERSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000513063792 1093715836 /nfs/dbraw/zinc/71/58/36/1093715836.db2.gz IPMSNMKPHANNDL-UWJYYQICSA-N 2 0 365.496 4.492 20 0 FIADRP C[C@H]1CC(N(CC[NH3+])c2ccc(F)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168034065 1093735565 /nfs/dbraw/zinc/73/55/65/1093735565.db2.gz OEMDPWWNWOMVQT-ROUUACIJSA-N 2 0 355.501 4.032 20 0 FIADRP COCc1ccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168034493 1093753446 /nfs/dbraw/zinc/75/34/46/1093753446.db2.gz PTLIUIKOECLLFF-OALUTQOASA-N 2 0 352.522 4.364 20 0 FIADRP COc1ccc(CC[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1F ZINC000513080902 1093783031 /nfs/dbraw/zinc/78/30/31/1093783031.db2.gz GNDZLEVDRDSSFH-XLIONFOSSA-N 2 0 356.485 4.020 20 0 FIADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C1 ZINC000474469299 1093806607 /nfs/dbraw/zinc/80/66/07/1093806607.db2.gz CFKAJFIALSXAPM-FCHUYYIVSA-N 2 0 358.570 4.338 20 0 FIADRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)[C@H]1C ZINC000474466923 1093813829 /nfs/dbraw/zinc/81/38/29/1093813829.db2.gz BKXVWPBLHUPFNT-GHDARCQNSA-N 2 0 372.553 4.128 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)[C@@H](C)C1CCCCC1 ZINC000474473474 1093818585 /nfs/dbraw/zinc/81/85/85/1093818585.db2.gz JLQCVGALSGOCNX-RTBURBONSA-N 2 0 358.570 4.338 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000474480205 1093826286 /nfs/dbraw/zinc/82/62/86/1093826286.db2.gz ZOMDBWKNXGJTCK-QRVBRYPASA-N 2 0 362.558 4.440 20 0 FIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000474484351 1093830921 /nfs/dbraw/zinc/83/09/21/1093830921.db2.gz IEVBKYZZPPGYLX-KDURUIRLSA-N 2 0 354.542 4.232 20 0 FIADRP C[C@@H]1C[C@@H](N2CCC([NH3+])(CC3CCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036065 1093834981 /nfs/dbraw/zinc/83/49/81/1093834981.db2.gz TUVQIWCOYLGJNH-JHDGKUDLSA-N 2 0 369.597 4.412 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccnn2-c2ccccc2C)c1 ZINC000474494179 1093837977 /nfs/dbraw/zinc/83/79/77/1093837977.db2.gz UNJFPWBXYTZDNF-UHFFFAOYSA-N 2 0 362.521 4.312 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)C1CCSCC1 ZINC000474491598 1093844567 /nfs/dbraw/zinc/84/45/67/1093844567.db2.gz QMHLYDYOFVNJLI-KRWDZBQOSA-N 2 0 350.572 4.029 20 0 FIADRP COc1cccc(C[C@H]([NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)C2CC2)c1 ZINC000513393914 1094095582 /nfs/dbraw/zinc/09/55/82/1094095582.db2.gz JMCLJKJWUGRQAA-QFIPXVFZSA-N 2 0 356.485 4.007 20 0 FIADRP c1ccc(C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2cccnc2)nc1 ZINC000513495410 1094162141 /nfs/dbraw/zinc/16/21/41/1094162141.db2.gz PMZQHOAMHHOMMM-DEOSSOPVSA-N 2 0 372.516 4.146 20 0 FIADRP Cc1ccc2ncc(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)n2c1 ZINC000513500299 1094173093 /nfs/dbraw/zinc/17/30/93/1094173093.db2.gz LTEXZIYGTUBQON-PZJWPPBQSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2csc(C3CC3)n2)C[N@@H+]1Cc1ccccc1 ZINC000513500801 1094173910 /nfs/dbraw/zinc/17/39/10/1094173910.db2.gz OWWKLFCPPUTEMA-SJLPKXTDSA-N 2 0 355.551 4.411 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000513502231 1094173997 /nfs/dbraw/zinc/17/39/97/1094173997.db2.gz YGOQPOCPQVIIEX-TZIWHRDSSA-N 2 0 374.532 4.467 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]CC2=Cc3ccccc3OC2)C[N@@H+]1Cc1ccccc1 ZINC000513513834 1094186304 /nfs/dbraw/zinc/18/63/04/1094186304.db2.gz UWKXZBBWDVQKNG-CTNGQTDRSA-N 2 0 362.517 4.353 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000513523826 1094197104 /nfs/dbraw/zinc/19/71/04/1094197104.db2.gz CLJKSDUQFJVJGA-DENIHFKCSA-N 2 0 352.526 4.005 20 0 FIADRP Cc1cccc(C2(C[NH2+]C3C[C@@H](C)[NH+](Cc4ccccc4)[C@H](C)C3)CC2)n1 ZINC001168036913 1094326361 /nfs/dbraw/zinc/32/63/61/1094326361.db2.gz XVJJFYKFRUHHAR-WOJBJXKFSA-N 2 0 363.549 4.453 20 0 FIADRP COCCC[NH+]1CCC([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474606548 1094406181 /nfs/dbraw/zinc/40/61/81/1094406181.db2.gz LPEHKPQBVPQWFK-UHFFFAOYSA-N 2 0 373.368 4.407 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H]2CCC[C@H]21 ZINC000513703683 1094411559 /nfs/dbraw/zinc/41/15/59/1094411559.db2.gz YTAFXKCLPSWFPR-BHIFYINESA-N 2 0 350.506 4.195 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000501009099 1094418889 /nfs/dbraw/zinc/41/88/89/1094418889.db2.gz ZCWWNAAMWVPGPD-UHFFFAOYSA-N 2 0 372.384 4.234 20 0 FIADRP C[N@@H+](Cc1csc(C(C)(C)C)n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501033891 1094459279 /nfs/dbraw/zinc/45/92/79/1094459279.db2.gz SSYHNTNTZNEQIU-UHFFFAOYSA-N 2 0 358.555 4.184 20 0 FIADRP C[N@@H+](Cc1ccc(C(F)(F)F)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501083882 1094497257 /nfs/dbraw/zinc/49/72/57/1094497257.db2.gz VPIDCDASHVHJHG-UHFFFAOYSA-N 2 0 363.427 4.449 20 0 FIADRP COc1cc(F)cc(C[C@H](C)[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000453405418 1094573869 /nfs/dbraw/zinc/57/38/69/1094573869.db2.gz SLMZJBPADPCBGG-AQKFKSFVSA-N 2 0 356.485 4.190 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000501390336 1094676147 /nfs/dbraw/zinc/67/61/47/1094676147.db2.gz VRJYTFNWOFCKMZ-CQOQZXRMSA-N 2 0 363.549 4.262 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C[NH3+])c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000420364470 1094901130 /nfs/dbraw/zinc/90/11/30/1094901130.db2.gz CWRWOYWOUXKRRG-YJBOKZPZSA-N 2 0 364.436 4.080 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420373856 1094904464 /nfs/dbraw/zinc/90/44/64/1094904464.db2.gz GWYSQXIJHQUSCL-PJSAGSTRSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420386593 1094907281 /nfs/dbraw/zinc/90/72/81/1094907281.db2.gz VEJFNXIEBBODRF-PJSAGSTRSA-N 2 0 357.325 4.273 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2ccc(F)cc2F)CC1 ZINC000501776514 1094919998 /nfs/dbraw/zinc/91/99/98/1094919998.db2.gz OMVUYOFXZJTXQQ-INIZCTEOSA-N 2 0 354.485 4.096 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000474923318 1094922975 /nfs/dbraw/zinc/92/29/75/1094922975.db2.gz GABBJTKOLCPADY-DOADOZAASA-N 2 0 374.569 4.438 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2ccc(F)c(F)c2)CC1 ZINC000501785175 1094923935 /nfs/dbraw/zinc/92/39/35/1094923935.db2.gz KLTCLLDLSBZQPY-MRXNPFEDSA-N 2 0 354.485 4.096 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cnc(-c4ccncc4)s3)CC2)CC1 ZINC000443854844 1095110808 /nfs/dbraw/zinc/11/08/08/1095110808.db2.gz DAFASSVCUMAAJQ-UHFFFAOYSA-N 2 0 370.566 4.338 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000502282636 1095304405 /nfs/dbraw/zinc/30/44/05/1095304405.db2.gz OJYBICSKGRBHDW-MJGOQNOKSA-N 2 0 362.558 4.045 20 0 FIADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000502282591 1095304741 /nfs/dbraw/zinc/30/47/41/1095304741.db2.gz CNZMJUAVTKXRBA-PUHATCMVSA-N 2 0 356.554 4.226 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)CC1 ZINC000280953138 1095463185 /nfs/dbraw/zinc/46/31/85/1095463185.db2.gz IWLADRHVKYSOJF-JRRMTSHWSA-N 2 0 374.594 4.074 20 0 FIADRP COCCC[NH+]1CCC(NCc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000443979044 1095570043 /nfs/dbraw/zinc/57/00/43/1095570043.db2.gz MSJZIQYOTKBDQJ-UHFFFAOYSA-N 2 0 372.484 4.209 20 0 FIADRP CO[C@@H]1CCC[C@@H]2C[N@@H+]([C@@H]3C[C@@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)C[C@@H]21 ZINC001168050489 1095721504 /nfs/dbraw/zinc/72/15/04/1095721504.db2.gz BGGBUPCVJYQBFQ-NFVALVNTSA-N 2 0 356.554 4.175 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CC[C@@H]2CCC[N@@H+]2C)c2ccc(OC)cc2)cc1 ZINC000503076960 1096054411 /nfs/dbraw/zinc/05/44/11/1096054411.db2.gz WOVQFOICAPMELG-REWPJTCUSA-N 2 0 368.521 4.062 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H](c3ccc(F)cc3)C3CC3)cc2)CC1 ZINC000271754863 1096125365 /nfs/dbraw/zinc/12/53/65/1096125365.db2.gz SCJZCFJCKCHOAS-HSZRJFAPSA-N 2 0 368.496 4.023 20 0 FIADRP [NH3+]CC1CCC([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC1 ZINC000422721978 1096471649 /nfs/dbraw/zinc/47/16/49/1096471649.db2.gz WLQBFUNMQBGFJJ-UHFFFAOYSA-N 2 0 374.532 4.206 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000422736270 1096476331 /nfs/dbraw/zinc/47/63/31/1096476331.db2.gz GEEWHJCEEHIFFU-ZBFGXGADSA-N 2 0 355.345 4.092 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000422769362 1096486875 /nfs/dbraw/zinc/48/68/75/1096486875.db2.gz OTEVTTPRTZLNCV-VXWZWFMZSA-N 2 0 362.517 4.472 20 0 FIADRP Fc1ccc(SCCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422772001 1096487702 /nfs/dbraw/zinc/48/77/02/1096487702.db2.gz XSQACCBZEZVVKL-PZJWPPBQSA-N 2 0 372.509 4.153 20 0 FIADRP [NH3+][C@@H]1C[C@@H](NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000422778903 1096488750 /nfs/dbraw/zinc/48/87/50/1096488750.db2.gz FGMKEJRPCHZNAT-NHCUHLMSSA-N 2 0 355.913 4.039 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784244 1096490136 /nfs/dbraw/zinc/49/01/36/1096490136.db2.gz PKCISXYXRLDGBO-OFNKIYASSA-N 2 0 350.506 4.330 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@H](Cc3ccccc3)[C@@H](C)[NH3+])s2)cs1 ZINC000422796993 1096493275 /nfs/dbraw/zinc/49/32/75/1096493275.db2.gz KUQUIIJKMMNFRF-RDTXWAMCSA-N 2 0 371.575 4.271 20 0 FIADRP FC(F)(F)COCc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422805129 1096494926 /nfs/dbraw/zinc/49/49/26/1096494926.db2.gz GIGGAULDEYSCEZ-IPMKNSEASA-N 2 0 370.459 4.166 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OC(C)C ZINC000422805428 1096496227 /nfs/dbraw/zinc/49/62/27/1096496227.db2.gz GSIYKGYULUUKPT-CABCVRRESA-N 2 0 357.498 4.056 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H](Cc2ccccc2)[C@@H](C)[NH3+])cc1 ZINC000422811064 1096497344 /nfs/dbraw/zinc/49/73/44/1096497344.db2.gz TVCCZBYVVBXRFI-QQUTXWOLSA-N 2 0 352.522 4.011 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000422813889 1096498501 /nfs/dbraw/zinc/49/85/01/1096498501.db2.gz YUXJCKNCBBWYPL-VWNXMTODSA-N 2 0 371.484 4.094 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000422832371 1096501468 /nfs/dbraw/zinc/50/14/68/1096501468.db2.gz UTWMUJIRBQSDGN-ZSYWTGECSA-N 2 0 350.453 4.176 20 0 FIADRP COc1ccc(-c2csc(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)c2)cc1 ZINC000422818032 1096503774 /nfs/dbraw/zinc/50/37/74/1096503774.db2.gz FHRAPUKSTTWZEE-CQSZACIVSA-N 2 0 367.518 4.437 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000422843262 1096508860 /nfs/dbraw/zinc/50/88/60/1096508860.db2.gz HOSWHBFIUWPOJE-AWEZNQCLSA-N 2 0 359.464 4.290 20 0 FIADRP CC(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422891057 1096514961 /nfs/dbraw/zinc/51/49/61/1096514961.db2.gz UOVLJVKBDJUGOM-DNVJHFABSA-N 2 0 370.581 4.369 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422892308 1096516422 /nfs/dbraw/zinc/51/64/22/1096516422.db2.gz MPZQDXJVZYRABA-LSDHHAIUSA-N 2 0 357.498 4.058 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000422930941 1096528059 /nfs/dbraw/zinc/52/80/59/1096528059.db2.gz AEVYNPUCWOKBJL-ACJLOTCBSA-N 2 0 365.290 4.395 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422943868 1096529966 /nfs/dbraw/zinc/52/99/66/1096529966.db2.gz LCJLVPRNEUPHCV-YDZRNGNQSA-N 2 0 362.583 4.324 20 0 FIADRP Cc1ccc(COc2ccc(C[C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cc1 ZINC000422939501 1096530254 /nfs/dbraw/zinc/53/02/54/1096530254.db2.gz FWXDNNBKCUTWTE-ZYGDZFMBSA-N 2 0 364.533 4.378 20 0 FIADRP Clc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422943031 1096531322 /nfs/dbraw/zinc/53/13/22/1096531322.db2.gz XOAWDASOTQOTHD-IRFCIJBXSA-N 2 0 354.881 4.173 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)cc1OC ZINC000422917716 1096531825 /nfs/dbraw/zinc/53/18/25/1096531825.db2.gz GQIFXPQOXWQMDR-JLTOFOAXSA-N 2 0 362.901 4.164 20 0 FIADRP c1sc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)nc1-c1ccncc1 ZINC000422956886 1096539319 /nfs/dbraw/zinc/53/93/19/1096539319.db2.gz RHGWZVGQSAHWJU-CEXWTWQISA-N 2 0 370.566 4.038 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](COc1ccccc1)c1ccccc1 ZINC000422959612 1096539887 /nfs/dbraw/zinc/53/98/87/1096539887.db2.gz SVSJRXIDUASOEX-FDDCHVKYSA-N 2 0 361.489 4.320 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423005258 1096548283 /nfs/dbraw/zinc/54/82/83/1096548283.db2.gz QYFLGWOXYSHOJF-WIYYLYMNSA-N 2 0 372.896 4.084 20 0 FIADRP CC(C)N1CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423043158 1096558588 /nfs/dbraw/zinc/55/85/88/1096558588.db2.gz NNVPEBRAWYAWSK-CCKFTAQKSA-N 2 0 355.929 4.110 20 0 FIADRP CCCOc1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000423066299 1096562107 /nfs/dbraw/zinc/56/21/07/1096562107.db2.gz DKISOPDDMPOEMF-GMAHTHKFSA-N 2 0 366.505 4.129 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2cccc(F)c2o1 ZINC000423074850 1096563859 /nfs/dbraw/zinc/56/38/59/1096563859.db2.gz VSDXUXQRRJLTIQ-SDYXESRWSA-N 2 0 366.436 4.478 20 0 FIADRP Cc1oc2ccccc2c1CC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423051605 1096564951 /nfs/dbraw/zinc/56/49/51/1096564951.db2.gz OTIMMDCLHKXZLA-REWPJTCUSA-N 2 0 362.473 4.129 20 0 FIADRP c1ccc(COCCC2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000423052834 1096565303 /nfs/dbraw/zinc/56/53/03/1096565303.db2.gz QOLZEYAXYWTQNX-BHDDXSALSA-N 2 0 356.554 4.274 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089880 1096570840 /nfs/dbraw/zinc/57/08/40/1096570840.db2.gz WETDCLKTZGYCIL-SJBKTWHCSA-N 2 0 352.453 4.049 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000423093229 1096572201 /nfs/dbraw/zinc/57/22/01/1096572201.db2.gz GQNYMIZQFNBVMG-BQGCOEIASA-N 2 0 355.295 4.084 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423100982 1096575137 /nfs/dbraw/zinc/57/51/37/1096575137.db2.gz NFYKKZKXGFFJOD-RRMPHLOHSA-N 2 0 354.519 4.315 20 0 FIADRP Fc1cc(C2CC2)ccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423123499 1096578809 /nfs/dbraw/zinc/57/88/09/1096578809.db2.gz DZWCBMMHAPJHEK-RBBKRZOGSA-N 2 0 352.453 4.049 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423122575 1096579003 /nfs/dbraw/zinc/57/90/03/1096579003.db2.gz KAOPENDUCRXMCZ-HZPDHXFCSA-N 2 0 362.477 4.448 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423122712 1096579063 /nfs/dbraw/zinc/57/90/63/1096579063.db2.gz LAVLJJWDVHFAEP-HQYGPGPXSA-N 2 0 374.326 4.180 20 0 FIADRP CC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423125800 1096580259 /nfs/dbraw/zinc/58/02/59/1096580259.db2.gz AHMZEZJELVKRQY-WIYYLYMNSA-N 2 0 358.432 4.144 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000423106739 1096583126 /nfs/dbraw/zinc/58/31/26/1096583126.db2.gz OZDJNDPUQLCTNR-KSSFIOAISA-N 2 0 358.448 4.280 20 0 FIADRP Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)s2)cc1 ZINC000423108389 1096583720 /nfs/dbraw/zinc/58/37/20/1096583720.db2.gz RDGJOTSLDQRHDW-RCCFBDPRSA-N 2 0 361.942 4.474 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112047 1096586185 /nfs/dbraw/zinc/58/61/85/1096586185.db2.gz XGZVPQVDHFNTRE-DLVCFXQMSA-N 2 0 354.519 4.315 20 0 FIADRP Clc1ccccc1[C@H]1C[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423150892 1096588751 /nfs/dbraw/zinc/58/87/51/1096588751.db2.gz ZMIXPDXRUKYFGB-RDAXPCIFSA-N 2 0 368.908 4.432 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000423133180 1096590966 /nfs/dbraw/zinc/59/09/66/1096590966.db2.gz VRTVWVDRTPFVSV-GAJHUEQPSA-N 2 0 368.569 4.001 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000503950476 1096602747 /nfs/dbraw/zinc/60/27/47/1096602747.db2.gz UHFIVSARMDGUJI-OMQSBVIBSA-N 2 0 364.480 4.037 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423214013 1096619474 /nfs/dbraw/zinc/61/94/74/1096619474.db2.gz ODACKHVNNYWFGW-XJKSGUPXSA-N 2 0 361.942 4.430 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)[C@@H]1CCC[NH2+]C1 ZINC000423221826 1096621620 /nfs/dbraw/zinc/62/16/20/1096621620.db2.gz YIDQPQNIDFQYGO-JJRVBVJISA-N 2 0 359.514 4.304 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423228492 1096623791 /nfs/dbraw/zinc/62/37/91/1096623791.db2.gz ZVQIKBCKOFEJQV-QWRGUYRKSA-N 2 0 368.344 4.269 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)CCC2 ZINC000423257415 1096631294 /nfs/dbraw/zinc/63/12/94/1096631294.db2.gz JHNQBOGCXZNSSO-YOEHRIQHSA-N 2 0 359.514 4.306 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423255551 1096631874 /nfs/dbraw/zinc/63/18/74/1096631874.db2.gz CHCJNQZOLGRYKC-YOEHRIQHSA-N 2 0 359.514 4.306 20 0 FIADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423253844 1096631883 /nfs/dbraw/zinc/63/18/83/1096631883.db2.gz WNDYBFCSRFFDCR-MNOVXSKESA-N 2 0 365.237 4.118 20 0 FIADRP CCC([NH3+])(CC)C[NH2+][C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423283477 1096634081 /nfs/dbraw/zinc/63/40/81/1096634081.db2.gz FGUACJDKHCDDHI-QGZVFWFLSA-N 2 0 369.347 4.024 20 0 FIADRP CCC([NH3+])(CC)CN[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000423288810 1096635032 /nfs/dbraw/zinc/63/50/32/1096635032.db2.gz VENBGVOBRDWTKF-JTQLQIEISA-N 2 0 352.372 4.058 20 0 FIADRP CCC([NH3+])(CC)CN[C@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000423288811 1096635201 /nfs/dbraw/zinc/63/52/01/1096635201.db2.gz VENBGVOBRDWTKF-SNVBAGLBSA-N 2 0 352.372 4.058 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000423291488 1096636100 /nfs/dbraw/zinc/63/61/00/1096636100.db2.gz IMECAIKMSBVCMK-GTNSWQLSSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000423296222 1096644359 /nfs/dbraw/zinc/64/43/59/1096644359.db2.gz YPKWEABVQDPWPI-KZULUSFZSA-N 2 0 350.384 4.382 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccc(F)cc3)s2)CC[NH2+]CC1 ZINC000423380527 1096660310 /nfs/dbraw/zinc/66/03/10/1096660310.db2.gz DTTOSNHUCMTFLS-OAHLLOKOSA-N 2 0 362.514 4.221 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000423421312 1096669142 /nfs/dbraw/zinc/66/91/42/1096669142.db2.gz KBFYPKLGGLQYBB-CBGDNZLLSA-N 2 0 357.929 4.374 20 0 FIADRP CSC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423420260 1096669612 /nfs/dbraw/zinc/66/96/12/1096669612.db2.gz AJFQHXGRBIKCJO-BBWFWOEESA-N 2 0 358.473 4.087 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3F)s2)CC[NH2+]CC1 ZINC000423408808 1096673215 /nfs/dbraw/zinc/67/32/15/1096673215.db2.gz PCUYLNUBEWBIJV-OAHLLOKOSA-N 2 0 362.514 4.221 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423448716 1096679264 /nfs/dbraw/zinc/67/92/64/1096679264.db2.gz VKXLHRVYFZLPBE-OCBCSQNSSA-N 2 0 359.514 4.296 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423430552 1096682666 /nfs/dbraw/zinc/68/26/66/1096682666.db2.gz LBISZQGBKRHXTR-KDOFPFPSSA-N 2 0 369.347 4.024 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCSc3ccc(Br)cc32)C1 ZINC000423469718 1096692864 /nfs/dbraw/zinc/69/28/64/1096692864.db2.gz VPJYACFZKMDBGO-LNSITVRQSA-N 2 0 355.345 4.093 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCC2 ZINC000423474377 1096695527 /nfs/dbraw/zinc/69/55/27/1096695527.db2.gz HGSOLRUVZUVSPJ-PBHICJAKSA-N 2 0 359.514 4.448 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cc2cc(Br)ccc2o1 ZINC000423477991 1096697008 /nfs/dbraw/zinc/69/70/08/1096697008.db2.gz SUMSXKNDLRENLR-SLEUVZQESA-N 2 0 351.288 4.363 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423478691 1096697391 /nfs/dbraw/zinc/69/73/91/1096697391.db2.gz UJWNTZZVOBVZEM-XFQXTVEOSA-N 2 0 360.448 4.485 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423503727 1096701414 /nfs/dbraw/zinc/70/14/14/1096701414.db2.gz FYTKVJDSYJZDKT-FUHIMQAGSA-N 2 0 356.510 4.266 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2ccccc2Br)C1 ZINC000423508807 1096702205 /nfs/dbraw/zinc/70/22/05/1096702205.db2.gz OFBODZWTIFUPHH-SIXWZSSISA-N 2 0 359.311 4.256 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423483142 1096703545 /nfs/dbraw/zinc/70/35/45/1096703545.db2.gz PYMUUJKFJKSYBC-UYAOXDASSA-N 2 0 360.448 4.499 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423492563 1096705309 /nfs/dbraw/zinc/70/53/09/1096705309.db2.gz NQJWFINAPAFNFB-NJZAAPMLSA-N 2 0 367.324 4.266 20 0 FIADRP [NH3+]C1(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)C2CC3CC(C2)CC1C3 ZINC000423530378 1096708636 /nfs/dbraw/zinc/70/86/36/1096708636.db2.gz RHIRQZLREOUVQO-ZKHDVHNPSA-N 2 0 372.528 4.037 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423537769 1096715909 /nfs/dbraw/zinc/71/59/09/1096715909.db2.gz DNCWBNYHSOGSJF-KLIQENQMSA-N 2 0 355.551 4.081 20 0 FIADRP C[C@@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000423540676 1096716128 /nfs/dbraw/zinc/71/61/28/1096716128.db2.gz ABVALXZRAIULTC-GOSISDBHSA-N 2 0 363.505 4.077 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc2cc(Br)ccc2o1 ZINC000423541720 1096716315 /nfs/dbraw/zinc/71/63/15/1096716315.db2.gz LNOBYULSJLNJMJ-LMRQPLJMSA-N 2 0 363.299 4.234 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423541685 1096716567 /nfs/dbraw/zinc/71/65/67/1096716567.db2.gz LJMZQCVWDVFKHX-BIMLSOSBSA-N 2 0 369.734 4.068 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@H]3C1)CCC2 ZINC000423543575 1096717434 /nfs/dbraw/zinc/71/74/34/1096717434.db2.gz NGGMAFTWCSWMRF-LUXYFRNMSA-N 2 0 371.525 4.304 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(OCc2ccccc2)cc1 ZINC000423544484 1096717599 /nfs/dbraw/zinc/71/75/99/1096717599.db2.gz OGFUKCIABAELIB-ZHNGQKSSSA-N 2 0 350.506 4.304 20 0 FIADRP C[C@H](CCO)C1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCC1 ZINC000515439748 1098578576 /nfs/dbraw/zinc/57/85/76/1098578576.db2.gz LNMSXCCWYGTFNZ-JSRJAPPDSA-N 2 0 358.570 4.208 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCc2cccc(OC(F)(F)F)c2)CC1 ZINC000533010332 1098685654 /nfs/dbraw/zinc/68/56/54/1098685654.db2.gz XBCVDXBMXFZCPO-UHFFFAOYSA-N 2 0 358.448 4.180 20 0 FIADRP Cc1ncsc1C[N@H+](CCCc1ccc(Cl)cc1)C[C@H]1CC[NH2+]C1 ZINC000436058808 1098686206 /nfs/dbraw/zinc/68/62/06/1098686206.db2.gz ZPUZTAIOIJWUCQ-KRWDZBQOSA-N 2 0 363.958 4.149 20 0 FIADRP C[C@H](CC[NH2+]Cc1c[nH]nc1-c1ccsc1)[N@H+](C)Cc1ccccc1 ZINC000436241883 1098847377 /nfs/dbraw/zinc/84/73/77/1098847377.db2.gz LDPABSNTHJOYCT-MRXNPFEDSA-N 2 0 354.523 4.138 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436279024 1098881816 /nfs/dbraw/zinc/88/18/16/1098881816.db2.gz GHTQNTWSVDISND-UHFFFAOYSA-N 2 0 369.484 4.317 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436298709 1098910790 /nfs/dbraw/zinc/91/07/90/1098910790.db2.gz HGHGBTOWCPVVTK-OZOXKJRCSA-N 2 0 356.485 4.363 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1C ZINC000533309930 1098945981 /nfs/dbraw/zinc/94/59/81/1098945981.db2.gz GTOKMHSWBWKSFH-ZFWWWQNUSA-N 2 0 372.340 4.127 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000515900793 1099019564 /nfs/dbraw/zinc/01/95/64/1099019564.db2.gz YVBVXXIVKHIQHY-XZOQPEGZSA-N 2 0 368.496 4.023 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(Br)cs1 ZINC000658354094 1099103258 /nfs/dbraw/zinc/10/32/58/1099103258.db2.gz WYIVMXMSSFYOPD-GFCCVEGCSA-N 2 0 357.361 4.283 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1cccc(CN2CC[NH+](C)CC2)c1 ZINC001211996422 1099220457 /nfs/dbraw/zinc/22/04/57/1099220457.db2.gz YZKKLDBPHMRFRF-UHFFFAOYSA-N 2 0 366.553 4.019 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccc(-n2ccnc2)cc1 ZINC000516436052 1099465482 /nfs/dbraw/zinc/46/54/82/1099465482.db2.gz NXWWEXVYNKTZBC-ZDUSSCGKSA-N 2 0 361.367 4.464 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162277141 1099672386 /nfs/dbraw/zinc/67/23/86/1099672386.db2.gz HTKAYFOLCTTZKV-CVEARBPZSA-N 2 0 360.473 4.187 20 0 FIADRP C[NH2+]CCC1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000262017018 1099686388 /nfs/dbraw/zinc/68/63/88/1099686388.db2.gz WLDRTICXWKFWQK-UHFFFAOYSA-N 2 0 352.522 4.114 20 0 FIADRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000262024079 1099688649 /nfs/dbraw/zinc/68/86/49/1099688649.db2.gz YZEBZKUMJVCJMX-SFHVURJKSA-N 2 0 365.521 4.321 20 0 FIADRP CCC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000162484202 1099813273 /nfs/dbraw/zinc/81/32/73/1099813273.db2.gz QAOAVHXQGNHJRQ-GOSISDBHSA-N 2 0 358.357 4.062 20 0 FIADRP C[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693516 1099824044 /nfs/dbraw/zinc/82/40/44/1099824044.db2.gz CVCMDXPYEWRFFT-NQIIRXRSSA-N 2 0 372.940 4.357 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508698000 1099830561 /nfs/dbraw/zinc/83/05/61/1099830561.db2.gz KPYCSKMQAGRMIZ-QNWVGRARSA-N 3 0 357.586 4.141 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1OC(F)F ZINC000162557544 1099841717 /nfs/dbraw/zinc/84/17/17/1099841717.db2.gz NOVNXHLIXDJUPF-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@H](COc1ccc(F)cc1F)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702501 1099854896 /nfs/dbraw/zinc/85/48/96/1099854896.db2.gz ZILSBGHWGDQPLV-AOIWGVFYSA-N 2 0 374.475 4.232 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702684 1099857240 /nfs/dbraw/zinc/85/72/40/1099857240.db2.gz WHKNJEUQZNNMDK-RXVVDRJESA-N 2 0 367.537 4.259 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709833 1099899155 /nfs/dbraw/zinc/89/91/55/1099899155.db2.gz JWNLOLYUTWNSMH-GMHONNGPSA-N 2 0 364.533 4.407 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(-n2cccn2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712669 1099903159 /nfs/dbraw/zinc/90/31/59/1099903159.db2.gz RMVOUBRDVSVNQI-MZKRTTBSSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)COCc1ccccc1 ZINC000508712288 1099903749 /nfs/dbraw/zinc/90/37/49/1099903749.db2.gz QLRNQJPADKUIMM-LGVFNWMJSA-N 2 0 366.549 4.340 20 0 FIADRP C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722245 1099940112 /nfs/dbraw/zinc/94/01/12/1099940112.db2.gz WWZUFQXBUHBYPC-ICSRJNTNSA-N 2 0 352.497 4.358 20 0 FIADRP C/C(=C/c1ccccc1)C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000536665586 1100139197 /nfs/dbraw/zinc/13/91/97/1100139197.db2.gz RXBPCMQCBJQHID-VZCXRCSSSA-N 2 0 369.597 4.218 20 0 FIADRP Cc1ccc(C[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000459418350 1100145335 /nfs/dbraw/zinc/14/53/35/1100145335.db2.gz VHYCVSVGQUHZDS-XMMPIXPASA-N 2 0 372.516 4.327 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459431909 1100169147 /nfs/dbraw/zinc/16/91/47/1100169147.db2.gz ZBZYIUHDSAPVQQ-REWPJTCUSA-N 2 0 365.521 4.116 20 0 FIADRP CC[C@@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Oc1cccc(Cl)c1 ZINC000459447971 1100184461 /nfs/dbraw/zinc/18/44/61/1100184461.db2.gz VRTBFCLACOJNTB-IBGZPJMESA-N 2 0 359.901 4.151 20 0 FIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1F ZINC000459494327 1100249455 /nfs/dbraw/zinc/24/94/55/1100249455.db2.gz AOMOWTDAKZSAPO-UHFFFAOYSA-N 2 0 361.892 4.410 20 0 FIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000459562219 1100299529 /nfs/dbraw/zinc/29/95/29/1100299529.db2.gz NQFSOOFLOMFTFQ-DHBDYNCWSA-N 2 0 359.473 4.149 20 0 FIADRP C[C@@H]([NH2+]CCOc1ccccc1Cl)c1ccc(OCC[NH+](C)C)cc1 ZINC000536828520 1100326777 /nfs/dbraw/zinc/32/67/77/1100326777.db2.gz ULUKRAANYKJMBZ-MRXNPFEDSA-N 2 0 362.901 4.010 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000536824975 1100342367 /nfs/dbraw/zinc/34/23/67/1100342367.db2.gz DZUYQYPSVRWLJS-MJGOQNOKSA-N 2 0 354.494 4.102 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3Cl)CC2)[C@H](C)C1 ZINC000536853096 1100368423 /nfs/dbraw/zinc/36/84/23/1100368423.db2.gz PRBDNBAURUGOMJ-YLJYHZDGSA-N 2 0 364.961 4.098 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](c2cccs2)C2CCCC2)C[C@H](C)O1 ZINC000536857258 1100373580 /nfs/dbraw/zinc/37/35/80/1100373580.db2.gz KRFVCJUJJSJAEA-FUHIMQAGSA-N 2 0 350.572 4.458 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C[C@@H](C)O1 ZINC000536861954 1100379690 /nfs/dbraw/zinc/37/96/90/1100379690.db2.gz IKPHQBXLUAJAPT-IIDMSEBBSA-N 2 0 368.974 4.356 20 0 FIADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000459652837 1100395540 /nfs/dbraw/zinc/39/55/40/1100395540.db2.gz QVRQBYIKQFPSJM-SFTDATJTSA-N 2 0 365.565 4.478 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000438093290 1100416265 /nfs/dbraw/zinc/41/62/65/1100416265.db2.gz BUIKPXMIUOOSRJ-JTHBVZDNSA-N 2 0 358.570 4.320 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]C/C=C/c3ccccc3)cc2)C[C@@H](C)O1 ZINC000517538996 1100460495 /nfs/dbraw/zinc/46/04/95/1100460495.db2.gz VWIZDOLSTSJFHP-WOPDUGCTSA-N 2 0 350.506 4.099 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000517537224 1100475572 /nfs/dbraw/zinc/47/55/72/1100475572.db2.gz LXNXNELSYIBOBT-OALUTQOASA-N 2 0 368.569 4.337 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]CCCCOc3ccccc3)CC2)c1 ZINC000438196999 1100492639 /nfs/dbraw/zinc/49/26/39/1100492639.db2.gz APMCRXQSJYPAPU-UHFFFAOYSA-N 2 0 358.551 4.409 20 0 FIADRP COc1cccc(C2(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CC2)c1 ZINC000517629924 1100571924 /nfs/dbraw/zinc/57/19/24/1100571924.db2.gz BLGIRFPIEPKVSA-CVDCTZTESA-N 2 0 364.533 4.227 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC[NH2+]1 ZINC000414946490 1100902229 /nfs/dbraw/zinc/90/22/29/1100902229.db2.gz JSJLFUFZGSNCSF-GDBMZVCRSA-N 2 0 360.933 4.189 20 0 FIADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438829247 1100949107 /nfs/dbraw/zinc/94/91/07/1100949107.db2.gz ZJZTVZWMSMDEQF-SBOSXTITSA-N 2 0 358.570 4.470 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CC1 ZINC000438845537 1100952385 /nfs/dbraw/zinc/95/23/85/1100952385.db2.gz ZKEGRNHPIVCEMO-UHFFFAOYSA-N 3 0 357.586 4.328 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCN(c3ccccc3F)C2)CC1 ZINC000426296592 1101220716 /nfs/dbraw/zinc/22/07/16/1101220716.db2.gz STLSMRQRZXVAFB-YFVAEKQCSA-N 2 0 359.533 4.037 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccccc2Br)CCC1 ZINC000426327991 1101281002 /nfs/dbraw/zinc/28/10/02/1101281002.db2.gz WQRFKOFZJQXRDI-RKVPGOIHSA-N 2 0 365.359 4.189 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccccc2Br)CCC1 ZINC000426327992 1101281232 /nfs/dbraw/zinc/28/12/32/1101281232.db2.gz WQRFKOFZJQXRDI-RVKKMQEKSA-N 2 0 365.359 4.189 20 0 FIADRP CC1(C)Cc2c(cccc2Br)[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000426331242 1101291188 /nfs/dbraw/zinc/29/11/88/1101291188.db2.gz NHACVWOOGJIICH-LBTNJELSSA-N 2 0 363.343 4.289 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)[C@H]1OCCc2sccc21 ZINC000426342645 1101315625 /nfs/dbraw/zinc/31/56/25/1101315625.db2.gz MUULIVRPXLEGQR-GCKMJXCFSA-N 2 0 374.550 4.042 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)ccc1OCc1ccccc1 ZINC000459733355 1101351042 /nfs/dbraw/zinc/35/10/42/1101351042.db2.gz NKEHUBOTYQRAQL-IBGZPJMESA-N 2 0 368.521 4.096 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1OCCc2sccc21 ZINC000426355031 1101351694 /nfs/dbraw/zinc/35/16/94/1101351694.db2.gz XKWGKCOEHUQONI-ODULNIPZSA-N 2 0 370.562 4.251 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000459741300 1101366362 /nfs/dbraw/zinc/36/63/62/1101366362.db2.gz VGSFALYDSREOSR-QGZVFWFLSA-N 2 0 373.928 4.136 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000536958463 1101370845 /nfs/dbraw/zinc/37/08/45/1101370845.db2.gz IVCLZOOUACDARL-HXUWFJFHSA-N 2 0 353.466 4.082 20 0 FIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423026804 1101404586 /nfs/dbraw/zinc/40/45/86/1101404586.db2.gz CACNADUFVBHXFL-RBUKOAKNSA-N 2 0 370.368 4.207 20 0 FIADRP C[C@@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC000178742017 1101533487 /nfs/dbraw/zinc/53/34/87/1101533487.db2.gz UNQIYDDWPRMEFN-ICSRJNTNSA-N 2 0 357.542 4.027 20 0 FIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537308532 1101636256 /nfs/dbraw/zinc/63/62/56/1101636256.db2.gz RWKFQMCJLSHDHF-QGZVFWFLSA-N 2 0 354.469 4.317 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccccc2F)CC1 ZINC001168166600 1101782494 /nfs/dbraw/zinc/78/24/94/1101782494.db2.gz JXFMXVZITFAGIF-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP COc1ccc(C2([NH3+])CC[NH+]([C@@H](C)Cc3ccc(Cl)cc3)CC2)cc1 ZINC001168168923 1101840712 /nfs/dbraw/zinc/84/07/12/1101840712.db2.gz VTZWKACOPCJKPG-INIZCTEOSA-N 2 0 358.913 4.230 20 0 FIADRP CC[NH+](CC)[C@@H](C(=O)Nc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000519169023 1101982001 /nfs/dbraw/zinc/98/20/01/1101982001.db2.gz IZQXYNDMNBYWDT-JOCHJYFZSA-N 2 0 365.521 4.304 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(Cl)nc3)CC2)cc1 ZINC000179115997 1102014378 /nfs/dbraw/zinc/01/43/78/1102014378.db2.gz JIKJBNHOGKOUKT-MRXNPFEDSA-N 2 0 373.928 4.306 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)N[C@@H](C)c2ccccc2C)CC1 ZINC000519222205 1102019364 /nfs/dbraw/zinc/01/93/64/1102019364.db2.gz SFFBTFOBBXAMNJ-VQTJNVASSA-N 2 0 373.585 4.005 20 0 FIADRP FC(F)(F)c1cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc(C(F)(F)F)c1 ZINC000327908478 1102025250 /nfs/dbraw/zinc/02/52/50/1102025250.db2.gz QILPENUJUKUMJV-BETUJISGSA-N 2 0 366.349 4.156 20 0 FIADRP COc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2Cl)cc1OC ZINC000643465564 1102132206 /nfs/dbraw/zinc/13/22/06/1102132206.db2.gz WFBPJWJPWJELIK-IERDGZPVSA-N 2 0 374.912 4.178 20 0 FIADRP Fc1ccc(C2([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)cc1 ZINC000643467815 1102182386 /nfs/dbraw/zinc/18/23/86/1102182386.db2.gz UANDURNAVOHFBR-PZJWPPBQSA-N 2 0 352.453 4.050 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)c1 ZINC000061000072 1102187635 /nfs/dbraw/zinc/18/76/35/1102187635.db2.gz BQCHEOBPDZRQAL-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000187585702 1102286520 /nfs/dbraw/zinc/28/65/20/1102286520.db2.gz IKFNAQORNMPVMQ-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc(OC(F)F)c1 ZINC000120894199 1102295192 /nfs/dbraw/zinc/29/51/92/1102295192.db2.gz REJPXUNEHCSFFC-ZDUSSCGKSA-N 2 0 352.400 4.340 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cccc(CO)c1 ZINC000121229706 1102349214 /nfs/dbraw/zinc/34/92/14/1102349214.db2.gz OGMAVMJMVSIKEC-MOPGFXCFSA-N 2 0 352.522 4.404 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Br)c2)[C@@H](C)C1 ZINC000537635827 1102382183 /nfs/dbraw/zinc/38/21/83/1102382183.db2.gz ZDQLHQXDHLTUPY-VKJFTORMSA-N 2 0 353.348 4.215 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cccc(CO)c1 ZINC000121545750 1102413516 /nfs/dbraw/zinc/41/35/16/1102413516.db2.gz SLJVRSUFWVFCDR-IBGZPJMESA-N 2 0 352.522 4.406 20 0 FIADRP C[C@H](c1nnc(-c2ccccc2)o1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121670500 1102432913 /nfs/dbraw/zinc/43/29/13/1102432913.db2.gz RSYMFMABKDAWOV-GOSISDBHSA-N 2 0 368.525 4.386 20 0 FIADRP c1cc2c(c3c1CC[C@H]3CC[NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCO2 ZINC001167971211 1102438232 /nfs/dbraw/zinc/43/82/32/1102438232.db2.gz SPVBUUKWMMBTLL-UDEWTMQYSA-N 2 0 366.549 4.036 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCOc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC000532523441 1102441984 /nfs/dbraw/zinc/44/19/84/1102441984.db2.gz HTMGIBHQHFTLSB-UHFFFAOYSA-N 2 0 365.732 4.488 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC)c(Cl)c2)[C@H](C)C1 ZINC000122264376 1102553508 /nfs/dbraw/zinc/55/35/08/1102553508.db2.gz RMOATJYQPLOLOK-GJYPPUQNSA-N 2 0 368.949 4.136 20 0 FIADRP Cc1cc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)on1 ZINC000664835374 1102643031 /nfs/dbraw/zinc/64/30/31/1102643031.db2.gz FBBRXSZRTCIMHE-NRFANRHFSA-N 2 0 353.510 4.106 20 0 FIADRP Cc1cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC[NH+](Cc3ccccc3)CC2)on1 ZINC000664835376 1102644020 /nfs/dbraw/zinc/64/40/20/1102644020.db2.gz FBBRXSZRTCIMHE-OAQYLSRUSA-N 2 0 353.510 4.106 20 0 FIADRP COCC1(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000550861099 1102644623 /nfs/dbraw/zinc/64/46/23/1102644623.db2.gz WETNHCIGGUAJLC-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1 ZINC000550881680 1102651343 /nfs/dbraw/zinc/65/13/43/1102651343.db2.gz BDYZAMNLLFVBIF-NFBKMPQASA-N 2 0 364.533 4.266 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)ccn1 ZINC000550886299 1102658005 /nfs/dbraw/zinc/65/80/05/1102658005.db2.gz GUSWWWNTEQTLHE-ROUUACIJSA-N 2 0 353.510 4.173 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cn2ccccc2n1 ZINC000550886243 1102658469 /nfs/dbraw/zinc/65/84/69/1102658469.db2.gz NOKFQIKJNQAKAT-MOPGFXCFSA-N 2 0 362.521 4.417 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168253021 1102660781 /nfs/dbraw/zinc/66/07/81/1102660781.db2.gz VFBOTMRJDWCHLC-YPAWHYETSA-N 2 0 368.496 4.074 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953521 1102748250 /nfs/dbraw/zinc/74/82/50/1102748250.db2.gz AQHPLJAIBCBJQY-JOCHJYFZSA-N 2 0 372.516 4.079 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)Sc1ccccc1 ZINC000608067114 1102855911 /nfs/dbraw/zinc/85/59/11/1102855911.db2.gz WNNJNWYZPHBLIP-LJQANCHMSA-N 2 0 370.562 4.432 20 0 FIADRP CO[C@H](C[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cccc(Cl)c1 ZINC000551087733 1102906001 /nfs/dbraw/zinc/90/60/01/1102906001.db2.gz ZIVADIBLRLFMAF-PWRODBHTSA-N 2 0 358.913 4.453 20 0 FIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000459358596 1102912700 /nfs/dbraw/zinc/91/27/00/1102912700.db2.gz BKTSKKLISONWFQ-FDQBOKQBSA-N 2 0 362.517 4.353 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)nn(-c3ccc(F)cc3)c2C)CC1 ZINC000506892788 1102944974 /nfs/dbraw/zinc/94/49/74/1102944974.db2.gz FPUXCPLVNWLWNL-UHFFFAOYSA-N 2 0 372.532 4.182 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000551176115 1102948769 /nfs/dbraw/zinc/94/87/69/1102948769.db2.gz UOJALELOZIIAHO-OUFMZXHOSA-N 2 0 351.538 4.103 20 0 FIADRP Oc1cccc2c1CCC[C@@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000551267924 1103028545 /nfs/dbraw/zinc/02/85/45/1103028545.db2.gz XTWBTSBRSBEHFG-FQEVSTJZSA-N 2 0 356.535 4.333 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2c(C)nn(-c3cc(C)ccc3C)c2Cl)CC1 ZINC000729682331 1103037150 /nfs/dbraw/zinc/03/71/50/1103037150.db2.gz PUDOADMTCIDGLT-UHFFFAOYSA-N 2 0 374.960 4.272 20 0 FIADRP COc1cc([C@H](C)[NH2+]C2CCN(C3CC3)CC2)ccc1OC1CCCC1 ZINC000459378978 1103037680 /nfs/dbraw/zinc/03/76/80/1103037680.db2.gz SBAAGSPQNMSDJU-INIZCTEOSA-N 2 0 358.526 4.294 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccccc2-c2ccnn2C)CC1 ZINC000507212937 1103218477 /nfs/dbraw/zinc/21/84/77/1103218477.db2.gz OGVPXKXZKFNROX-UHFFFAOYSA-N 2 0 354.542 4.031 20 0 FIADRP Cc1ccc(-c2ncc(C[N@H+]3CC[C@@H](C4CC[NH+](C)CC4)C3)s2)cc1 ZINC000514693202 1103273125 /nfs/dbraw/zinc/27/31/25/1103273125.db2.gz KCVNMDDQTHJFFV-LJQANCHMSA-N 2 0 355.551 4.282 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551541142 1103320338 /nfs/dbraw/zinc/32/03/38/1103320338.db2.gz KSCQGJIZCJYODA-OAHLLOKOSA-N 2 0 361.917 4.436 20 0 FIADRP COc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000551541722 1103321107 /nfs/dbraw/zinc/32/11/07/1103321107.db2.gz WBRAOXTZXCRARQ-HNNXBMFYSA-N 2 0 359.901 4.190 20 0 FIADRP CCC[N@H+](Cc1ccc(-n2ccnc2)cc1)[C@H](C)C(=O)Nc1ccccc1 ZINC000507377061 1103332422 /nfs/dbraw/zinc/33/24/22/1103332422.db2.gz HQQJRPNISWUVLE-GOSISDBHSA-N 2 0 362.477 4.112 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccccc2)cc1OC ZINC000666995239 1103350610 /nfs/dbraw/zinc/35/06/10/1103350610.db2.gz HLJWPJRYJNAFIZ-LJQANCHMSA-N 2 0 366.505 4.135 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc4ccccc4o3)cc2)CC1 ZINC000551569416 1103371771 /nfs/dbraw/zinc/37/17/71/1103371771.db2.gz HLYCZIIXWHTNHR-UHFFFAOYSA-N 2 0 350.462 4.196 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000507459369 1103403067 /nfs/dbraw/zinc/40/30/67/1103403067.db2.gz FUGPYZVKESFTKZ-FJIJXJHWSA-N 2 0 359.517 4.211 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cnn1-c1cccc(Cl)c1 ZINC000507476551 1103421682 /nfs/dbraw/zinc/42/16/82/1103421682.db2.gz JVPCJZVTDLBAML-OAHLLOKOSA-N 2 0 360.933 4.217 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]CCc4ccc5ccccc5n4)[C@H]3C2)cc1 ZINC000507519019 1103463775 /nfs/dbraw/zinc/46/37/75/1103463775.db2.gz GQZBXBDWPMVYMT-RSEQLOHWSA-N 2 0 371.528 4.278 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000551811196 1103693918 /nfs/dbraw/zinc/69/39/18/1103693918.db2.gz AAQHKUOEWFDALY-QHCPKHFHSA-N 2 0 368.496 4.466 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCc4cc(F)ccc43)cc2)CC1 ZINC000551812613 1103694226 /nfs/dbraw/zinc/69/42/26/1103694226.db2.gz NYKCMFURBCRZBA-QFIPXVFZSA-N 2 0 354.469 4.076 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000187996997 1103733904 /nfs/dbraw/zinc/73/39/04/1103733904.db2.gz QVUGGMKIAPWIIX-PBFPGSCMSA-N 2 0 358.423 4.194 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cnn(-c3ccccc3)c2)CC1 ZINC000514098535 1103782073 /nfs/dbraw/zinc/78/20/73/1103782073.db2.gz HQZAZVJBHQRQTH-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])on1 ZINC000519763920 1103835370 /nfs/dbraw/zinc/83/53/70/1103835370.db2.gz HYGDQQBPRITAPU-QFBILLFUSA-N 2 0 365.477 4.111 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(-c3ccccc3)nc3ccccn32)[C@H](C)C1 ZINC000440688626 1103888596 /nfs/dbraw/zinc/88/85/96/1103888596.db2.gz GSRRJAVXKIBUAJ-QUCCMNQESA-N 2 0 362.521 4.163 20 0 FIADRP CC[NH+]1CCC([NH2+]CCc2ccc(Oc3ccc(OC)cc3)cc2)CC1 ZINC000538197414 1104033156 /nfs/dbraw/zinc/03/31/56/1104033156.db2.gz GKWACRYYJQHRFV-UHFFFAOYSA-N 2 0 354.494 4.104 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2)C2CCCCC2)CC1 ZINC000538274875 1104094630 /nfs/dbraw/zinc/09/46/30/1104094630.db2.gz LHMRDEFVAJUDST-HSZRJFAPSA-N 2 0 357.586 4.315 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000246885651 1104211203 /nfs/dbraw/zinc/21/12/03/1104211203.db2.gz FCVWDAWMIHZSOM-GIWBLDEGSA-N 2 0 368.496 4.335 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc4ccccc4c3)cn2)CC1 ZINC000112529232 1104375042 /nfs/dbraw/zinc/37/50/42/1104375042.db2.gz FYKQARLWNMTWBP-IBGZPJMESA-N 2 0 374.532 4.228 20 0 FIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441419135 1104399332 /nfs/dbraw/zinc/39/93/32/1104399332.db2.gz JJURSYUUAFFQPX-UGKGYDQZSA-N 2 0 350.506 4.167 20 0 FIADRP Cc1ccccc1O[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995737 1104558219 /nfs/dbraw/zinc/55/82/19/1104558219.db2.gz PFPFKPVJLJTQKR-PJEZACDQSA-N 2 0 354.538 4.244 20 0 FIADRP Cc1cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc(C)c1OCc1ccccn1 ZINC000237186676 1105002720 /nfs/dbraw/zinc/00/27/20/1105002720.db2.gz DVYQCSDJTPJQBM-RBBKRZOGSA-N 2 0 367.537 4.240 20 0 FIADRP Fc1cccc(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001168004336 1105033570 /nfs/dbraw/zinc/03/35/70/1105033570.db2.gz SYTRKYBQYNLFAF-AIZNXBIQSA-N 2 0 356.529 4.486 20 0 FIADRP C[C@@H]1CC(NC(=[NH2+])c2ccc(Cl)nc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008126 1105159185 /nfs/dbraw/zinc/15/91/85/1105159185.db2.gz CTJRMMJYALOGQE-HUUCEWRRSA-N 2 0 356.901 4.092 20 0 FIADRP CC[C@@H]1C[C@H](C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCO1 ZINC000507809873 1105175594 /nfs/dbraw/zinc/17/55/94/1105175594.db2.gz FQEQHJPFZFDARW-ODAXIHTASA-N 2 0 356.554 4.178 20 0 FIADRP Brc1csc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192931632 1106905559 /nfs/dbraw/zinc/90/55/59/1106905559.db2.gz PLQAVYFXFSVDQH-HNNXBMFYSA-N 2 0 365.340 4.122 20 0 FIADRP CCc1ccc([C@@H](CC(C)C)[NH+]2CCC(n3ncc4c3C[NH2+]C4)CC2)cc1 ZINC000530226857 1106916394 /nfs/dbraw/zinc/91/63/94/1106916394.db2.gz UIWMVCSLUHJSRI-JOCHJYFZSA-N 2 0 366.553 4.473 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530241012 1106922013 /nfs/dbraw/zinc/92/20/13/1106922013.db2.gz OVPKIIAHLLZTSP-CZUORRHYSA-N 2 0 357.325 4.145 20 0 FIADRP Cc1cc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301717555 1107121839 /nfs/dbraw/zinc/12/18/39/1107121839.db2.gz ODMBNSLSMVARSU-RDTXWAMCSA-N 2 0 361.436 4.065 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152434274 1107454557 /nfs/dbraw/zinc/45/45/57/1107454557.db2.gz KZVGBAQAQQCUGX-WZONZLPQSA-N 2 0 368.496 4.192 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000475577523 1107789206 /nfs/dbraw/zinc/78/92/06/1107789206.db2.gz ZBEIYJCPGCQEJR-PXNSSMCTSA-N 2 0 350.441 4.141 20 0 FIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000531688940 1108055119 /nfs/dbraw/zinc/05/51/19/1108055119.db2.gz MOVFMOQHVCZWNU-AQNXPRMDSA-N 2 0 352.522 4.455 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1C ZINC000531710489 1108089266 /nfs/dbraw/zinc/08/92/66/1108089266.db2.gz SHZNBABAHPUCFR-QPPBQGQZSA-N 2 0 365.565 4.251 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531709925 1108089609 /nfs/dbraw/zinc/08/96/09/1108089609.db2.gz BTBGVUHCNPJBJX-BJKOFHAPSA-N 2 0 365.565 4.278 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)CC(=O)Nc1ccccc1C ZINC000531726009 1108097425 /nfs/dbraw/zinc/09/74/25/1108097425.db2.gz ZBSJOVDVZKFZLQ-IRFCIJBXSA-N 2 0 359.558 4.202 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3csc(C)c3)cc2)CC1 ZINC000453060251 1108136754 /nfs/dbraw/zinc/13/67/54/1108136754.db2.gz JPSNATYXRQSTSV-GOSISDBHSA-N 2 0 357.567 4.045 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](CC)CC1)c1ccncc1 ZINC000453102856 1108171826 /nfs/dbraw/zinc/17/18/26/1108171826.db2.gz QNQCGWBGSHIAGL-UWJYYQICSA-N 2 0 370.516 4.165 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453194811 1108264430 /nfs/dbraw/zinc/26/44/30/1108264430.db2.gz IGLUSVHWENVHJE-QTEQDKRBSA-N 2 0 351.538 4.293 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2sccc21 ZINC000453198628 1108267762 /nfs/dbraw/zinc/26/77/62/1108267762.db2.gz QHUUNOIGCCPYCJ-MOXGXCLJSA-N 2 0 356.535 4.043 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncn1 ZINC000453231310 1108303725 /nfs/dbraw/zinc/30/37/25/1108303725.db2.gz XTVHCCYALQEPPH-QIOKEVSGSA-N 2 0 370.928 4.395 20 0 FIADRP c1ccc(CN2CCC([NH2+][C@@H]3CSCCc4ccccc43)CC2)cc1 ZINC000531932761 1108401807 /nfs/dbraw/zinc/40/18/07/1108401807.db2.gz XPAIZAQEEBMOTC-JOCHJYFZSA-N 2 0 352.547 4.271 20 0 FIADRP C[N@H+](Cc1ccccc1)C1(CN[C@H]2CC[NH+]3CCC[C@H]3C2)CCCCC1 ZINC000714226702 1108402243 /nfs/dbraw/zinc/40/22/43/1108402243.db2.gz OAWUAYHBLAJUKD-VXKWHMMOSA-N 2 0 355.570 4.038 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccccc1C[NH+](C)C1CCCCC1 ZINC000531939142 1108416341 /nfs/dbraw/zinc/41/63/41/1108416341.db2.gz XOKDIVRYBJYSGO-SELNLUPBSA-N 3 0 357.586 4.269 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC[C@]4(CCSC4)C2)C3)cc1 ZINC000453353467 1108452809 /nfs/dbraw/zinc/45/28/09/1108452809.db2.gz JEPVYILWXPZJAY-LRSLUSHPSA-N 2 0 356.579 4.401 20 0 FIADRP CCC1(C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)COC1 ZINC000453382503 1108467512 /nfs/dbraw/zinc/46/75/12/1108467512.db2.gz SJYOXXIXETYHOP-OAQYLSRUSA-N 2 0 362.533 4.395 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCCOc2cc(Br)ccc21)C1CC1 ZINC000453389407 1108476582 /nfs/dbraw/zinc/47/65/82/1108476582.db2.gz CHUUDVNLRZFJNW-KRWDZBQOSA-N 2 0 367.331 4.127 20 0 FIADRP CC[C@H](C[NH2+]C1CC[NH+](C(C)C)CC1)Cc1cccc(Br)c1 ZINC000531969147 1108479178 /nfs/dbraw/zinc/47/91/78/1108479178.db2.gz JAMDAUIPIOXOEB-INIZCTEOSA-N 2 0 367.375 4.480 20 0 FIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000453375608 1108494279 /nfs/dbraw/zinc/49/42/79/1108494279.db2.gz XYUFOVXBZZLOOD-ITQWMJHLSA-N 2 0 357.325 4.364 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCc2c1ccc(F)c2Br)C1CC1 ZINC000453395316 1108526597 /nfs/dbraw/zinc/52/65/97/1108526597.db2.gz HSFDQVGALDOKJV-MRXNPFEDSA-N 2 0 355.295 4.040 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC1=Cc2ccccc2OC1 ZINC000532119770 1108678458 /nfs/dbraw/zinc/67/84/58/1108678458.db2.gz GMDFKBJPVSYSNJ-HROJSSOGSA-N 2 0 362.517 4.209 20 0 FIADRP c1ccc2c(c1)CCSC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532200118 1108705223 /nfs/dbraw/zinc/70/52/23/1108705223.db2.gz QOHHIRVQQXKALK-QFIPXVFZSA-N 2 0 352.547 4.403 20 0 FIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000532227109 1108723513 /nfs/dbraw/zinc/72/35/13/1108723513.db2.gz OQDHLEPPQQPLOV-IBGZPJMESA-N 2 0 368.521 4.329 20 0 FIADRP CC(C)CCn1cccc1C[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000524114676 1108834842 /nfs/dbraw/zinc/83/48/42/1108834842.db2.gz KQRJHGDBSFTAHI-UHFFFAOYSA-N 2 0 353.554 4.331 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](CCC)C2CC[NH2+]CC2)cc1OC ZINC000469988902 1109295049 /nfs/dbraw/zinc/29/50/49/1109295049.db2.gz ARGNZLWZCBAKEO-UHFFFAOYSA-N 2 0 354.922 4.101 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@H](C)c3ccc4ccccc4c3)C2)CC1 ZINC000525267301 1109324828 /nfs/dbraw/zinc/32/48/28/1109324828.db2.gz NGQUMVROUFAXFK-AUSIDOKSSA-N 2 0 351.538 4.001 20 0 FIADRP Clc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Br ZINC000446884694 1109382767 /nfs/dbraw/zinc/38/27/67/1109382767.db2.gz QHRKLDOEEZKZFI-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP CCC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccsc1 ZINC000525954722 1109562764 /nfs/dbraw/zinc/56/27/64/1109562764.db2.gz YIWTUCVIMYCVIN-RTWAWAEBSA-N 2 0 357.567 4.168 20 0 FIADRP Fc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1F ZINC000447590413 1109589792 /nfs/dbraw/zinc/58/97/92/1109589792.db2.gz CLPYMHGCBIZNTP-REPLKXPHSA-N 2 0 374.450 4.432 20 0 FIADRP c1c2ccccc2oc1[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccnc1 ZINC000447580273 1109595009 /nfs/dbraw/zinc/59/50/09/1109595009.db2.gz PZNZYFRZZSHQHQ-QHCPKHFHSA-N 2 0 361.489 4.381 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1nc(-c2ccccc2)c[nH]1 ZINC000447849474 1109658879 /nfs/dbraw/zinc/65/88/79/1109658879.db2.gz IAPGSUIAOQCWRK-NQIIRXRSSA-N 2 0 360.505 4.077 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000527222466 1109716452 /nfs/dbraw/zinc/71/64/52/1109716452.db2.gz XGXLRSTVNSSIFK-ZEQRLZLVSA-N 2 0 365.565 4.005 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3cc(F)c(Cl)cc32)cc1 ZINC000527845285 1109832634 /nfs/dbraw/zinc/83/26/34/1109832634.db2.gz DLJVJSJMKHYHJV-FQEVSTJZSA-N 2 0 362.876 4.197 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000527948472 1109866626 /nfs/dbraw/zinc/86/66/26/1109866626.db2.gz LOSPRMZETFXKHA-IIBYNOLFSA-N 2 0 370.541 4.028 20 0 FIADRP C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000527971033 1109871784 /nfs/dbraw/zinc/87/17/84/1109871784.db2.gz UNILYUHNZJEKBO-VGSWGCGISA-N 2 0 353.510 4.214 20 0 FIADRP c1nc(CCc2ccccc2)sc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000449009358 1109957455 /nfs/dbraw/zinc/95/74/55/1109957455.db2.gz HKLCPRWZXCRSGP-UHFFFAOYSA-N 2 0 369.578 4.236 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[NH+]2CCC(C)CC2)CC1 ZINC000449083407 1109975623 /nfs/dbraw/zinc/97/56/23/1109975623.db2.gz UALXJZWLCPYCFU-JOCHJYFZSA-N 3 0 371.613 4.184 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc2ccoc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000449129603 1109981901 /nfs/dbraw/zinc/98/19/01/1109981901.db2.gz CTPDHYGCXUEAPO-MRXNPFEDSA-N 2 0 367.468 4.175 20 0 FIADRP COCC1CCC([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000449156488 1109986850 /nfs/dbraw/zinc/98/68/50/1109986850.db2.gz DNEUUCKJIMHAGR-UHFFFAOYSA-N 2 0 356.510 4.206 20 0 FIADRP Clc1ccc(C2=CC[C@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)CC2)cc1 ZINC000449163442 1109989853 /nfs/dbraw/zinc/98/98/53/1109989853.db2.gz WDUIIGDRHFQHPE-UWJYYQICSA-N 2 0 374.956 4.366 20 0 FIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)C2)cc1 ZINC000449164148 1109990470 /nfs/dbraw/zinc/99/04/70/1109990470.db2.gz YEADQSMEPRICCS-CDXJDZJCSA-N 2 0 362.945 4.067 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CCC3(CCOCC3)CC2)CC1 ZINC000449188105 1109990925 /nfs/dbraw/zinc/99/09/25/1109990925.db2.gz RSIZCDYAKSXTDC-HXUWFJFHSA-N 2 0 370.581 4.411 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@@H]2CCCC[C@@H]2O)CC1 ZINC000449190538 1109991386 /nfs/dbraw/zinc/99/13/86/1109991386.db2.gz JELLHIIMBQBIFM-NWSQWKLXSA-N 2 0 358.570 4.003 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000449208283 1109995819 /nfs/dbraw/zinc/99/58/19/1109995819.db2.gz CZJQTVWTCYDXAJ-OAQYLSRUSA-N 2 0 356.554 4.370 20 0 FIADRP Cc1cnc([C@@H](C)C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)s1 ZINC000449240598 1110009607 /nfs/dbraw/zinc/00/96/07/1110009607.db2.gz ZSPBSYHQSKVKMU-IRXDYDNUSA-N 2 0 357.567 4.240 20 0 FIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cnc(CCc4ccccc4)s3)C2)CC1 ZINC000449325910 1110026616 /nfs/dbraw/zinc/02/66/16/1110026616.db2.gz QKYUKXHGODEGBM-HXUWFJFHSA-N 2 0 369.578 4.092 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(C(F)(F)F)CCC2)CC1 ZINC000449320859 1110032914 /nfs/dbraw/zinc/03/29/14/1110032914.db2.gz KIGBPQQGLVJONO-MRXNPFEDSA-N 2 0 354.460 4.404 20 0 FIADRP CC(C)c1nnc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)s1 ZINC000449333932 1110039932 /nfs/dbraw/zinc/03/99/32/1110039932.db2.gz CMWIZZPTKMDVIU-UHFFFAOYSA-N 2 0 366.619 4.473 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+]CC[C@@H]3CCc4ccccc43)sc2C1 ZINC000449375871 1110043156 /nfs/dbraw/zinc/04/31/56/1110043156.db2.gz JQSQVWBYJPIXGN-KRWDZBQOSA-N 2 0 355.551 4.119 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC(C)(C)c2ccccn2)CC1 ZINC000449394128 1110050446 /nfs/dbraw/zinc/05/04/46/1110050446.db2.gz PKDVLKTUCHQWPY-IBGZPJMESA-N 2 0 351.538 4.044 20 0 FIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CC[NH+](C)C)CC3)o2)cc1C ZINC000121238324 1110319354 /nfs/dbraw/zinc/31/93/54/1110319354.db2.gz BLBCUSHJAIPOCA-KRWDZBQOSA-N 2 0 356.514 4.078 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCCC1(F)F ZINC000450644137 1110322141 /nfs/dbraw/zinc/32/21/41/1110322141.db2.gz BBCWLUFYNXBTPK-SFHVURJKSA-N 2 0 351.485 4.445 20 0 FIADRP CC[C@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000538723583 1111262860 /nfs/dbraw/zinc/26/28/60/1111262860.db2.gz NOMYXARHLGRDIG-JOCHJYFZSA-N 2 0 371.613 4.308 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000538733505 1111269471 /nfs/dbraw/zinc/26/94/71/1111269471.db2.gz YODXIXGUJCREMX-HSZRJFAPSA-N 2 0 360.505 4.051 20 0 FIADRP CCOc1c(Cl)cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1OC ZINC000538750778 1111280807 /nfs/dbraw/zinc/28/08/07/1111280807.db2.gz YCMNLNCLXRHSME-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Br)c2)CCCC1 ZINC000539062130 1111408272 /nfs/dbraw/zinc/40/82/72/1111408272.db2.gz SXRXXFPVHANDKL-MAUKXSAKSA-N 2 0 365.359 4.191 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000539075834 1111420711 /nfs/dbraw/zinc/42/07/11/1111420711.db2.gz MPEIJHVRAPDZOP-CVDCTZTESA-N 2 0 354.538 4.109 20 0 FIADRP Cc1cc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)ccc1F ZINC000539163598 1111457271 /nfs/dbraw/zinc/45/72/71/1111457271.db2.gz IQPUMTLFRAKDGS-JOCHJYFZSA-N 2 0 356.485 4.315 20 0 FIADRP CC[C@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)c1nccn1C ZINC000539294333 1111505153 /nfs/dbraw/zinc/50/51/53/1111505153.db2.gz BWBRUEABHBGNHD-FQEVSTJZSA-N 2 0 354.542 4.153 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCNc1ccccc1)c1ccccc1O2 ZINC000539400943 1111551198 /nfs/dbraw/zinc/55/11/98/1111551198.db2.gz VJNPULLZSKAXTF-OAQYLSRUSA-N 2 0 365.521 4.066 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H]2CCC[C@H]21 ZINC000552056385 1111559850 /nfs/dbraw/zinc/55/98/50/1111559850.db2.gz ATHUTBIDRCTHCC-XFUTXVRSSA-N 2 0 352.444 4.414 20 0 FIADRP COC(=O)c1csc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000552062595 1111562767 /nfs/dbraw/zinc/56/27/67/1111562767.db2.gz AHJAOQSHQCAIOW-ZLPCBKJTSA-N 2 0 364.555 4.228 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC[C@H]2OC(F)F)CC1 ZINC000552053590 1111568408 /nfs/dbraw/zinc/56/84/08/1111568408.db2.gz MVVMVRJQXQWEHG-CSODTCANSA-N 2 0 352.469 4.180 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)CC1 ZINC000552087290 1111570187 /nfs/dbraw/zinc/57/01/87/1111570187.db2.gz DGYILPRRXZQYNZ-RBUKOAKNSA-N 2 0 352.469 4.117 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC1 ZINC000477855908 1111579482 /nfs/dbraw/zinc/57/94/82/1111579482.db2.gz JBGYFEYRLCRZIP-UHFFFAOYSA-N 2 0 354.325 4.480 20 0 FIADRP CC[C@@H]1C[C@@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCO1 ZINC000552273259 1111654295 /nfs/dbraw/zinc/65/42/95/1111654295.db2.gz AUWLPDMXIMZCIB-FCHUYYIVSA-N 2 0 356.554 4.180 20 0 FIADRP Clc1ccccc1COc1cccc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000097287794 1111935895 /nfs/dbraw/zinc/93/58/95/1111935895.db2.gz HWRCDAXXTNGMMA-SFHVURJKSA-N 2 0 370.924 4.493 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4nn(C)cc43)cc2)C1 ZINC000479363207 1112006728 /nfs/dbraw/zinc/00/67/28/1112006728.db2.gz PKJZDGMOLBFEPQ-KGVIQGDOSA-N 2 0 366.553 4.065 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000479464293 1112034421 /nfs/dbraw/zinc/03/44/21/1112034421.db2.gz LPCSBUDWUKUGQD-PZJWPPBQSA-N 2 0 360.505 4.045 20 0 FIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1F ZINC000479550380 1112066082 /nfs/dbraw/zinc/06/60/82/1112066082.db2.gz CGSUOECHLFZJNV-BRAJZSMUSA-N 2 0 360.517 4.467 20 0 FIADRP Cc1cc2[nH]c(C[NH2+]Cc3cccc(OCC[NH+](C)C)c3)cc2c(C)c1 ZINC000479553013 1112069545 /nfs/dbraw/zinc/06/95/45/1112069545.db2.gz OLOJZEYXGIGTDS-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000479553113 1112069570 /nfs/dbraw/zinc/06/95/70/1112069570.db2.gz PLCSRWOEPWTKDM-OAHLLOKOSA-N 2 0 369.347 4.202 20 0 FIADRP CCC[N@H+](CCC1CC[NH2+]CC1)CC(=O)Nc1ccc(Cl)cc1Cl ZINC000479678935 1112111662 /nfs/dbraw/zinc/11/16/62/1112111662.db2.gz VQNQDBACOBCPRA-UHFFFAOYSA-N 2 0 372.340 4.034 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000479765604 1112135179 /nfs/dbraw/zinc/13/51/79/1112135179.db2.gz DIDHZRUVWPDPEY-DNVCBOLYSA-N 2 0 373.368 4.263 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000479899249 1112181153 /nfs/dbraw/zinc/18/11/53/1112181153.db2.gz ILOSLDXVNNFBSI-RTBURBONSA-N 2 0 374.573 4.475 20 0 FIADRP COc1cc([C@H](C)NCc2ccccc2C[NH+]2CCCCCC2)c(F)cn1 ZINC000554073259 1112183894 /nfs/dbraw/zinc/18/38/94/1112183894.db2.gz WXOBEAZWWUYNIN-KRWDZBQOSA-N 2 0 371.500 4.456 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000479889562 1112187038 /nfs/dbraw/zinc/18/70/38/1112187038.db2.gz VRHCHULXRYRVIA-GAJHUEQPSA-N 2 0 368.496 4.071 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC[NH+]1CCCC1)CCC2 ZINC000480159997 1112307744 /nfs/dbraw/zinc/30/77/44/1112307744.db2.gz NJZFGNKAAXCKGU-QGZVFWFLSA-N 2 0 359.514 4.402 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(F)cc(F)c1 ZINC000480229363 1112340419 /nfs/dbraw/zinc/34/04/19/1112340419.db2.gz PXPPJKWEGHDLHZ-IXDOHACOSA-N 2 0 374.475 4.425 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480241364 1112345711 /nfs/dbraw/zinc/34/57/11/1112345711.db2.gz MVPITPLIZVICAJ-ZCNNSNEGSA-N 2 0 352.522 4.455 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(-n2cccn2)cc1 ZINC000480266063 1112352664 /nfs/dbraw/zinc/35/26/64/1112352664.db2.gz OEUPCJOVMBSJHE-LJQANCHMSA-N 2 0 360.505 4.319 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000480277752 1112371204 /nfs/dbraw/zinc/37/12/04/1112371204.db2.gz YBOSUESGMYCJIA-QHCPKHFHSA-N 2 0 350.506 4.458 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000554552854 1112397040 /nfs/dbraw/zinc/39/70/40/1112397040.db2.gz NCEDPKGIEUOPTJ-QGZVFWFLSA-N 2 0 358.476 4.417 20 0 FIADRP COC1(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CCCC1 ZINC000480364851 1112403652 /nfs/dbraw/zinc/40/36/52/1112403652.db2.gz NLOJUBLVRCBVMQ-UHFFFAOYSA-N 2 0 350.934 4.101 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+]Cc3ccc(OCC4CC4)cc3)C2)cc1 ZINC000480369854 1112408169 /nfs/dbraw/zinc/40/81/69/1112408169.db2.gz JJGZCEGZMWIBRO-HSZRJFAPSA-N 2 0 364.533 4.130 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1OC ZINC000480603349 1112505243 /nfs/dbraw/zinc/50/52/43/1112505243.db2.gz RUTLECPFLHFQDZ-ULQDDVLXSA-N 2 0 366.521 4.252 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480630800 1112510156 /nfs/dbraw/zinc/51/01/56/1112510156.db2.gz LQSVCEMZENNSIJ-PXNSSMCTSA-N 2 0 351.966 4.043 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cnn1-c1ccc(F)cc1 ZINC000480643854 1112518734 /nfs/dbraw/zinc/51/87/34/1112518734.db2.gz SYHKYGRDOOUQCB-ROUUACIJSA-N 2 0 372.532 4.483 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCO2 ZINC000480636649 1112523412 /nfs/dbraw/zinc/52/34/12/1112523412.db2.gz CVSUNBKZMJXRTP-MSOLQXFVSA-N 2 0 366.505 4.498 20 0 FIADRP CCCCc1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000480697398 1112560370 /nfs/dbraw/zinc/56/03/70/1112560370.db2.gz KONBIHRMNKJCDP-LJQANCHMSA-N 2 0 366.553 4.027 20 0 FIADRP CCC[N@H+](C)[C@@H](CNC(=O)Nc1cccc(C[NH3+])c1)c1ccc(Cl)cc1 ZINC000667733358 1112564120 /nfs/dbraw/zinc/56/41/20/1112564120.db2.gz AURPDBLQYVJZPU-IBGZPJMESA-N 2 0 374.916 4.003 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000480724632 1112572522 /nfs/dbraw/zinc/57/25/22/1112572522.db2.gz CPSQHLAMQBGISK-QFIPXVFZSA-N 2 0 356.485 4.323 20 0 FIADRP Fc1cccc(C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000480742152 1112581242 /nfs/dbraw/zinc/58/12/42/1112581242.db2.gz BLDKFABCCZHPOP-VGOFRKELSA-N 2 0 356.460 4.323 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000480779415 1112594229 /nfs/dbraw/zinc/59/42/29/1112594229.db2.gz KMOBGTBTWLPHQO-HXUWFJFHSA-N 2 0 371.594 4.286 20 0 FIADRP FC(F)(F)c1ccccc1OCCCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000554972303 1112599919 /nfs/dbraw/zinc/59/99/19/1112599919.db2.gz JCJRYGSLLDEXEN-QGZVFWFLSA-N 2 0 370.459 4.282 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2c(s1)CCCC2 ZINC000481322267 1112903981 /nfs/dbraw/zinc/90/39/81/1112903981.db2.gz ZORBEVNFOXDGGY-INIZCTEOSA-N 2 0 358.551 4.418 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3cccc(Br)c3C2)C1 ZINC000555536835 1112913655 /nfs/dbraw/zinc/91/36/55/1112913655.db2.gz ABJGDEPZEZCZIM-NVXWUHKLSA-N 2 0 365.359 4.016 20 0 FIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000481651075 1113012144 /nfs/dbraw/zinc/01/21/44/1113012144.db2.gz CUUKVQZVYMEAGN-IKGGRYGDSA-N 2 0 372.475 4.115 20 0 FIADRP C[NH+](C)[C@H](CNc1cc[nH+]c2cc(OC(F)(F)F)ccc12)c1ccco1 ZINC000899875389 1113039562 /nfs/dbraw/zinc/03/95/62/1113039562.db2.gz UKBWISYMKKBOSU-MRXNPFEDSA-N 2 0 365.355 4.441 20 0 FIADRP COc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000481725230 1113055590 /nfs/dbraw/zinc/05/55/90/1113055590.db2.gz OPYJEOONIZEJKW-HXUWFJFHSA-N 2 0 356.535 4.246 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCc4cc(F)ccc43)CC2)cc1 ZINC000481733909 1113059939 /nfs/dbraw/zinc/05/99/39/1113059939.db2.gz JAGQFTYQNSHCNS-HSZRJFAPSA-N 2 0 368.496 4.323 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000481947469 1113142524 /nfs/dbraw/zinc/14/25/24/1113142524.db2.gz XHKRNLWKQMZHSM-IBGZPJMESA-N 2 0 358.551 4.369 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1cccc(OCC[NH+](C)C)c1 ZINC000481993048 1113146586 /nfs/dbraw/zinc/14/65/86/1113146586.db2.gz QWZPCTSOASRNDR-MRXNPFEDSA-N 2 0 369.484 4.141 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)CC1 ZINC000482117365 1113173125 /nfs/dbraw/zinc/17/31/25/1113173125.db2.gz BAKZHLXIBJRFDW-GOSISDBHSA-N 2 0 368.521 4.018 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000482341779 1113229880 /nfs/dbraw/zinc/22/98/80/1113229880.db2.gz COCLZDZIPDTVDY-INIZCTEOSA-N 2 0 357.567 4.425 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)c(Br)c2)C1 ZINC000482340825 1113229949 /nfs/dbraw/zinc/22/99/49/1113229949.db2.gz BWKLDFTVEVIRCZ-KBPBESRZSA-N 2 0 357.311 4.359 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000482344092 1113230311 /nfs/dbraw/zinc/23/03/11/1113230311.db2.gz NGWBGLCYKRHBIK-GUYCJALGSA-N 2 0 351.332 4.319 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000482497525 1113276288 /nfs/dbraw/zinc/27/62/88/1113276288.db2.gz AJVKXTHCVGZBSF-YLJYHZDGSA-N 2 0 351.966 4.044 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482503531 1113279548 /nfs/dbraw/zinc/27/95/48/1113279548.db2.gz LPLFPMLNICVYNR-YLJYHZDGSA-N 2 0 371.594 4.142 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)CC1 ZINC000482503305 1113279559 /nfs/dbraw/zinc/27/95/59/1113279559.db2.gz DHAKLIXABDJLHM-MOPGFXCFSA-N 2 0 371.594 4.339 20 0 FIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482554104 1113298111 /nfs/dbraw/zinc/29/81/11/1113298111.db2.gz FEEFROANJWJSTH-VGSWGCGISA-N 2 0 367.512 4.224 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1cn(-c2ccccc2Cl)nc1C(C)(C)C ZINC000482651677 1113323095 /nfs/dbraw/zinc/32/30/95/1113323095.db2.gz YHYXUPJQZHFWBS-UHFFFAOYSA-N 2 0 362.949 4.255 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-c2cccs2)cc1 ZINC000482898711 1113395186 /nfs/dbraw/zinc/39/51/86/1113395186.db2.gz ZLAPUQWUVSUCBJ-FXAWDEMLSA-N 2 0 358.551 4.303 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3c(s2)CCCC3)[C@@H](C)C1 ZINC000483137039 1113446323 /nfs/dbraw/zinc/44/63/23/1113446323.db2.gz SZXDMYGEAAPVQU-SCTDSRPQSA-N 2 0 364.599 4.415 20 0 FIADRP COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162372525 1113462538 /nfs/dbraw/zinc/46/25/38/1113462538.db2.gz VTTMOHHLRCDNDK-ROUUACIJSA-N 2 0 356.510 4.356 20 0 FIADRP CCC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000483213086 1113466511 /nfs/dbraw/zinc/46/65/11/1113466511.db2.gz LKXBVYLXBUKBHA-OXQOHEQNSA-N 2 0 350.934 4.272 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)Cc1cccc(Br)c1 ZINC000483220414 1113467959 /nfs/dbraw/zinc/46/79/59/1113467959.db2.gz WUEXXPPPWAGLJF-RLFYNMQTSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@@H](NCc1csc(-c2ccco2)n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486514876 1113585524 /nfs/dbraw/zinc/58/55/24/1113585524.db2.gz FKAZJYGKBUNHNM-SJLPKXTDSA-N 2 0 367.518 4.403 20 0 FIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C3CCN([C@H]4CCOC4)CC3)CC2)cc1 ZINC000668693816 1113658502 /nfs/dbraw/zinc/65/85/02/1113658502.db2.gz WEOAMXRWAKXCAT-CTNGQTDRSA-N 2 0 360.929 4.119 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000488361670 1113915583 /nfs/dbraw/zinc/91/55/83/1113915583.db2.gz QITVRWGBNGUMAR-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP C[C@H]1[C@@H](NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000489912908 1114191702 /nfs/dbraw/zinc/19/17/02/1114191702.db2.gz XLDZSBFDLPZACK-CVDCTZTESA-N 2 0 355.570 4.036 20 0 FIADRP [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000490031011 1114204600 /nfs/dbraw/zinc/20/46/00/1114204600.db2.gz NBFLWTOZXCAVAR-GOSISDBHSA-N 2 0 371.912 4.296 20 0 FIADRP COc1ccc([C@@H](NC[C@@H]2CCC[N@@H+](C(C)C)C2)c2ccccc2)cc1 ZINC000491043183 1114366721 /nfs/dbraw/zinc/36/67/21/1114366721.db2.gz ZTBFAGWHSWHYLD-CVDCTZTESA-N 2 0 352.522 4.495 20 0 FIADRP COc1ccc([C@H](NC[C@@H]2CCC[N@@H+](C(C)C)C2)c2ccccc2)cc1 ZINC000491043184 1114366753 /nfs/dbraw/zinc/36/67/53/1114366753.db2.gz ZTBFAGWHSWHYLD-WMZHIEFXSA-N 2 0 352.522 4.495 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(-c3cnn(C)c3)s2)CC1 ZINC000571541333 1114480811 /nfs/dbraw/zinc/48/08/11/1114480811.db2.gz IYYFQUYHSQNAPE-UHFFFAOYSA-N 2 0 374.598 4.483 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccccc3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000588710055 1114601685 /nfs/dbraw/zinc/60/16/85/1114601685.db2.gz PEESBIJSROAVGP-HZPDHXFCSA-N 2 0 370.459 4.027 20 0 FIADRP CN1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C[C@@H]1c1ccccc1 ZINC000572370808 1114638113 /nfs/dbraw/zinc/63/81/13/1114638113.db2.gz APHQHDBWHPSVPP-DNQXCXABSA-N 2 0 363.549 4.208 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(F)c(Br)c2)C1 ZINC000589836086 1114847032 /nfs/dbraw/zinc/84/70/32/1114847032.db2.gz GJFRILFOCNBEFR-CQSZACIVSA-N 2 0 357.311 4.190 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cccc(Br)c2)C1 ZINC000589837390 1114847499 /nfs/dbraw/zinc/84/74/99/1114847499.db2.gz SPVJRGCBGUEEFD-IYBDPMFKSA-N 2 0 353.348 4.297 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)cc1 ZINC000589950679 1114866775 /nfs/dbraw/zinc/86/67/75/1114866775.db2.gz BIGFOYBXRHEPBD-QFIPXVFZSA-N 2 0 371.569 4.009 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCOc2ccccc2)CC1 ZINC000589998834 1114873392 /nfs/dbraw/zinc/87/33/92/1114873392.db2.gz UOXYVBJMVKPDKO-UHFFFAOYSA-N 2 0 352.522 4.300 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cn(C)nc2C(C)(C)C)cc1 ZINC000093947695 1115026927 /nfs/dbraw/zinc/02/69/27/1115026927.db2.gz JOIGCYFOSDHJET-GOSISDBHSA-N 2 0 368.569 4.382 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)C2)c1 ZINC000573366141 1115094058 /nfs/dbraw/zinc/09/40/58/1115094058.db2.gz FXRXYYGBBHQEFO-QRGRWYIGSA-N 2 0 370.487 4.365 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCC(O)(c4ccccc4)CC3)CC2)C1 ZINC000760908727 1115170588 /nfs/dbraw/zinc/17/05/88/1115170588.db2.gz QJCPUEOEEOVRHB-ZOGZRVJRSA-N 2 0 370.581 4.450 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CCc2ccc(F)cc2F)[C@H](C)C1 ZINC000574062429 1115288264 /nfs/dbraw/zinc/28/82/64/1115288264.db2.gz TZZIUVHSOJESPB-WWMYMODYSA-N 2 0 368.512 4.013 20 0 FIADRP COC(=O)c1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c(C)o1 ZINC000594615573 1115471786 /nfs/dbraw/zinc/47/17/86/1115471786.db2.gz PURLNNPIFOSUDL-UHFFFAOYSA-N 2 0 370.493 4.040 20 0 FIADRP COC(=O)c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1Cl ZINC000597075358 1115638945 /nfs/dbraw/zinc/63/89/45/1115638945.db2.gz JBNLARMKNPGKKQ-UHFFFAOYSA-N 2 0 372.896 4.012 20 0 FIADRP CC[C@@](C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1nc(C)cs1 ZINC000608060381 1116079456 /nfs/dbraw/zinc/07/94/56/1116079456.db2.gz AVMGKRGDPJEYJD-OAQYLSRUSA-N 2 0 373.566 4.341 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000534059321 1116153859 /nfs/dbraw/zinc/15/38/59/1116153859.db2.gz NPZKYRRVOQGWAG-INIZCTEOSA-N 2 0 357.723 4.021 20 0 FIADRP C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3cccc(C[NH+]4CCCC4)c3)ccc21 ZINC000456292722 1116174675 /nfs/dbraw/zinc/17/46/75/1116174675.db2.gz ZUAPZJLJSHFLDP-JOCHJYFZSA-N 2 0 363.505 4.084 20 0 FIADRP COc1nc2ccccc2cc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000534272810 1116180833 /nfs/dbraw/zinc/18/08/33/1116180833.db2.gz GEROGVVLIAGTBS-UHFFFAOYSA-N 2 0 363.505 4.373 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000534347197 1116186867 /nfs/dbraw/zinc/18/68/67/1116186867.db2.gz XMUAEXOSZREVPM-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP CC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000462660687 1116387332 /nfs/dbraw/zinc/38/73/32/1116387332.db2.gz VUKDPWKUYKXXNO-UHFFFAOYSA-N 2 0 359.464 4.056 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000462689166 1116393432 /nfs/dbraw/zinc/39/34/32/1116393432.db2.gz VBAMNLAIPITMMW-KRWDZBQOSA-N 2 0 374.960 4.436 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1C ZINC000462784365 1117762599 /nfs/dbraw/zinc/76/25/99/1117762599.db2.gz DZHZBQHUJSJJMX-CVEARBPZSA-N 2 0 374.326 4.075 20 0 FIADRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(C3CCCC3)cc2)CC1 ZINC000462783466 1117765456 /nfs/dbraw/zinc/76/54/56/1117765456.db2.gz PDUHEJFDBSNCTO-GOTSBHOMSA-N 2 0 356.554 4.202 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC000462799312 1117783903 /nfs/dbraw/zinc/78/39/03/1117783903.db2.gz SNIXWHXBTLJJSQ-BHIFYINESA-N 2 0 374.569 4.092 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2=CCCOC2)c2ccc(F)cc2)CC1 ZINC000462803998 1117786213 /nfs/dbraw/zinc/78/62/13/1117786213.db2.gz BVBYDKXYNWGOFR-JOCHJYFZSA-N 2 0 360.517 4.315 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H]2CCC[C@H]21 ZINC000462820292 1117795976 /nfs/dbraw/zinc/79/59/76/1117795976.db2.gz VCATYQCAXUEJJG-XFUTXVRSSA-N 2 0 363.343 4.158 20 0 FIADRP Cc1nc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)cs1 ZINC000462876317 1117834601 /nfs/dbraw/zinc/83/46/01/1117834601.db2.gz DHTRXBCEYOPZMR-GOSISDBHSA-N 2 0 372.582 4.013 20 0 FIADRP CCc1nc2ccccc2n1C1CC[NH+](CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000540056388 1117845974 /nfs/dbraw/zinc/84/59/74/1117845974.db2.gz RMTHCXBXIVDKEV-GOSISDBHSA-N 2 0 354.542 4.110 20 0 FIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000540142681 1117895239 /nfs/dbraw/zinc/89/52/39/1117895239.db2.gz LEFUHDDZUFIZPK-GOSISDBHSA-N 2 0 355.526 4.071 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CCC2)[C@@H](C)C1 ZINC000540159630 1117903938 /nfs/dbraw/zinc/90/39/38/1117903938.db2.gz BFEDEZYJKKXGHY-RBBKRZOGSA-N 2 0 358.570 4.126 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccc1C(F)(F)F ZINC000540170497 1117912728 /nfs/dbraw/zinc/91/27/28/1117912728.db2.gz ITRZJMXBZFVSLQ-BZUAXINKSA-N 2 0 358.448 4.245 20 0 FIADRP COc1ccc2cc([C@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)ccc2c1 ZINC000540171554 1117912876 /nfs/dbraw/zinc/91/28/76/1117912876.db2.gz RJOFTMNOKVAVGV-OTWHNJEPSA-N 2 0 370.537 4.388 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1OC(F)F ZINC000540172693 1117913600 /nfs/dbraw/zinc/91/36/00/1117913600.db2.gz SBTCVUCLFZKZSR-JZXOWHBKSA-N 2 0 370.484 4.218 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000540165229 1117918447 /nfs/dbraw/zinc/91/84/47/1117918447.db2.gz ZYGNMLLQIWLPAG-CDNPAEQRSA-N 2 0 374.569 4.284 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(Cl)s1)c1cccc(OCC[NH+](C)C)c1 ZINC000540192646 1117934309 /nfs/dbraw/zinc/93/43/09/1117934309.db2.gz KSLTWRUUPLNDEL-CQSZACIVSA-N 2 0 352.931 4.235 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)C[C@H]1C ZINC000463105738 1117966690 /nfs/dbraw/zinc/96/66/90/1117966690.db2.gz HCRAKCGXIWYQQO-UYAOXDASSA-N 2 0 356.558 4.320 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CCN(CCc3ccccc3)CC2)cc1 ZINC000463106914 1117967439 /nfs/dbraw/zinc/96/74/39/1117967439.db2.gz BSMMNISVBZKMKQ-HXUWFJFHSA-N 2 0 366.549 4.313 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)cc1 ZINC000540315368 1117980854 /nfs/dbraw/zinc/98/08/54/1117980854.db2.gz DNGUCWMFJDQNOR-UFYCRDLUSA-N 2 0 350.934 4.005 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000540315369 1117981093 /nfs/dbraw/zinc/98/10/93/1117981093.db2.gz DNGUCWMFJDQNOR-ZCNNSNEGSA-N 2 0 350.934 4.005 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1 ZINC000463136514 1117984613 /nfs/dbraw/zinc/98/46/13/1117984613.db2.gz KKLSOFYAZZKSBP-GBAAUQCPSA-N 2 0 371.613 4.387 20 0 FIADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475534 1118077834 /nfs/dbraw/zinc/07/78/34/1118077834.db2.gz NUQIKHOWSDQYTG-GIVPXCGWSA-N 2 0 372.553 4.160 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000463291126 1118086242 /nfs/dbraw/zinc/08/62/42/1118086242.db2.gz WAXNSURLYBTVQS-JVODISISSA-N 2 0 365.565 4.321 20 0 FIADRP CCC[NH+]1CCC([NH2+]C2(c3cccc(Br)c3)CCC2)CC1 ZINC000540724016 1118208127 /nfs/dbraw/zinc/20/81/27/1118208127.db2.gz QSCPVHJLPXNTCW-UHFFFAOYSA-N 2 0 351.332 4.292 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1C(C)(C)C ZINC000540989824 1118340024 /nfs/dbraw/zinc/34/00/24/1118340024.db2.gz XEKBIARIFZMRBR-NQIIRXRSSA-N 2 0 366.549 4.402 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](CC2CCC2)c2ccccc2)C1 ZINC000540988116 1118340149 /nfs/dbraw/zinc/34/01/49/1118340149.db2.gz GKEMNGJJZGSXCX-DNQXCXABSA-N 2 0 364.533 4.274 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(OC2CCC(C)CC2)CC1 ZINC000541534468 1118552676 /nfs/dbraw/zinc/55/26/76/1118552676.db2.gz RBYIIAVKASYPBS-UHFFFAOYSA-N 2 0 368.525 4.135 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000541913873 1118699248 /nfs/dbraw/zinc/69/92/48/1118699248.db2.gz ATIINYFGIMHEOC-DNQXCXABSA-N 2 0 364.533 4.274 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c[nH]nc2-c2cccs2)CC1 ZINC000542177390 1118837573 /nfs/dbraw/zinc/83/75/73/1118837573.db2.gz UQZFKGXASTXUSA-UHFFFAOYSA-N 2 0 360.571 4.472 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C(C)C)cc1 ZINC000465351809 1118926073 /nfs/dbraw/zinc/92/60/73/1118926073.db2.gz AEXPAZKMGHSZCU-YADHBBJMSA-N 2 0 371.569 4.006 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173331183 1119034072 /nfs/dbraw/zinc/03/40/72/1119034072.db2.gz LOCSCLMQEXGKRP-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000311493655 1119377114 /nfs/dbraw/zinc/37/71/14/1119377114.db2.gz KDEPGAVFBZOWDW-WMZHIEFXSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2ccc(O)cc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311491847 1119377162 /nfs/dbraw/zinc/37/71/62/1119377162.db2.gz CFPPSZIMPIFVME-XTQVGHSUSA-N 2 0 350.506 4.270 20 0 FIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1OCC ZINC000178257411 1119380381 /nfs/dbraw/zinc/38/03/81/1119380381.db2.gz HLXMTNAJNIWRNN-FQEVSTJZSA-N 2 0 360.542 4.399 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311994847 1119396869 /nfs/dbraw/zinc/39/68/69/1119396869.db2.gz SSARSCPBBXKVOU-APWZRJJASA-N 2 0 360.448 4.288 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311994853 1119396990 /nfs/dbraw/zinc/39/69/90/1119396990.db2.gz SSARSCPBBXKVOU-QFBILLFUSA-N 2 0 360.448 4.288 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccsc2)CC1 ZINC000178770716 1119407907 /nfs/dbraw/zinc/40/79/07/1119407907.db2.gz KYNAIGVDSYYJBT-HOTGVXAUSA-N 2 0 361.530 4.441 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000493884485 1119503095 /nfs/dbraw/zinc/50/30/95/1119503095.db2.gz YEJCEYWWTCUQKI-HLRQEUIKSA-N 2 0 354.538 4.108 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183183349 1119568382 /nfs/dbraw/zinc/56/83/82/1119568382.db2.gz OBDOUBSSFBSIHD-NLWGTHIKSA-N 2 0 360.542 4.015 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000186097069 1119705711 /nfs/dbraw/zinc/70/57/11/1119705711.db2.gz PRRODFFBHOMAQS-ULQDDVLXSA-N 2 0 374.550 4.217 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1 ZINC000186849339 1119753139 /nfs/dbraw/zinc/75/31/39/1119753139.db2.gz BSXBAOOFYJQIOK-MRXNPFEDSA-N 2 0 369.475 4.137 20 0 FIADRP CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542485083 1119902263 /nfs/dbraw/zinc/90/22/63/1119902263.db2.gz IELMXIDFAXVDLV-FOIQADDNSA-N 2 0 370.884 4.095 20 0 FIADRP COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cn(-c3cc[nH+]cc3)nc1C)[C@H]2C ZINC000542485527 1119932960 /nfs/dbraw/zinc/93/29/60/1119932960.db2.gz POURVGZGJQXGKM-WBVHZDCISA-N 2 0 362.477 4.092 20 0 FIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1csc(Cl)c1 ZINC000191314459 1119970653 /nfs/dbraw/zinc/97/06/53/1119970653.db2.gz ILGWWQMGNAOCDO-HNNXBMFYSA-N 2 0 355.979 4.002 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC000191851766 1119998694 /nfs/dbraw/zinc/99/86/94/1119998694.db2.gz BIMMNVMREMGHJA-HMNCIZAVSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccnn1-c1ccccc1 ZINC000467384316 1120036185 /nfs/dbraw/zinc/03/61/85/1120036185.db2.gz VVNXLXBEOPEDTG-HXUWFJFHSA-N 2 0 374.532 4.435 20 0 FIADRP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cnn1C(C)(C)C ZINC000195132564 1120119269 /nfs/dbraw/zinc/11/92/69/1120119269.db2.gz JRXJOOUDBYLEMS-FXAWDEMLSA-N 2 0 354.542 4.119 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2ccccc2Cl)CC1 ZINC001168470509 1120265444 /nfs/dbraw/zinc/26/54/44/1120265444.db2.gz ZREZJROHMPESIK-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3sccc3Cl)CC2)C[C@H](C)O1 ZINC000494985581 1120411975 /nfs/dbraw/zinc/41/19/75/1120411975.db2.gz LGEZONBEELVOLY-GASCZTMLSA-N 2 0 356.963 4.113 20 0 FIADRP C[C@H]([NH2+]CCCOc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534259 1120435687 /nfs/dbraw/zinc/43/56/87/1120435687.db2.gz RNHNTTUBGLLMTL-DLBZAZTESA-N 2 0 350.934 4.352 20 0 FIADRP CC(C)[NH+](CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C(C)C ZINC000495075736 1120458829 /nfs/dbraw/zinc/45/88/29/1120458829.db2.gz USSAZMGRCCJULG-GHTZIAJQSA-N 2 0 350.522 4.392 20 0 FIADRP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)C1CCCC1 ZINC000495076344 1120459744 /nfs/dbraw/zinc/45/97/44/1120459744.db2.gz ZFHHEMBUIWYDRW-CVDCTZTESA-N 2 0 356.554 4.317 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000495089046 1120468935 /nfs/dbraw/zinc/46/89/35/1120468935.db2.gz XBZOKMYZHXXRHF-JQVVWYNYSA-N 2 0 362.533 4.251 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000495415653 1120792654 /nfs/dbraw/zinc/79/26/54/1120792654.db2.gz SCQIBWVTUMQCPE-NMNUPHIUSA-N 2 0 374.544 4.488 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(F)ccc1F ZINC000495548482 1120882316 /nfs/dbraw/zinc/88/23/16/1120882316.db2.gz QKTSKVNBZAVJOM-BBWFWOEESA-N 2 0 374.475 4.425 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cc(Br)ncc1F ZINC000762736728 1120957055 /nfs/dbraw/zinc/95/70/55/1120957055.db2.gz RRFLNDBMTBEWCX-KBPBESRZSA-N 2 0 372.326 4.288 20 0 FIADRP c1ccc(CCCOc2cccc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)c2)cc1 ZINC000236738807 1120969468 /nfs/dbraw/zinc/96/94/68/1120969468.db2.gz GZVFDGSOIVFTGP-JOCHJYFZSA-N 2 0 364.533 4.272 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3cccc(OCC[NH+](C)C)c3)o2)cc1 ZINC000236980159 1120972059 /nfs/dbraw/zinc/97/20/59/1120972059.db2.gz KUKNWNDANPNBQX-UHFFFAOYSA-N 2 0 364.489 4.485 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000237065122 1120973071 /nfs/dbraw/zinc/97/30/71/1120973071.db2.gz OOAWFZOJVPSBKE-UHFFFAOYSA-N 2 0 355.507 4.378 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccccc2Cl)C[C@H](C)O1 ZINC000237623660 1120980431 /nfs/dbraw/zinc/98/04/31/1120980431.db2.gz UJULBFIMMGEXOV-CALCHBBNSA-N 2 0 358.913 4.239 20 0 FIADRP Cn1ccnc1[C@H]1CCCN(c2ccnc3cc(Br)ccc32)C1 ZINC000443969153 1121035433 /nfs/dbraw/zinc/03/54/33/1121035433.db2.gz GHOPHQRGXJSTJO-ZDUSSCGKSA-N 2 0 371.282 4.115 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000397563464 1121223256 /nfs/dbraw/zinc/22/32/56/1121223256.db2.gz ZKWVZGAMERUQFF-KRWDZBQOSA-N 2 0 358.913 4.018 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000397628484 1121252148 /nfs/dbraw/zinc/25/21/48/1121252148.db2.gz MCGNVPPBPQUQHS-OAHLLOKOSA-N 2 0 364.942 4.079 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000397626983 1121252302 /nfs/dbraw/zinc/25/23/02/1121252302.db2.gz YJTYWBYAQTWNGZ-GOSISDBHSA-N 2 0 364.489 4.111 20 0 FIADRP OC1(C[NH2+]Cc2csc3ccccc23)CC[NH+](Cc2ccccc2)CC1 ZINC000397685898 1121281731 /nfs/dbraw/zinc/28/17/31/1121281731.db2.gz NUSYBNCRSUQNNB-UHFFFAOYSA-N 2 0 366.530 4.018 20 0 FIADRP Cc1ccc(-c2noc([C@@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)n2)cc1F ZINC000123414454 1121511140 /nfs/dbraw/zinc/51/11/40/1121511140.db2.gz BSLLAUINEZYYFX-MRXNPFEDSA-N 2 0 374.504 4.299 20 0 FIADRP Cc1ccc(-c2noc([C@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)n2)cc1F ZINC000123414738 1121511404 /nfs/dbraw/zinc/51/14/04/1121511404.db2.gz BSLLAUINEZYYFX-INIZCTEOSA-N 2 0 374.504 4.299 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(OC(F)(F)F)c1 ZINC000123722971 1121625916 /nfs/dbraw/zinc/62/59/16/1121625916.db2.gz PFYGOFMQLKFVIV-CQSZACIVSA-N 2 0 352.400 4.498 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1OC(F)F ZINC000123716047 1121626255 /nfs/dbraw/zinc/62/62/55/1121626255.db2.gz QCSFOVAEKIWLKF-ZDUSSCGKSA-N 2 0 352.400 4.340 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(N3CCCC3=O)c2)c1 ZINC000123948666 1121649256 /nfs/dbraw/zinc/64/92/56/1121649256.db2.gz PVQNJSLXMBTFFJ-SFHVURJKSA-N 2 0 365.521 4.116 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000671743239 1121652827 /nfs/dbraw/zinc/65/28/27/1121652827.db2.gz XXCJPNNWZBQWAW-MRXNPFEDSA-N 2 0 365.477 4.096 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000124726466 1121716233 /nfs/dbraw/zinc/71/62/33/1121716233.db2.gz UPNZHEWABIMSLW-QRVBRYPASA-N 2 0 354.542 4.271 20 0 FIADRP CC(C)[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccnn1C ZINC000671762008 1121794176 /nfs/dbraw/zinc/79/41/76/1121794176.db2.gz QSHWXAWDWMDGOS-HRTMPFAESA-N 2 0 368.569 4.193 20 0 FIADRP CC(C)[NH+]1CCC(NCc2cccc(NC(=O)c3cccc(F)c3)c2)CC1 ZINC000126120071 1121921119 /nfs/dbraw/zinc/92/11/19/1121921119.db2.gz XSFXLOZOKARNDL-UHFFFAOYSA-N 2 0 369.484 4.040 20 0 FIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(F)c1 ZINC000126743911 1121982443 /nfs/dbraw/zinc/98/24/43/1121982443.db2.gz MLOQGIRBDDHFIV-HOTGVXAUSA-N 2 0 359.464 4.128 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000126757302 1121983615 /nfs/dbraw/zinc/98/36/15/1121983615.db2.gz IXJPMWZMOXYIEY-QZTJIDSGSA-N 2 0 355.501 4.298 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3F)cc2)CC1 ZINC000916999666 1121995984 /nfs/dbraw/zinc/99/59/84/1121995984.db2.gz NRIAKYXCMAZIDN-QFIPXVFZSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cc(F)ccc3F)cc2)C1 ZINC000917007715 1121999575 /nfs/dbraw/zinc/99/95/75/1121999575.db2.gz AUISTQCXZGVBRZ-AOMKIAJQSA-N 2 0 374.475 4.020 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000066594204 1122078324 /nfs/dbraw/zinc/07/83/24/1122078324.db2.gz CTJWJCCUUIJQNS-INIZCTEOSA-N 2 0 374.960 4.390 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@H+](C3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168623444 1122179296 /nfs/dbraw/zinc/17/92/96/1122179296.db2.gz IUXGZRCWBYXNPQ-LPOZWGFCSA-N 2 0 372.553 4.430 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630608 1122217233 /nfs/dbraw/zinc/21/72/33/1122217233.db2.gz QODCVAMIOVCXGE-XWUOBKMESA-N 2 0 360.542 4.158 20 0 FIADRP C[C@@H](CCn1cccn1)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000497525399 1122265419 /nfs/dbraw/zinc/26/54/19/1122265419.db2.gz RZAMYCRCXRCBJU-IBGZPJMESA-N 2 0 354.542 4.216 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@@H](c1cc2ccccc2o1)C(C)(C)C)N1CC[NH+](C)CC1 ZINC000497833593 1122429753 /nfs/dbraw/zinc/42/97/53/1122429753.db2.gz WHCJECCXGDAWKR-KNQAVFIVSA-N 2 0 371.569 4.382 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497853954 1122441249 /nfs/dbraw/zinc/44/12/49/1122441249.db2.gz RFXLCRIMOBHQTH-OAQYLSRUSA-N 2 0 357.542 4.137 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497860459 1122443413 /nfs/dbraw/zinc/44/34/13/1122443413.db2.gz UMSLSDRQYWQCQC-GCJKJVERSA-N 2 0 371.569 4.383 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(Br)cc2Cl)CC[N@@H+]1C ZINC000556228699 1122745508 /nfs/dbraw/zinc/74/55/08/1122745508.db2.gz DJEOUPBNTXESJZ-TZMCWYRMSA-N 2 0 373.766 4.452 20 0 FIADRP CCc1noc(C2CCC([NH2+][C@@H]3CCCC[C@@H]3C[NH+](CC)CC)CC2)n1 ZINC000498920939 1123078029 /nfs/dbraw/zinc/07/80/29/1123078029.db2.gz WYPAMCAGUKCEAZ-JWHDQAAXSA-N 2 0 362.562 4.148 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCc4ccccn4)[C@@H]3C2)cc1 ZINC000556887498 1123164355 /nfs/dbraw/zinc/16/43/55/1123164355.db2.gz YKBVIFKIDPXNGC-QTJGBDASSA-N 2 0 363.549 4.295 20 0 FIADRP CC(C)OCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556891906 1123179487 /nfs/dbraw/zinc/17/94/87/1123179487.db2.gz HHVRNECLRFAXGC-RJGXRXQPSA-N 2 0 358.570 4.472 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000556909974 1123209653 /nfs/dbraw/zinc/20/96/53/1123209653.db2.gz QAUBRHSBUSBPMJ-QGZVFWFLSA-N 2 0 352.869 4.219 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1cccc(C)c1C ZINC000073737110 1123242495 /nfs/dbraw/zinc/24/24/95/1123242495.db2.gz LSODBHKWEGCYAB-LJQANCHMSA-N 2 0 367.537 4.262 20 0 FIADRP Fc1ccc(OCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499143827 1123286479 /nfs/dbraw/zinc/28/64/79/1123286479.db2.gz BHSNAPQNHHQWTP-DKUWSORSSA-N 2 0 368.496 4.380 20 0 FIADRP CCC(CC)[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)C ZINC000499146319 1123288233 /nfs/dbraw/zinc/28/82/33/1123288233.db2.gz KUOQYSVYUBGFKU-GPJHCHHRSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1CCC[C@H](C)[N@H+]1CCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499152534 1123294806 /nfs/dbraw/zinc/29/48/06/1123294806.db2.gz OWMDJYOIAWOYHL-ZDOXGEDHSA-N 2 0 355.570 4.035 20 0 FIADRP CCOc1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499160981 1123300336 /nfs/dbraw/zinc/30/03/36/1123300336.db2.gz JZPZQVCDLWUCRD-DKUWSORSSA-N 2 0 350.506 4.371 20 0 FIADRP CCOc1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499160982 1123300462 /nfs/dbraw/zinc/30/04/62/1123300462.db2.gz JZPZQVCDLWUCRD-KOUNCHBCSA-N 2 0 350.506 4.371 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1ccccc1Cl)C1CC[NH+](C)CC1 ZINC000132676081 1123327568 /nfs/dbraw/zinc/32/75/68/1123327568.db2.gz ORQIWJJNYLNEMW-UHFFFAOYSA-N 2 0 357.929 4.160 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000132688333 1123333616 /nfs/dbraw/zinc/33/36/16/1123333616.db2.gz BVGTYZVVHISSAH-DEOSSOPVSA-N 2 0 366.549 4.447 20 0 FIADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1c(C)nn(C)c1C ZINC000499245968 1123363484 /nfs/dbraw/zinc/36/34/84/1123363484.db2.gz BQVRPDHXXTYRTJ-KJJMTIBFSA-N 2 0 366.553 4.273 20 0 FIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2ccccc2)cc1 ZINC000132827632 1123366041 /nfs/dbraw/zinc/36/60/41/1123366041.db2.gz UPFIRKHZLRPZRD-QPPBQGQZSA-N 2 0 364.533 4.061 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000133402907 1123484269 /nfs/dbraw/zinc/48/42/69/1123484269.db2.gz DESMLMRUPYGOMJ-IMWIBFENSA-N 3 0 365.565 4.234 20 0 FIADRP CCCCCOc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1OC ZINC000236783544 1123564115 /nfs/dbraw/zinc/56/41/15/1123564115.db2.gz WZPZJHTZVLWOMG-IHWFROFDSA-N 2 0 360.542 4.369 20 0 FIADRP CC(C)N(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(C)C ZINC000615316369 1123989248 /nfs/dbraw/zinc/98/92/48/1123989248.db2.gz RQGABZBZJNXPRF-VQTJNVASSA-N 2 0 373.585 4.185 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(CO)c1 ZINC000245549865 1124118077 /nfs/dbraw/zinc/11/80/77/1124118077.db2.gz GYZATURYCFVEKU-RBUKOAKNSA-N 2 0 352.522 4.262 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000245677431 1124187353 /nfs/dbraw/zinc/18/73/53/1124187353.db2.gz IGNLUJIJNRJWKI-SNJCGAMXSA-N 2 0 355.570 4.036 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1COc2ccccc21 ZINC000245738047 1124231467 /nfs/dbraw/zinc/23/14/67/1124231467.db2.gz RCPYBGDKNOFTEY-BYGOBXPBSA-N 2 0 362.517 4.336 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245750744 1124239421 /nfs/dbraw/zinc/23/94/21/1124239421.db2.gz TZHHCWDQVWYPKN-BUZMGHMJSA-N 3 0 369.597 4.284 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245787513 1124249196 /nfs/dbraw/zinc/24/91/96/1124249196.db2.gz ZTFCWXHYBCZSPS-XBYSBRQOSA-N 3 0 357.586 4.282 20 0 FIADRP CN1CC[C@@H]([NH2+]CCCOCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000518575424 1124370651 /nfs/dbraw/zinc/37/06/51/1124370651.db2.gz WCZLWLYQOHCVPH-DHIUTWEWSA-N 2 0 352.522 4.061 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)CCO2)cc1 ZINC001168654444 1124414729 /nfs/dbraw/zinc/41/47/29/1124414729.db2.gz UBGFNLDBCLUUHI-GIWBLDEGSA-N 2 0 372.553 4.256 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)CCO2)cc1 ZINC001168654450 1124414767 /nfs/dbraw/zinc/41/47/67/1124414767.db2.gz UBGFNLDBCLUUHI-XPNTWCBSSA-N 2 0 372.553 4.256 20 0 FIADRP c1nc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)sc1-c1ccccc1 ZINC000246563746 1124534057 /nfs/dbraw/zinc/53/40/57/1124534057.db2.gz LAXNWMHQZQUJOA-PKOBYXMFSA-N 2 0 353.535 4.259 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)ccc1OC(F)F ZINC000246979028 1124577771 /nfs/dbraw/zinc/57/77/71/1124577771.db2.gz JXXDUMYNKKYPDB-HUUCEWRRSA-N 2 0 356.457 4.068 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cnn(C)c1 ZINC000246996269 1124579843 /nfs/dbraw/zinc/57/98/43/1124579843.db2.gz KKUJHVPUVJNEPF-HMFYCAOWSA-N 2 0 354.542 4.139 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)c(F)c2)[C@@H](C)C1 ZINC000247969030 1124734532 /nfs/dbraw/zinc/73/45/32/1124734532.db2.gz HBUJSOUOFGADAX-FCEWJHQRSA-N 2 0 368.562 4.335 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCCC[C@H]2C)cc1)C(C)C ZINC000248014072 1124738303 /nfs/dbraw/zinc/73/83/03/1124738303.db2.gz SCZOAGCHQQXZIO-HXUWFJFHSA-N 2 0 373.585 4.301 20 0 FIADRP CN1CCC([NH2+][C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000248393932 1124760374 /nfs/dbraw/zinc/76/03/74/1124760374.db2.gz XLICAMGKZQSNEB-RTBURBONSA-N 2 0 367.940 4.077 20 0 FIADRP CN1CCC([NH2+][C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000248393931 1124760591 /nfs/dbraw/zinc/76/05/91/1124760591.db2.gz XLICAMGKZQSNEB-RBUKOAKNSA-N 2 0 367.940 4.077 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(C)cc1 ZINC000248434732 1124767995 /nfs/dbraw/zinc/76/79/95/1124767995.db2.gz DZJLDZQZRWAAAJ-XZOQPEGZSA-N 2 0 352.522 4.193 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1Cl ZINC000248443514 1124769673 /nfs/dbraw/zinc/76/96/73/1124769673.db2.gz LLDYYKSQSGDVTQ-APWZRJJASA-N 2 0 358.913 4.148 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)CC1 ZINC000521917912 1124827777 /nfs/dbraw/zinc/82/77/77/1124827777.db2.gz LKBQGEKZKMENIQ-WDTLCOQZSA-N 2 0 369.597 4.455 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3occc32)C[C@H](C)O1 ZINC000249056664 1124839820 /nfs/dbraw/zinc/83/98/20/1124839820.db2.gz YTGGMVWXUQBVIS-FVJLSDCUSA-N 2 0 354.494 4.056 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000249087081 1124843046 /nfs/dbraw/zinc/84/30/46/1124843046.db2.gz JHHSCCURISSMBP-BKULYWANSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cc2ccccc2s1 ZINC000249192992 1124849608 /nfs/dbraw/zinc/84/96/08/1124849608.db2.gz PBGLPAFLCDRNNL-KFKAGJAMSA-N 2 0 358.551 4.320 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C2CCC2)cc1 ZINC000249875581 1124883787 /nfs/dbraw/zinc/88/37/87/1124883787.db2.gz GVKGZISPZPPPQK-DNQXCXABSA-N 2 0 364.533 4.193 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000090468923 1124998315 /nfs/dbraw/zinc/99/83/15/1124998315.db2.gz XDHXRCLNGQKWLH-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc2ccccc21 ZINC000090523361 1125000920 /nfs/dbraw/zinc/00/09/20/1125000920.db2.gz ITQAJCZDAJYIBS-RTFZILSDSA-N 2 0 352.522 4.258 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(-c2ccccc2)o1 ZINC000090936917 1125027642 /nfs/dbraw/zinc/02/76/42/1125027642.db2.gz YELHPWIFACMYOC-KRWDZBQOSA-N 2 0 365.477 4.133 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285054 1125062536 /nfs/dbraw/zinc/06/25/36/1125062536.db2.gz VOIZYOACUCSSJW-IBGZPJMESA-N 2 0 370.368 4.062 20 0 FIADRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000310897687 1125078852 /nfs/dbraw/zinc/07/88/52/1125078852.db2.gz MDKUPGTUWCQAHO-LJQANCHMSA-N 2 0 358.913 4.350 20 0 FIADRP CC(C)c1ccc(C2(O)CCC([NH2+]C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC000181967043 1125195042 /nfs/dbraw/zinc/19/50/42/1125195042.db2.gz VMEQWVHICPQAQG-UHFFFAOYSA-N 2 0 370.581 4.404 20 0 FIADRP CCCCC/C(=C\c1ccccc1)C[NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000602278694 567962718 /nfs/dbraw/zinc/96/27/18/567962718.db2.gz YDFYQMURUWZTKU-OEZHIIBRSA-N 2 0 369.597 4.408 20 0 FIADRP COc1cccc(C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)c1 ZINC000643546858 1079671924 /nfs/dbraw/zinc/67/19/24/1079671924.db2.gz VWTMCQSANITNGA-IRLDBZIGSA-N 2 0 350.506 4.243 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@H](O)c2ccc(Cl)c(Cl)c2)CC1 ZINC001167077675 1080063027 /nfs/dbraw/zinc/06/30/27/1080063027.db2.gz MCFIXPNTHMYUOP-IBGZPJMESA-N 2 0 373.368 4.471 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000510159309 1080478932 /nfs/dbraw/zinc/47/89/32/1080478932.db2.gz LZNOEIBZEZSSSQ-UHFFFAOYSA-N 2 0 374.532 4.089 20 0 FIADRP Cc1ccc(C[N@@H+]2CCCC3(CC[NH+](Cc4cncs4)CC3)C2)cc1 ZINC001209546626 1080759705 /nfs/dbraw/zinc/75/97/05/1080759705.db2.gz LIOLFXLMYCIPOX-UHFFFAOYSA-N 2 0 355.551 4.330 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N2CCOC2=O)cc1 ZINC000247070684 1080762014 /nfs/dbraw/zinc/76/20/14/1080762014.db2.gz OGWZSXYFKSUPNQ-CEXWTWQISA-N 2 0 373.541 4.052 20 0 FIADRP CNc1ccccc1C[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001648808043 1081107985 /nfs/dbraw/zinc/10/79/85/1081107985.db2.gz APZRSRMUNMYLAX-KDURUIRLSA-N 2 0 351.538 4.496 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2N)C1 ZINC001648808571 1081113237 /nfs/dbraw/zinc/11/32/37/1081113237.db2.gz UWQDGHVJKAMTSG-CALCHBBNSA-N 2 0 355.501 4.176 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccnn3C3CCC3)cc2)C1 ZINC001648808669 1081114407 /nfs/dbraw/zinc/11/44/07/1081114407.db2.gz ZITSDNQIEZDGHV-RTBURBONSA-N 2 0 366.553 4.376 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc3c(c2)OCCCCO3)C1 ZINC001648811399 1081126814 /nfs/dbraw/zinc/12/68/14/1081126814.db2.gz MEEJUZDLTZKMIQ-KDURUIRLSA-N 2 0 360.542 4.086 20 0 FIADRP C[N@H+](Cc1ccccc1NC1CC[NH+]([C@H]2CCOC2)CC1)C1CCCCC1 ZINC000655746810 1081166841 /nfs/dbraw/zinc/16/68/41/1081166841.db2.gz GVFPQMVULDSKJL-QFIPXVFZSA-N 2 0 371.569 4.116 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000655825880 1081233378 /nfs/dbraw/zinc/23/33/78/1081233378.db2.gz NWQBFSMZQDQLLY-UWUNEBHHSA-N 2 0 366.534 4.031 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000655826788 1081233397 /nfs/dbraw/zinc/23/33/97/1081233397.db2.gz YYVKHWZWESAGGM-MAEOIBBWSA-N 2 0 371.912 4.022 20 0 FIADRP CCc1cccc2cc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)oc21 ZINC001648828514 1081265803 /nfs/dbraw/zinc/26/58/03/1081265803.db2.gz FQZSENFWIOBQBQ-UHFFFAOYSA-N 2 0 352.478 4.225 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CCC4(CCCC4)O2)C3)cc1 ZINC000655853723 1081266071 /nfs/dbraw/zinc/26/60/71/1081266071.db2.gz YBNKJZLNIKMXEM-CIAFKFPVSA-N 2 0 354.538 4.263 20 0 FIADRP CC(C)[N@H+](C)C[C@@H](O)C[NH+](Cc1cccc2ccccc21)C1CCCC1 ZINC001167318437 1081357585 /nfs/dbraw/zinc/35/75/85/1081357585.db2.gz MCAPXTAXJRFMME-JOCHJYFZSA-N 2 0 354.538 4.286 20 0 FIADRP CC(C)[N@H+](C)C[C@H](O)C[NH+](Cc1cccc2ccccc21)C1CCCC1 ZINC001167318438 1081358350 /nfs/dbraw/zinc/35/83/50/1081358350.db2.gz MCAPXTAXJRFMME-QFIPXVFZSA-N 2 0 354.538 4.286 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000579982263 1081361201 /nfs/dbraw/zinc/36/12/01/1081361201.db2.gz VFYKTFRDTNDJFM-SJLPKXTDSA-N 2 0 368.949 4.015 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[NH+](C)C ZINC000579986270 1081371549 /nfs/dbraw/zinc/37/15/49/1081371549.db2.gz XNFHXIZNXJDNHG-VSYWRSJOSA-N 2 0 365.565 4.411 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CCC(C(F)F)CC3)cc2)CC1 ZINC000580340000 1081867019 /nfs/dbraw/zinc/86/70/19/1081867019.db2.gz XOXVYPCROIRXOT-UHFFFAOYSA-N 2 0 352.469 4.073 20 0 FIADRP Cc1cc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)ccc1Oc1cccnc1 ZINC000580483653 1081970903 /nfs/dbraw/zinc/97/09/03/1081970903.db2.gz OPBCYJSMHOUWQX-PZJWPPBQSA-N 2 0 351.494 4.098 20 0 FIADRP C[C@@H](NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000471585486 1081984499 /nfs/dbraw/zinc/98/44/99/1081984499.db2.gz MKILJLNUKXBVDB-VKGYTVAMSA-N 2 0 357.586 4.311 20 0 FIADRP Cc1ccc2ncc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)n2c1 ZINC000580588420 1082031821 /nfs/dbraw/zinc/03/18/21/1082031821.db2.gz PKTXAJWJEKHAJO-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000581065786 1082298834 /nfs/dbraw/zinc/29/88/34/1082298834.db2.gz SQHBENKWWHGBCY-CPAJTMIGSA-N 2 0 372.896 4.060 20 0 FIADRP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccc4c(n2)CCC4)CC3)cc1 ZINC000656449880 1082410624 /nfs/dbraw/zinc/41/06/24/1082410624.db2.gz SYJSYUIVCOWKEU-UHFFFAOYSA-N 2 0 361.533 4.058 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)[NH+]1CCCCCC1 ZINC000510389114 1082470740 /nfs/dbraw/zinc/47/07/40/1082470740.db2.gz NUKMAMBTSNPFIZ-RBUKOAKNSA-N 2 0 357.542 4.122 20 0 FIADRP CCCC[C@H](CC)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000581384496 1082507249 /nfs/dbraw/zinc/50/72/49/1082507249.db2.gz YQJXNHNRMSTLIS-YADHBBJMSA-N 2 0 358.570 4.474 20 0 FIADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000430602580 1082572115 /nfs/dbraw/zinc/57/21/15/1082572115.db2.gz WLSQMHQMFAXAAO-UTKZUKDTSA-N 2 0 353.510 4.305 20 0 FIADRP CC(C)Cn1nccc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000647177138 1082865315 /nfs/dbraw/zinc/86/53/15/1082865315.db2.gz MWHBVBPZDMIOJX-UHFFFAOYSA-N 2 0 354.542 4.205 20 0 FIADRP CC[C@@H](c1ccccc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430926428 1083235866 /nfs/dbraw/zinc/23/58/66/1083235866.db2.gz GCZVYLHJPAWDPM-QHCPKHFHSA-N 2 0 357.586 4.266 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000430950882 1083250702 /nfs/dbraw/zinc/25/07/02/1083250702.db2.gz JNOPDTLXXLOCKX-GOSISDBHSA-N 2 0 360.505 4.099 20 0 FIADRP Cc1cccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2cccc(F)c2)c1 ZINC000510716030 1083259173 /nfs/dbraw/zinc/25/91/73/1083259173.db2.gz OFPIXZMNUYPZSK-XZOQPEGZSA-N 2 0 370.512 4.050 20 0 FIADRP CCC[NH+]1CCC(N(C)Cc2cc(Cl)c(OC)c(OCC)c2)CC1 ZINC000092165292 1083358322 /nfs/dbraw/zinc/35/83/22/1083358322.db2.gz ANXABXOYQROHMU-UHFFFAOYSA-N 2 0 354.922 4.054 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCOCC1 ZINC000658319913 1083407037 /nfs/dbraw/zinc/40/70/37/1083407037.db2.gz JSEDNDRBDVPYFL-VXKWHMMOSA-N 2 0 356.554 4.084 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)c1 ZINC000092565106 1083440349 /nfs/dbraw/zinc/44/03/49/1083440349.db2.gz QPCJLSABDMBQQX-UHFFFAOYSA-N 2 0 360.542 4.128 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)o1 ZINC000525708988 1083750884 /nfs/dbraw/zinc/75/08/84/1083750884.db2.gz APKHJHHBYBCRQT-LPHOPBHVSA-N 2 0 364.493 4.013 20 0 FIADRP Clc1cccc(Cl)c1CCC[NH2+]C1CCN(C[C@H]2CCCO2)CC1 ZINC000684614518 1083783551 /nfs/dbraw/zinc/78/35/51/1083783551.db2.gz YJNBMMDJMGRGHP-MRXNPFEDSA-N 2 0 371.352 4.159 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000535839054 1083796641 /nfs/dbraw/zinc/79/66/41/1083796641.db2.gz LBXGCRNDPFFVNN-GGAORHGYSA-N 2 0 352.522 4.396 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)c1 ZINC000065976544 1083904476 /nfs/dbraw/zinc/90/44/76/1083904476.db2.gz SKGKUQDJGOCUIR-UHFFFAOYSA-N 2 0 366.484 4.346 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCC[C@H](c4ccnn4C)C3)CC2)CC1 ZINC000448027301 1083940284 /nfs/dbraw/zinc/94/02/84/1083940284.db2.gz MKLNHNHDDYDNSN-QEMIJWRASA-N 2 0 358.574 4.079 20 0 FIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCCC2)cc1 ZINC000132976660 1083982951 /nfs/dbraw/zinc/98/29/51/1083982951.db2.gz OFQNECJYHQBQKT-URXFXBBRSA-N 2 0 370.581 4.269 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000511003161 1084100121 /nfs/dbraw/zinc/10/01/21/1084100121.db2.gz VETZXPSGJUPPRW-VFNWGFHPSA-N 2 0 372.484 4.113 20 0 FIADRP Brc1ccccc1CNC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000380918081 1084292719 /nfs/dbraw/zinc/29/27/19/1084292719.db2.gz VFXUYZIIHFGPIV-GOSISDBHSA-N 2 0 373.338 4.451 20 0 FIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000537969586 1084319771 /nfs/dbraw/zinc/31/97/71/1084319771.db2.gz GYNFNZWWFGOFQR-HRCADAONSA-N 2 0 358.979 4.202 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)CC[C@H]3CCCC[N@@H+]3C)cc2)CC1 ZINC000431730527 1084322719 /nfs/dbraw/zinc/32/27/19/1084322719.db2.gz VQUJZRQDXJTLJA-OAQYLSRUSA-N 2 0 357.542 4.122 20 0 FIADRP Clc1cccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)C2)c1 ZINC000414068136 1084420735 /nfs/dbraw/zinc/42/07/35/1084420735.db2.gz AWJSQCUFNMDAJQ-CDXJDZJCSA-N 2 0 362.945 4.067 20 0 FIADRP CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523648 1084477223 /nfs/dbraw/zinc/47/72/23/1084477223.db2.gz OMTYIDWRVXRFNI-ROUUACIJSA-N 2 0 359.558 4.191 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@H]4CCC[C@@H](C)C4)CC3)CC2)c1 ZINC000582032413 1084494306 /nfs/dbraw/zinc/49/43/06/1084494306.db2.gz HGLIODLLXXBCKC-NQIIRXRSSA-N 2 0 356.554 4.360 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1ccnn1CC1CC1)C1CCCCC1 ZINC000657323431 1084568465 /nfs/dbraw/zinc/56/84/65/1084568465.db2.gz BCTSELOBPIRKDT-UHFFFAOYSA-N 2 0 366.553 4.347 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511492483 1084647996 /nfs/dbraw/zinc/64/79/96/1084647996.db2.gz IYGRSZUOLMRDLR-UHFFFAOYSA-N 2 0 374.960 4.306 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cs1 ZINC000548712099 1084792549 /nfs/dbraw/zinc/79/25/49/1084792549.db2.gz SJZUKOCZNGLQHV-KSEOMHKRSA-N 2 0 369.578 4.274 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cnn1-c1cccc(Cl)c1 ZINC000414202364 1084799241 /nfs/dbraw/zinc/79/92/41/1084799241.db2.gz ZCDNGXYTROYBRL-WBVHZDCISA-N 2 0 360.933 4.217 20 0 FIADRP CCOc1ccc(Oc2cc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)ccn2)cc1 ZINC000124980435 1084904065 /nfs/dbraw/zinc/90/40/65/1084904065.db2.gz DWQAPIIHPXTALH-KRWDZBQOSA-N 2 0 369.509 4.093 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2c(C3CCC3)cnn2C)C[N@@H+]1Cc1ccccc1 ZINC000657415906 1084952891 /nfs/dbraw/zinc/95/28/91/1084952891.db2.gz OVQYVYXLJVCZOL-QUCCMNQESA-N 2 0 366.553 4.078 20 0 FIADRP COCc1csc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000657415574 1084957968 /nfs/dbraw/zinc/95/79/68/1084957968.db2.gz LAFINQVDDKSEHK-MJGOQNOKSA-N 2 0 358.551 4.285 20 0 FIADRP C[C@H](CCOCc1ccccc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582438744 1084999423 /nfs/dbraw/zinc/99/94/23/1084999423.db2.gz BBPHOFHFLGNGJW-LGVFNWMJSA-N 2 0 366.549 4.482 20 0 FIADRP C[N@@H+]1CC[C@@]2(C1)CCCN(CCOC(c1ccccc1)c1ccccc1)C2 ZINC000660653651 1085202583 /nfs/dbraw/zinc/20/25/83/1085202583.db2.gz UCFFJHWSTKETGI-XMMPIXPASA-N 2 0 364.533 4.210 20 0 FIADRP Fc1cncc([C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000684955564 1085301181 /nfs/dbraw/zinc/30/11/81/1085301181.db2.gz QABUXRGNORKVOL-PGRDOPGGSA-N 2 0 353.485 4.174 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)NCC2CC[NH+](CCC(C)C)CC2)cc1 ZINC000548748220 1085335885 /nfs/dbraw/zinc/33/58/85/1085335885.db2.gz PFZOAFRAXLVBCS-UHFFFAOYSA-N 2 0 373.585 4.016 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]CCCC[NH+]2CCC(C)CC2)c2ccccc21 ZINC000549526047 1085341796 /nfs/dbraw/zinc/34/17/96/1085341796.db2.gz HAJHQXMUHFJJNE-VXKWHMMOSA-N 2 0 372.553 4.270 20 0 FIADRP c1cc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc(C2CCCC2)c1 ZINC000657537773 1085460669 /nfs/dbraw/zinc/46/06/69/1085460669.db2.gz SIQZGXXPRRNDNK-UHFFFAOYSA-N 2 0 356.554 4.325 20 0 FIADRP Cc1cc(F)c(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(Cl)c1 ZINC000657612948 1085691554 /nfs/dbraw/zinc/69/15/54/1085691554.db2.gz GMWBSGBXEAXFCQ-UHFFFAOYSA-N 2 0 361.892 4.184 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613878 1085699562 /nfs/dbraw/zinc/69/95/62/1085699562.db2.gz VOOCFBFUTNIQGO-QGZVFWFLSA-N 2 0 357.929 4.168 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000237526870 1085710469 /nfs/dbraw/zinc/71/04/69/1085710469.db2.gz KUKFMOXPYXAXCX-NPPFBWRTSA-N 2 0 365.521 4.336 20 0 FIADRP CSC1(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC[NH+](C)CC1 ZINC000582875250 1085874039 /nfs/dbraw/zinc/87/40/39/1085874039.db2.gz PGACLJSAFUSDRV-HXUWFJFHSA-N 2 0 358.526 4.332 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC000652348694 1085924464 /nfs/dbraw/zinc/92/44/64/1085924464.db2.gz NVZVQCSMMNRVLT-DNVJHFABSA-N 2 0 356.554 4.453 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)c1ccccc1Cl ZINC000582927146 1085929545 /nfs/dbraw/zinc/92/95/45/1085929545.db2.gz STEYOLCBUXAFST-XNFNUYLZSA-N 2 0 351.966 4.041 20 0 FIADRP Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000663097534 1085989953 /nfs/dbraw/zinc/98/99/53/1085989953.db2.gz YRSQGVWJRRFIFW-JOCHJYFZSA-N 2 0 352.526 4.052 20 0 FIADRP Cc1cnn(CCCCC[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000246990333 1086145798 /nfs/dbraw/zinc/14/57/98/1086145798.db2.gz HXFMWMOBUHTCNT-JTHBVZDNSA-N 2 0 368.569 4.347 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000511234446 1086392485 /nfs/dbraw/zinc/39/24/85/1086392485.db2.gz LWLKRVFTNXQOHE-SFHVURJKSA-N 2 0 364.489 4.338 20 0 FIADRP Clc1ccc(-c2cnc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)o2)cc1 ZINC000662290338 1086397856 /nfs/dbraw/zinc/39/78/56/1086397856.db2.gz CIWDADMSQMKLOE-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP CC(C)c1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000663323976 1086413152 /nfs/dbraw/zinc/41/31/52/1086413152.db2.gz LNHUPCRNVBFHPX-QHCPKHFHSA-N 2 0 352.522 4.057 20 0 FIADRP Cc1cc(C)c(C[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c(C)c1 ZINC000662327971 1086417871 /nfs/dbraw/zinc/41/78/71/1086417871.db2.gz MZZWGZIFBKSZDC-UHFFFAOYSA-N 2 0 366.553 4.182 20 0 FIADRP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327513 1086417893 /nfs/dbraw/zinc/41/78/93/1086417893.db2.gz QEJNVBJENCAIBY-JOCHJYFZSA-N 2 0 370.516 4.347 20 0 FIADRP C[C@@H](c1ccc(F)c(F)c1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327975 1086418536 /nfs/dbraw/zinc/41/85/36/1086418536.db2.gz WWRPAGHLKHQBBD-AWEZNQCLSA-N 2 0 374.479 4.096 20 0 FIADRP Cc1ccc(-c2nc(CNC[C@H]3CCC[N@H+](CC4CC4)C3)cs2)cc1 ZINC000663345527 1086446587 /nfs/dbraw/zinc/44/65/87/1086446587.db2.gz KJAAZBAITNFWIR-GOSISDBHSA-N 2 0 355.551 4.330 20 0 FIADRP CN(c1ccccc1C[NH2+]CC(C)(C)CC(F)(F)F)C1CC[NH+](C)CC1 ZINC000663357778 1086459275 /nfs/dbraw/zinc/45/92/75/1086459275.db2.gz FMOYPJNNGMHQTE-UHFFFAOYSA-N 2 0 371.491 4.285 20 0 FIADRP C[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1OC(F)F ZINC000663468203 1086572431 /nfs/dbraw/zinc/57/24/31/1086572431.db2.gz KEXYRMCICPRMFR-ZFWWWQNUSA-N 2 0 356.432 4.200 20 0 FIADRP CCn1nccc1C[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000663469680 1086575222 /nfs/dbraw/zinc/57/52/22/1086575222.db2.gz LOTFRCGOSDYZDQ-JOCHJYFZSA-N 2 0 372.532 4.385 20 0 FIADRP CC(C)(C)[N@@H+]1CC[C@@](F)(c2nc(-c3cccc(C[NH+]4CCCC4)c3)no2)C1 ZINC000583351592 1086596541 /nfs/dbraw/zinc/59/65/41/1086596541.db2.gz HDMMSSOGQRWJGA-NRFANRHFSA-N 2 0 372.488 4.001 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)n1nc(-c2ccc(F)cc2)c2c1CC[NH2+]CC2 ZINC001167825130 1086612203 /nfs/dbraw/zinc/61/22/03/1086612203.db2.gz REUIKDUOSRRJQH-KRWDZBQOSA-N 2 0 372.532 4.060 20 0 FIADRP COc1ccccc1-c1ccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1 ZINC000583381483 1086628715 /nfs/dbraw/zinc/62/87/15/1086628715.db2.gz MNRMSEVDSBSLDF-NRFANRHFSA-N 2 0 350.506 4.184 20 0 FIADRP c1cc2cc(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)ccc2o1 ZINC000512017741 1086650866 /nfs/dbraw/zinc/65/08/66/1086650866.db2.gz WXJQPOUBLGLRJH-UHFFFAOYSA-N 2 0 350.462 4.197 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(C(=O)c2ccc(F)cc2F)CC1 ZINC001167837915 1086712274 /nfs/dbraw/zinc/71/22/74/1086712274.db2.gz NTPCXVVGWKWHFB-MRXNPFEDSA-N 2 0 366.496 4.370 20 0 FIADRP CCC[N@H+]([C@@H](C)CCC[NH+](CC)CC)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167839578 1086716312 /nfs/dbraw/zinc/71/63/12/1086716312.db2.gz ALTOXBWLAANDAZ-RBUKOAKNSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2cccc(Cl)n2)CC1 ZINC001167839936 1086718587 /nfs/dbraw/zinc/71/85/87/1086718587.db2.gz CUFHMNOANOYXJQ-INIZCTEOSA-N 2 0 353.938 4.089 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432410845 1086732819 /nfs/dbraw/zinc/73/28/19/1086732819.db2.gz SDVUXOBFFIYCLN-LSJNQWAISA-N 2 0 365.359 4.405 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167841370 1086735831 /nfs/dbraw/zinc/73/58/31/1086735831.db2.gz LMOCSOPUWNDZIS-VWNXMTODSA-N 3 0 371.613 4.485 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CCCO1 ZINC000432422559 1086747706 /nfs/dbraw/zinc/74/77/06/1086747706.db2.gz FUVMRCOJSCPNJG-DYVFJYSZSA-N 2 0 357.325 4.071 20 0 FIADRP Cc1cnn(C)c1C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000512122838 1086790131 /nfs/dbraw/zinc/79/01/31/1086790131.db2.gz MUSZMVILGMOYTL-UHFFFAOYSA-N 2 0 374.532 4.281 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CCC(=Cc2cccc(F)c2)CC1 ZINC000583661512 1086905272 /nfs/dbraw/zinc/90/52/72/1086905272.db2.gz QENOPWUWRPBMJT-UHFFFAOYSA-N 2 0 362.452 4.394 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Br)cc1 ZINC000650752552 1086951960 /nfs/dbraw/zinc/95/19/60/1086951960.db2.gz TYFBZCSWABDFQA-QGZVFWFLSA-N 2 0 351.263 4.288 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]CCCCOc3ccccc3)cc2)CC1 ZINC000583768397 1086954354 /nfs/dbraw/zinc/95/43/54/1086954354.db2.gz ZVLQEXVDGYWCFD-UHFFFAOYSA-N 2 0 368.521 4.108 20 0 FIADRP C[C@@H]([NH2+]CCCn1ccnc1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000151159289 1086974943 /nfs/dbraw/zinc/97/49/43/1086974943.db2.gz PVOXMGRLJJXTRB-QGZVFWFLSA-N 2 0 353.441 4.342 20 0 FIADRP c1ccc(COc2ccc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000247064234 1086980355 /nfs/dbraw/zinc/98/03/55/1086980355.db2.gz VOEXDOOKSFIQEU-YADHBBJMSA-N 2 0 350.506 4.025 20 0 FIADRP Cc1c(Br)cccc1C[NH+]1CCC2(CCC[N@@H+](C)C2)CC1 ZINC001279639934 1087013252 /nfs/dbraw/zinc/01/32/52/1087013252.db2.gz SQTXTDYUGKEPDJ-UHFFFAOYSA-N 2 0 351.332 4.065 20 0 FIADRP Cc1ccc2c(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)cc(=O)oc2c1 ZINC000052713562 1087064177 /nfs/dbraw/zinc/06/41/77/1087064177.db2.gz JUEUMEZGZXFMSQ-UHFFFAOYSA-N 2 0 368.521 4.189 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)s1 ZINC000132822596 1087105037 /nfs/dbraw/zinc/10/50/37/1087105037.db2.gz QSSLHTRPGRWBCF-MRXNPFEDSA-N 2 0 358.551 4.118 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(NC(C)=O)cc2)CC1)CC(C)C ZINC000584080786 1087161745 /nfs/dbraw/zinc/16/17/45/1087161745.db2.gz SQKQIVYONAVQAH-UHFFFAOYSA-N 2 0 359.558 4.225 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Br)c(Cl)c1 ZINC000657836568 1087226206 /nfs/dbraw/zinc/22/62/06/1087226206.db2.gz WIGNQCNXYSZIDF-NWDGAFQWSA-N 2 0 357.723 4.237 20 0 FIADRP Cc1ccc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)c(C[NH+](C)C)c1 ZINC000081046804 1087293117 /nfs/dbraw/zinc/29/31/17/1087293117.db2.gz OCVXIVIGWQNEGB-UHFFFAOYSA-N 2 0 360.461 4.448 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)C(C)(C)C(F)F)CC2)cc1 ZINC000657859910 1087410642 /nfs/dbraw/zinc/41/06/42/1087410642.db2.gz YUYJZXHPIVEDSM-OAHLLOKOSA-N 2 0 354.485 4.177 20 0 FIADRP COc1ccc(C[C@@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000090936600 1087411287 /nfs/dbraw/zinc/41/12/87/1087411287.db2.gz AGWQLXYDAYOESO-GOSISDBHSA-N 2 0 374.569 4.269 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091285131 1087427283 /nfs/dbraw/zinc/42/72/83/1087427283.db2.gz VEJBLSAUVHBJGI-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP CC(C)[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091367528 1087428345 /nfs/dbraw/zinc/42/83/45/1087428345.db2.gz CXFIHUAKPXJVKL-LJQANCHMSA-N 2 0 371.491 4.018 20 0 FIADRP FCC1(CF)CC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000657878333 1087521554 /nfs/dbraw/zinc/52/15/54/1087521554.db2.gz GSJSOJHGQRTNBK-UHFFFAOYSA-N 2 0 356.888 4.229 20 0 FIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C(C)(C)C(F)F ZINC000657896704 1087591774 /nfs/dbraw/zinc/59/17/74/1087591774.db2.gz BXBKVALGGBAJMK-QGZVFWFLSA-N 2 0 368.512 4.327 20 0 FIADRP CCOc1ccccc1CC[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508720456 1087622416 /nfs/dbraw/zinc/62/24/16/1087622416.db2.gz MSZNWCUQRTZMQK-DENIHFKCSA-N 2 0 352.522 4.128 20 0 FIADRP CCC[C@@H](CCc1ccccc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067897 1087709892 /nfs/dbraw/zinc/70/98/92/1087709892.db2.gz RINVYKLGITZIBQ-QFIPXVFZSA-N 2 0 358.570 4.269 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc2c(s1)CCCC2 ZINC000658066586 1087710074 /nfs/dbraw/zinc/71/00/74/1087710074.db2.gz CCAOJZSRLFIJSY-MRXNPFEDSA-N 2 0 362.583 4.169 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1C(F)(F)F ZINC000658068502 1087710450 /nfs/dbraw/zinc/71/04/50/1087710450.db2.gz FMRNZPPGYBUVND-HNNXBMFYSA-N 2 0 370.459 4.247 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068970 1087710594 /nfs/dbraw/zinc/71/05/94/1087710594.db2.gz BTTCHCPSKWEPHX-IBGZPJMESA-N 2 0 374.569 4.407 20 0 FIADRP COc1ccc([C@@H](CC(C)C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658070782 1087710868 /nfs/dbraw/zinc/71/08/68/1087710868.db2.gz QKFQSBRWNVVNBZ-HSZRJFAPSA-N 2 0 374.569 4.263 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658069678 1087711007 /nfs/dbraw/zinc/71/10/07/1087711007.db2.gz QEFNIOHPIPKQFJ-GOSISDBHSA-N 2 0 360.542 4.017 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c2ccccc21 ZINC000658136604 1087729710 /nfs/dbraw/zinc/72/97/10/1087729710.db2.gz HNVLBGJQJZODEZ-FGCOXFRFSA-N 2 0 364.533 4.227 20 0 FIADRP CCCC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccccc1 ZINC000658141734 1087733229 /nfs/dbraw/zinc/73/32/29/1087733229.db2.gz UKWXQBOTAHKLDG-DHIUTWEWSA-N 2 0 352.522 4.274 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc2c(s1)CCCC2 ZINC000658142527 1087735324 /nfs/dbraw/zinc/73/53/24/1087735324.db2.gz YMMKNYMCNWKEOG-OXJNMPFZSA-N 2 0 370.562 4.044 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc2c(s1)CCCC2 ZINC000658142524 1087735578 /nfs/dbraw/zinc/73/55/78/1087735578.db2.gz YMMKNYMCNWKEOG-JXFKEZNVSA-N 2 0 370.562 4.044 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc2ccccc2s1 ZINC000658139964 1087745089 /nfs/dbraw/zinc/74/50/89/1087745089.db2.gz RLAYZEHHEBWTTM-UZLBHIALSA-N 2 0 366.530 4.319 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(OC)cc1 ZINC000658165693 1087759581 /nfs/dbraw/zinc/75/95/81/1087759581.db2.gz KCKWIOGVGLAGQA-JOCHJYFZSA-N 2 0 353.510 4.043 20 0 FIADRP CC(C)(C)OC(=O)C(C)(C)CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000424182665 1087812261 /nfs/dbraw/zinc/81/22/61/1087812261.db2.gz ASLQMSQFMZOTGL-UHFFFAOYSA-N 2 0 352.563 4.131 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(Cl)c1 ZINC000424265560 1087886346 /nfs/dbraw/zinc/88/63/46/1087886346.db2.gz JXDONPIOQOGKGX-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518827 1087916621 /nfs/dbraw/zinc/91/66/21/1087916621.db2.gz LEERLPGVMBDCHA-BKVYNOPKSA-N 2 0 364.574 4.130 20 0 FIADRP C[C@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518868 1087916709 /nfs/dbraw/zinc/91/67/09/1087916709.db2.gz LEERLPGVMBDCHA-BMHOQUIDSA-N 2 0 364.574 4.130 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc(CC[C@@H]([NH3+])CC3CCCCC3)n2)cc1 ZINC000424333836 1087926827 /nfs/dbraw/zinc/92/68/27/1087926827.db2.gz DYPKWKKAYNJCDL-LJQANCHMSA-N 2 0 356.514 4.029 20 0 FIADRP Cc1cc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)ccc1Oc1cccnc1 ZINC000424372401 1087961430 /nfs/dbraw/zinc/96/14/30/1087961430.db2.gz FNOUXPVWBVFKAH-GOSISDBHSA-N 2 0 351.494 4.146 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424375781 1087962927 /nfs/dbraw/zinc/96/29/27/1087962927.db2.gz KCFIUUBTTOLCRZ-HNNXBMFYSA-N 2 0 372.944 4.107 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000414787659 1087987219 /nfs/dbraw/zinc/98/72/19/1087987219.db2.gz VSFQMCXWUGXRRC-LEWJYISDSA-N 2 0 350.506 4.184 20 0 FIADRP c1ccc2c(c1)C1C[C@H](C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)C2c2ccccc21 ZINC000647550764 1088062841 /nfs/dbraw/zinc/06/28/41/1088062841.db2.gz GMLZHJQUZPFNOB-QDOGXUEESA-N 2 0 358.529 4.261 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]C[C@H]2CCC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414825270 1088330091 /nfs/dbraw/zinc/33/00/91/1088330091.db2.gz GXBJLAFCHYEGHX-HNNXBMFYSA-N 2 0 360.933 4.048 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1)c1ccccc1Cl ZINC000414833542 1088370585 /nfs/dbraw/zinc/37/05/85/1088370585.db2.gz GIEODKZUEZTWFY-MRXNPFEDSA-N 2 0 371.912 4.072 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)[C@@H]2CCC[C@@H]21 ZINC000514095661 1088715079 /nfs/dbraw/zinc/71/50/79/1088715079.db2.gz SFAOXJNFKAJOOO-RLLPEYFOSA-N 3 0 355.570 4.023 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2ccccc2s1 ZINC000188286541 1088921715 /nfs/dbraw/zinc/92/17/15/1088921715.db2.gz RPDPKJGSKOKQBH-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000514249492 1088928999 /nfs/dbraw/zinc/92/89/99/1088928999.db2.gz GUQOJAXHWFJOFI-YAECTWJJSA-N 2 0 370.924 4.100 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c(-c2ccccc2Cl)n1 ZINC000415029510 1089058407 /nfs/dbraw/zinc/05/84/07/1089058407.db2.gz DPOGLMIKYKAREG-GDBMZVCRSA-N 2 0 360.933 4.176 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415033658 1089071803 /nfs/dbraw/zinc/07/18/03/1089071803.db2.gz JCTAPKNMWFXJNG-ICSRJNTNSA-N 2 0 360.505 4.065 20 0 FIADRP COc1ccc(Br)c(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415055308 1089098943 /nfs/dbraw/zinc/09/89/43/1089098943.db2.gz OFTICOYMQQEMAO-SFHVURJKSA-N 2 0 363.299 4.028 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)CCN1Cc1ccccc1 ZINC000415062075 1089112776 /nfs/dbraw/zinc/11/27/76/1089112776.db2.gz ZNXKLBFGBYEXTJ-WTIAFYNJSA-N 2 0 351.538 4.109 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C)C[C@H]3CCC[NH2+]3)s2)cc1 ZINC000415113005 1089173407 /nfs/dbraw/zinc/17/34/07/1089173407.db2.gz SECQYNBGRKEYIH-GRDNDAEWSA-N 2 0 359.539 4.308 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCC(C[NH3+])CC3)s2)cc1 ZINC000415116773 1089176322 /nfs/dbraw/zinc/17/63/22/1089176322.db2.gz VECSTMMONCLOGH-KTAKPFMOSA-N 2 0 359.539 4.295 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000415127268 1089179900 /nfs/dbraw/zinc/17/99/00/1089179900.db2.gz QRPVLSLESQHJEI-JPYJTQIMSA-N 2 0 370.537 4.494 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)s3)CC2)C1 ZINC000415119904 1089182656 /nfs/dbraw/zinc/18/26/56/1089182656.db2.gz FUHFNWSEDOPCCM-QUCCMNQESA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](CC3CCC(c4ccccc4)CC3)CC2)C1 ZINC000415121249 1089183038 /nfs/dbraw/zinc/18/30/38/1089183038.db2.gz HVRWTORUPAWDFC-FRZIOBBBSA-N 2 0 356.554 4.179 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CC2)c1 ZINC000415121683 1089184768 /nfs/dbraw/zinc/18/47/68/1089184768.db2.gz ZEOYVVFPGXQXSM-RCCFBDPRSA-N 2 0 352.444 4.247 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000415130705 1089196998 /nfs/dbraw/zinc/19/69/98/1089196998.db2.gz RKNOUGRCDCXFGC-XZOQPEGZSA-N 2 0 350.506 4.072 20 0 FIADRP C[NH+](C)[C@H]1CCOc2c(NC3CC[NH+](C4CCCCC4)CC3)cccc21 ZINC000435037911 1089213978 /nfs/dbraw/zinc/21/39/78/1089213978.db2.gz OVWPAZSMWCDAQZ-NRFANRHFSA-N 2 0 357.542 4.281 20 0 FIADRP C[NH+](C)[C@@H]1CCOc2c(NC3CC[NH+](Cc4ccccc4)CC3)cccc21 ZINC000435034074 1089231331 /nfs/dbraw/zinc/23/13/31/1089231331.db2.gz LAKWOBMWRNIERO-JOCHJYFZSA-N 2 0 365.521 4.148 20 0 FIADRP Cc1ccccc1C[N@@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000505607789 1089288409 /nfs/dbraw/zinc/28/84/09/1089288409.db2.gz KHMXSAQMSJYVJL-UHFFFAOYSA-N 2 0 351.538 4.157 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549235993 1089315065 /nfs/dbraw/zinc/31/50/65/1089315065.db2.gz TYVMBANGISUOPS-DLTYFMDKSA-N 2 0 364.533 4.059 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)CC1 ZINC000515067270 1089752870 /nfs/dbraw/zinc/75/28/70/1089752870.db2.gz AIXTZGALKFQGAO-KRWDZBQOSA-N 2 0 359.341 4.269 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000163782175 1089784032 /nfs/dbraw/zinc/78/40/32/1089784032.db2.gz YNOXVWFEPUOHCI-GKVSMKOHSA-N 2 0 358.551 4.117 20 0 FIADRP CC[N@H+](CCC1CCN(C(=O)Nc2ccccc2C[NH2+]C)CC1)CC(C)C ZINC000415898911 1089982529 /nfs/dbraw/zinc/98/25/29/1089982529.db2.gz IEVQZFIGHZBYNY-UHFFFAOYSA-N 2 0 374.573 4.018 20 0 FIADRP CO[C@H](C[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000549392955 1090018587 /nfs/dbraw/zinc/01/85/87/1090018587.db2.gz FUBBJGNKRPTJHF-VNHKHXMHSA-N 2 0 352.522 4.120 20 0 FIADRP FC(F)(F)[C@@H]1CC([NH2+][C@H]2CC[NH2+]C23CCCC3)C[C@@H](C(F)(F)F)C1 ZINC000925527632 1090270271 /nfs/dbraw/zinc/27/02/71/1090270271.db2.gz WAKSJMKUYJUCGV-GVXVVHGQSA-N 2 0 358.370 4.160 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc([S@](C)=O)cc1 ZINC000163937316 1090280226 /nfs/dbraw/zinc/28/02/26/1090280226.db2.gz BICOZYLOIZBTHV-WXTAPIANSA-N 2 0 370.562 4.261 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000312148361 1090320088 /nfs/dbraw/zinc/32/00/88/1090320088.db2.gz DCBKYDQGTJQECS-HBFSDRIKSA-N 2 0 371.525 4.237 20 0 FIADRP Cc1cccc(C[N@H+](CCCN2CC[NH+](C(C)C)CC2)Cc2ccco2)c1 ZINC000500132080 1091058284 /nfs/dbraw/zinc/05/82/84/1091058284.db2.gz LFZHMIWUQIOEDF-UHFFFAOYSA-N 2 0 369.553 4.006 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000192682738 1091185581 /nfs/dbraw/zinc/18/55/81/1091185581.db2.gz PZZCAJAKUOAZEQ-QHCPKHFHSA-N 2 0 367.537 4.444 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000390685386 1091399311 /nfs/dbraw/zinc/39/93/11/1091399311.db2.gz XPVVBLFSSASETL-AVRDEDQJSA-N 2 0 352.522 4.214 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000511772552 1091656979 /nfs/dbraw/zinc/65/69/79/1091656979.db2.gz MPIMTXJENRGRTE-DXIQSLLYSA-N 2 0 352.522 4.214 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000511772558 1091657009 /nfs/dbraw/zinc/65/70/09/1091657009.db2.gz MPIMTXJENRGRTE-XQBPLPMBSA-N 2 0 352.522 4.214 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2c(F)ccc(O)c2F)C[N@@H+]1Cc1ccccc1 ZINC000511778320 1091668121 /nfs/dbraw/zinc/66/81/21/1091668121.db2.gz ZIZDGZGORDPEGW-DOTOQJQBSA-N 2 0 360.448 4.061 20 0 FIADRP Cc1cc(OCC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)ccc1C(C)C ZINC000466932416 1091706281 /nfs/dbraw/zinc/70/62/81/1091706281.db2.gz AFSAOBRTIFUXJO-UHFFFAOYSA-N 2 0 374.569 4.074 20 0 FIADRP CC1CC[NH+](C[C@H]2CCCN(Cc3cnc(-c4ccncc4)s3)C2)CC1 ZINC000512191884 1091819885 /nfs/dbraw/zinc/81/98/85/1091819885.db2.gz BFALBSAPTKQNKK-GOSISDBHSA-N 2 0 370.566 4.149 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(Cl)c1 ZINC000467839154 1091886146 /nfs/dbraw/zinc/88/61/46/1091886146.db2.gz NNEDAKYZWZXXPW-FQEVSTJZSA-N 2 0 372.944 4.118 20 0 FIADRP [NH2+]=C(NCCCC[NH3+])Nc1ccc(-c2ccccc2)cc1C(F)(F)F ZINC001167883637 1091960348 /nfs/dbraw/zinc/96/03/48/1091960348.db2.gz KSTJWUXBCCODEX-UHFFFAOYSA-N 2 0 350.388 4.048 20 0 FIADRP CCC1(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCOCC1 ZINC000512383099 1092201683 /nfs/dbraw/zinc/20/16/83/1092201683.db2.gz SXSKGYMXEMPILS-UHFFFAOYSA-N 2 0 356.510 4.208 20 0 FIADRP Cc1c2cccc(Cl)c2sc1C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000508376182 1092306213 /nfs/dbraw/zinc/30/62/13/1092306213.db2.gz OJJLXSSHRMFTRB-UHFFFAOYSA-N 2 0 366.958 4.406 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H](C[NH+](C)C)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012210 1092346012 /nfs/dbraw/zinc/34/60/12/1092346012.db2.gz XXOMYWSBHUWLKP-WNXIRNOKSA-N 2 0 365.565 4.321 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000474028968 1092369151 /nfs/dbraw/zinc/36/91/51/1092369151.db2.gz GRXMDPWHNMSFKE-QFIPXVFZSA-N 2 0 365.521 4.319 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(Br)cc2F)C1 ZINC000520949871 1092376279 /nfs/dbraw/zinc/37/62/79/1092376279.db2.gz UGAFKSHMMVTFBB-CQSZACIVSA-N 2 0 357.311 4.190 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCC(=O)c2ccc(F)cc2)CC1 ZINC000512461871 1092426007 /nfs/dbraw/zinc/42/60/07/1092426007.db2.gz GFTZLCUYOOMNER-UHFFFAOYSA-N 2 0 368.496 4.243 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000521272300 1092614705 /nfs/dbraw/zinc/61/47/05/1092614705.db2.gz XIWRYGOYFZTGEZ-FGTMMUONSA-N 2 0 356.432 4.033 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000442706805 1092733384 /nfs/dbraw/zinc/73/33/84/1092733384.db2.gz FFYPTNIGRADFID-UHFFFAOYSA-N 2 0 354.485 4.321 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC(C(F)F)CC3)CC2)cc1 ZINC000442775960 1092756840 /nfs/dbraw/zinc/75/68/40/1092756840.db2.gz GYQDFGJPJBJPDB-UHFFFAOYSA-N 2 0 366.496 4.321 20 0 FIADRP C[N@@H+]1CCN(CC[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1(C)C ZINC000442874969 1092822397 /nfs/dbraw/zinc/82/23/97/1092822397.db2.gz RXDXXVPDEIGOOE-OAQYLSRUSA-N 2 0 371.956 4.045 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(Br)cc1F ZINC000521816802 1092936078 /nfs/dbraw/zinc/93/60/78/1092936078.db2.gz ITIXRTDTMNNSKY-CQSZACIVSA-N 2 0 357.311 4.332 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000512614115 1092992526 /nfs/dbraw/zinc/99/25/26/1092992526.db2.gz UXGIGPGNHMPXGI-NJDAHSKKSA-N 2 0 369.578 4.193 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(Cn3ccnc3)cc2)cc1 ZINC000152107520 1092994504 /nfs/dbraw/zinc/99/45/04/1092994504.db2.gz AWKCHMICSBSRCX-SFHVURJKSA-N 2 0 371.488 4.276 20 0 FIADRP C[C@@H]1C[C@@H](NCCC[N@H+]2CCCC[C@@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168015287 1092997804 /nfs/dbraw/zinc/99/78/04/1092997804.db2.gz QMDRBHSAFFVSEB-QXUYBEEESA-N 2 0 357.586 4.282 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000474042945 1093036994 /nfs/dbraw/zinc/03/69/94/1093036994.db2.gz FJEJFZDGEYSNBS-YTFSRNRJSA-N 2 0 356.554 4.357 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cs1 ZINC000512636275 1093052213 /nfs/dbraw/zinc/05/22/13/1093052213.db2.gz KWGPJIKUDMDHPD-HLAWJBBLSA-N 2 0 369.578 4.138 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168017513 1093151277 /nfs/dbraw/zinc/15/12/77/1093151277.db2.gz AVOOOVGUTFYMBP-KLXZVUIASA-N 2 0 355.570 4.033 20 0 FIADRP Cc1nc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c(C)s1 ZINC000433043812 1093153880 /nfs/dbraw/zinc/15/38/80/1093153880.db2.gz GIXGPHOJQJTZGL-UHFFFAOYSA-N 2 0 355.551 4.248 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC3(CO)CC(c4ccccc4)C3)CC2)C1 ZINC000433094077 1093241270 /nfs/dbraw/zinc/24/12/70/1093241270.db2.gz TXUPQOAJYVMKOG-LDOASJGRSA-N 2 0 370.581 4.175 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@]23C[C@H]4C[C@@H](C2)C[C@](O)(C4)C3)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168022432 1093304564 /nfs/dbraw/zinc/30/45/64/1093304564.db2.gz RXXKGJGQMPMEAZ-XGSIWGDSSA-N 2 0 368.565 4.101 20 0 FIADRP CC(C)(O)c1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000249001426 1093324781 /nfs/dbraw/zinc/32/47/81/1093324781.db2.gz QTGJGPVPYWMUSZ-NUNAXRQHSA-N 2 0 364.533 4.199 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccccc2-n2cccn2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168023530 1093363046 /nfs/dbraw/zinc/36/30/46/1093363046.db2.gz XFBUFAZMQSUELW-PMACEKPBSA-N 2 0 374.532 4.404 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Br)cc2)[C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919296 1093433829 /nfs/dbraw/zinc/43/38/29/1093433829.db2.gz XQNUZABDZXOKSL-MBBYRJAFSA-N 2 0 363.343 4.320 20 0 FIADRP COC(=O)CC1([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001168028839 1093542089 /nfs/dbraw/zinc/54/20/89/1093542089.db2.gz QPXHVFUEEYSVMY-CEQLMSFQSA-N 2 0 372.553 4.284 20 0 FIADRP C[C@@H]1CC(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032308 1093652536 /nfs/dbraw/zinc/65/25/36/1093652536.db2.gz HLWKHISNHNHDLT-KCZVDYSFSA-N 2 0 369.597 4.425 20 0 FIADRP C[C@@H]1CC([NH2+]C2(Cc3ccc(O)cc3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031822 1093656190 /nfs/dbraw/zinc/65/61/90/1093656190.db2.gz CLPBRVIPCLDAES-RTBURBONSA-N 2 0 364.533 4.499 20 0 FIADRP C[C@@H]1CC(N2CCC([NH3+])(CC3CC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032595 1093666977 /nfs/dbraw/zinc/66/69/77/1093666977.db2.gz IEZNBJONXZAFSD-RTBURBONSA-N 3 0 355.570 4.021 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2COc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032954 1093680070 /nfs/dbraw/zinc/68/00/70/1093680070.db2.gz JEIIHMPSACKTBV-MHXAIHSWSA-N 2 0 364.533 4.269 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC1CC[NH+](C2CCCCC2)CC1 ZINC000513042934 1093689129 /nfs/dbraw/zinc/68/91/29/1093689129.db2.gz VUAKJTCVFNUPAO-HYBUGGRVSA-N 2 0 369.597 4.284 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000513052911 1093697797 /nfs/dbraw/zinc/69/77/97/1093697797.db2.gz UHINXJVCYUNDCF-WMZHIEFXSA-N 2 0 359.517 4.420 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3cc(F)ccc23)CC1 ZINC000513063542 1093715410 /nfs/dbraw/zinc/71/54/10/1093715410.db2.gz IFECVDPZXUNKPP-KSFYIVLOSA-N 2 0 357.517 4.482 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000067222994 1093720447 /nfs/dbraw/zinc/72/04/47/1093720447.db2.gz GACPETNIIIACKD-SFHVURJKSA-N 2 0 374.550 4.157 20 0 FIADRP COCc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168034491 1093753914 /nfs/dbraw/zinc/75/39/14/1093753914.db2.gz PTLIUIKOECLLFF-BBIADKPPSA-N 2 0 352.522 4.364 20 0 FIADRP C[C@H]1CC([NH2+]C(C)(C)Cc2cccnc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168034693 1093763922 /nfs/dbraw/zinc/76/39/22/1093763922.db2.gz QPYAUDKPGDULSM-OALUTQOASA-N 2 0 351.538 4.434 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2Cc3ccc(F)cc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168035081 1093792483 /nfs/dbraw/zinc/79/24/83/1093792483.db2.gz SNTIUPQRAOWIGE-OIDISNMWSA-N 2 0 352.497 4.324 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)[C@H](C)C1CCCCC1 ZINC000474473473 1093818441 /nfs/dbraw/zinc/81/84/41/1093818441.db2.gz JLQCVGALSGOCNX-RBUKOAKNSA-N 2 0 358.570 4.338 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OC ZINC000474484542 1093831628 /nfs/dbraw/zinc/83/16/28/1093831628.db2.gz KOEMSMHQCJYNPG-IAGOWNOFSA-N 2 0 356.510 4.047 20 0 FIADRP C[C@@H]1CC(N2CCC([NH3+])(CC3CCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036077 1093836309 /nfs/dbraw/zinc/83/63/09/1093836309.db2.gz TUVQIWCOYLGJNH-WOJBJXKFSA-N 2 0 369.597 4.412 20 0 FIADRP C[C@H]1CC(N2CCC([NH3+])(CC3CCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168036071 1093836758 /nfs/dbraw/zinc/83/67/58/1093836758.db2.gz TUVQIWCOYLGJNH-PMACEKPBSA-N 2 0 369.597 4.412 20 0 FIADRP C[C@@H]1C[C@@H](N(C(N)=[NH2+])c2ccc(Cl)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036254 1093849585 /nfs/dbraw/zinc/84/95/85/1093849585.db2.gz URCHWPMEYKWVHV-CWPLJXCYSA-N 2 0 370.928 4.481 20 0 FIADRP COCc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513487684 1094158192 /nfs/dbraw/zinc/15/81/92/1094158192.db2.gz IQOZTGBOZOPEIT-UGKGYDQZSA-N 2 0 352.522 4.223 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1F ZINC000513494099 1094162322 /nfs/dbraw/zinc/16/23/22/1094162322.db2.gz FWRQSVDBGWEFFI-FXAWDEMLSA-N 2 0 356.485 4.225 20 0 FIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1OC ZINC000513495746 1094162845 /nfs/dbraw/zinc/16/28/45/1094162845.db2.gz UPRKDIZMMIZCBM-QUCCMNQESA-N 2 0 368.521 4.094 20 0 FIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1OC ZINC000513495745 1094162977 /nfs/dbraw/zinc/16/29/77/1094162977.db2.gz UPRKDIZMMIZCBM-ICSRJNTNSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(-n3ccnc3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000513488016 1094167232 /nfs/dbraw/zinc/16/72/32/1094167232.db2.gz NQCMKJQQMVBESW-NFBKMPQASA-N 2 0 374.532 4.263 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(OC)c1 ZINC000513510497 1094184817 /nfs/dbraw/zinc/18/48/17/1094184817.db2.gz DDNMHCOUICJICE-AZUAARDMSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]1CC(NC2CC[NH+](CC3CCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168037275 1094361017 /nfs/dbraw/zinc/36/10/17/1094361017.db2.gz XHECMJQMRBQWGF-WOJBJXKFSA-N 2 0 369.597 4.282 20 0 FIADRP C[N@@H+](Cc1coc(-c2ccccc2)n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501029555 1094429662 /nfs/dbraw/zinc/42/96/62/1094429662.db2.gz RUDFPPKIEPHRMU-UHFFFAOYSA-N 2 0 362.477 4.085 20 0 FIADRP CC(C)Oc1ccccc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049073 1094455324 /nfs/dbraw/zinc/45/53/24/1094455324.db2.gz ATPHIRQQTKDJFY-UHFFFAOYSA-N 2 0 353.510 4.217 20 0 FIADRP C[N@@H+](Cc1csc(-c2ccco2)n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501057013 1094466254 /nfs/dbraw/zinc/46/62/54/1094466254.db2.gz YGVWYDIKCWNTCI-UHFFFAOYSA-N 2 0 368.506 4.147 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001168039919 1094480714 /nfs/dbraw/zinc/48/07/14/1094480714.db2.gz IRQKWXRKYSKLLI-NVJIOZQYSA-N 2 0 357.586 4.136 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC001168039922 1094480883 /nfs/dbraw/zinc/48/08/83/1094480883.db2.gz IRQKWXRKYSKLLI-URFJDIBFSA-N 2 0 357.586 4.136 20 0 FIADRP COc1ccc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000501077747 1094495083 /nfs/dbraw/zinc/49/50/83/1094495083.db2.gz ORTNDXBCNWIKEO-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000501117298 1094516270 /nfs/dbraw/zinc/51/62/70/1094516270.db2.gz IKSWJYPPYRPVIK-HBMCJLEFSA-N 2 0 365.565 4.391 20 0 FIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000532216199 1094607680 /nfs/dbraw/zinc/60/76/80/1094607680.db2.gz XWJPURIIGADPTI-GOSISDBHSA-N 2 0 356.510 4.185 20 0 FIADRP CC(C)C[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1 ZINC000474797810 1094613355 /nfs/dbraw/zinc/61/33/55/1094613355.db2.gz ABALIQAGEVXYGA-YMPZKCBVSA-N 2 0 358.570 4.174 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]C[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000474811466 1094633868 /nfs/dbraw/zinc/63/38/68/1094633868.db2.gz ROVAOZNXIRUJQA-XIVBQZFQSA-N 2 0 370.459 4.103 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000474800490 1094636790 /nfs/dbraw/zinc/63/67/90/1094636790.db2.gz MPGGRWRHIFFPQT-AFMUBRCDSA-N 2 0 364.961 4.190 20 0 FIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCc2ccc(F)cc21 ZINC000501538883 1094765703 /nfs/dbraw/zinc/76/57/03/1094765703.db2.gz LJGURYUDFYJOMI-JOCHJYFZSA-N 2 0 353.485 4.447 20 0 FIADRP Clc1ccccc1-c1csc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)n1 ZINC000420325580 1094889402 /nfs/dbraw/zinc/88/94/02/1094889402.db2.gz IVQSLXDWZDTNJP-GJZGRUSLSA-N 2 0 361.942 4.285 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420386591 1094906994 /nfs/dbraw/zinc/90/69/94/1094906994.db2.gz VEJFNXIEBBODRF-NXOUGTEYSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccccc3Oc3ccccc3)CC2)C1 ZINC000420386642 1094907310 /nfs/dbraw/zinc/90/73/10/1094907310.db2.gz JBPMWPQZQLCKKH-NZQKXSOJSA-N 2 0 366.505 4.197 20 0 FIADRP COc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1Br ZINC000501784568 1094923260 /nfs/dbraw/zinc/92/32/60/1094923260.db2.gz HPOXUOZFCHJVCT-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000474943880 1094938925 /nfs/dbraw/zinc/93/89/25/1094938925.db2.gz OEHLVGQEIDGUOR-PNLZDCPESA-N 2 0 372.940 4.188 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)CC1 ZINC000501902122 1094995840 /nfs/dbraw/zinc/99/58/40/1094995840.db2.gz WPTPNJSLDPDFJU-NRFANRHFSA-N 2 0 363.977 4.283 20 0 FIADRP CC[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000502059014 1095076245 /nfs/dbraw/zinc/07/62/45/1095076245.db2.gz VHRQNFNWRLLPCZ-NZQKXSOJSA-N 2 0 374.569 4.235 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCC23CCOCC3)C[N@@H+]1Cc1ccccc1 ZINC000502411455 1095436007 /nfs/dbraw/zinc/43/60/07/1095436007.db2.gz ARZRCCFKBGUYFD-BAGYTPMASA-N 2 0 356.554 4.226 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(C2CCCC2)c1 ZINC000502458545 1095487872 /nfs/dbraw/zinc/48/78/72/1095487872.db2.gz CXQQBSQIXWNWTF-AZUAARDMSA-N 2 0 352.526 4.171 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]C[C@H]4CC45CCSCC5)[C@H]3C2)cc1 ZINC000421384113 1095586805 /nfs/dbraw/zinc/58/68/05/1095586805.db2.gz OWHBYWHNGQTVFA-WOZUAGRISA-N 2 0 356.579 4.020 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1 ZINC000522799478 1095690621 /nfs/dbraw/zinc/69/06/21/1095690621.db2.gz DSWPFAVZROZDKE-NJDAHSKKSA-N 2 0 365.565 4.391 20 0 FIADRP C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)CC[C@H]1CCCC[NH+]1C ZINC000444166191 1095792111 /nfs/dbraw/zinc/79/21/11/1095792111.db2.gz ISZRUJCOCPXNRI-OAHLLOKOSA-N 2 0 372.340 4.128 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)[nH]1 ZINC000503123194 1096075225 /nfs/dbraw/zinc/07/52/25/1096075225.db2.gz RJJXXAANOCTCBZ-BGWNEDDSSA-N 2 0 359.517 4.211 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]C[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000272649894 1096198362 /nfs/dbraw/zinc/19/83/62/1096198362.db2.gz DTHQXIIFGANLSO-MJGOQNOKSA-N 2 0 370.459 4.161 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccsc2S1 ZINC000272774861 1096210692 /nfs/dbraw/zinc/21/06/92/1096210692.db2.gz UETWOXFXJOGREN-UCLAIMLFSA-N 2 0 374.575 4.030 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000414654332 1096349968 /nfs/dbraw/zinc/34/99/68/1096349968.db2.gz BYKPKUFMXQAMSH-RTBURBONSA-N 2 0 360.505 4.017 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000414662431 1096372011 /nfs/dbraw/zinc/37/20/11/1096372011.db2.gz QFNRHQAIUWOBTI-ICSRJNTNSA-N 2 0 360.505 4.017 20 0 FIADRP CCCOc1c(Cl)cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)cc1OCC ZINC000414668332 1096388178 /nfs/dbraw/zinc/38/81/78/1096388178.db2.gz IWXNRLPPRJEWNQ-CQSZACIVSA-N 2 0 354.922 4.087 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1cnccc1N ZINC000422733560 1096465125 /nfs/dbraw/zinc/46/51/25/1096465125.db2.gz RDXZPDSHKWDGIE-KRWDZBQOSA-N 2 0 352.526 4.109 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@H]2[NH2+]CCCCCOC1CCCCC1 ZINC000422716812 1096469193 /nfs/dbraw/zinc/46/91/93/1096469193.db2.gz URSJOHOQHGDKGX-GGAORHGYSA-N 2 0 372.553 4.352 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@@H]2[NH2+]CCCCCOC1CCCCC1 ZINC000422716814 1096469394 /nfs/dbraw/zinc/46/93/94/1096469394.db2.gz URSJOHOQHGDKGX-GMAHTHKFSA-N 2 0 372.553 4.352 20 0 FIADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCCSc1ccccc1Br ZINC000422759084 1096474833 /nfs/dbraw/zinc/47/48/33/1096474833.db2.gz OVAJGZATPZWIQC-HIFRSBDPSA-N 2 0 357.361 4.038 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)c2ccccc21 ZINC000422768369 1096485516 /nfs/dbraw/zinc/48/55/16/1096485516.db2.gz SYAPFYCKQAVCJG-WOJBJXKFSA-N 2 0 356.897 4.123 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422785841 1096489926 /nfs/dbraw/zinc/48/99/26/1096489926.db2.gz RUWHERPACBBDEO-LXBDKUERSA-N 2 0 366.505 4.382 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@H](C)CCC[NH3+])cc1OC ZINC000422795110 1096492283 /nfs/dbraw/zinc/49/22/83/1096492283.db2.gz ZLRZLYYRPZFSCI-XLIONFOSSA-N 2 0 356.510 4.013 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OC(C)C ZINC000422805430 1096496429 /nfs/dbraw/zinc/49/64/29/1096496429.db2.gz GSIYKGYULUUKPT-HUUCEWRRSA-N 2 0 357.498 4.056 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H](Cc2ccccc2)[C@H](C)[NH3+])cc1 ZINC000422811059 1096497133 /nfs/dbraw/zinc/49/71/33/1096497133.db2.gz TVCCZBYVVBXRFI-AWDZXFJFSA-N 2 0 352.522 4.011 20 0 FIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422791232 1096498215 /nfs/dbraw/zinc/49/82/15/1096498215.db2.gz PZAMDDABFCEMGN-CHWSQXEVSA-N 2 0 353.388 4.108 20 0 FIADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422789657 1096498597 /nfs/dbraw/zinc/49/85/97/1096498597.db2.gz OSNIGGZHYWPMTB-GDBMZVCRSA-N 2 0 365.399 4.110 20 0 FIADRP c1nc2ccccc2n1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422828251 1096500681 /nfs/dbraw/zinc/50/06/81/1096500681.db2.gz ODRSJNJTAHLAAZ-FDFHNCONSA-N 2 0 374.532 4.095 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c(OC2CCCC2)c1 ZINC000422819459 1096503742 /nfs/dbraw/zinc/50/37/42/1096503742.db2.gz IIHWFNRRCVDDCF-OAHLLOKOSA-N 2 0 369.509 4.030 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000422851351 1096504998 /nfs/dbraw/zinc/50/49/98/1096504998.db2.gz ORKSDAHEODMCIU-INIZCTEOSA-N 2 0 353.510 4.411 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)c(Oc2ccccc2)c1 ZINC000422864718 1096508378 /nfs/dbraw/zinc/50/83/78/1096508378.db2.gz NVULFOFWKCHQPQ-YPAWHYETSA-N 2 0 366.505 4.034 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000422879528 1096510814 /nfs/dbraw/zinc/51/08/14/1096510814.db2.gz MIWHVNJFTVYURV-HSALFYBXSA-N 2 0 364.961 4.145 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000422880929 1096511208 /nfs/dbraw/zinc/51/12/08/1096511208.db2.gz XVDNKVNBKKXYNA-LRDDRELGSA-N 2 0 367.946 4.176 20 0 FIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422883960 1096512344 /nfs/dbraw/zinc/51/23/44/1096512344.db2.gz WAROEBAMKBQWKN-SXWKCWPCSA-N 2 0 366.505 4.382 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000422884255 1096512494 /nfs/dbraw/zinc/51/24/94/1096512494.db2.gz WPYNXNRTNRDHQM-BLLLJJGKSA-N 2 0 367.946 4.176 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1nc(-c2ccc(Br)cc2)cs1 ZINC000422887216 1096514385 /nfs/dbraw/zinc/51/43/85/1096514385.db2.gz AMAHCESMPKMTHC-NWDGAFQWSA-N 2 0 368.344 4.351 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422901574 1096518975 /nfs/dbraw/zinc/51/89/75/1096518975.db2.gz SEMHKQSDNXMMPU-PCCBWWKXSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)ccc1Oc1cccnc1 ZINC000422901951 1096519804 /nfs/dbraw/zinc/51/98/04/1096519804.db2.gz LXPJFAKVELWGAV-HLAWJBBLSA-N 2 0 369.484 4.413 20 0 FIADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911369 1096521108 /nfs/dbraw/zinc/52/11/08/1096521108.db2.gz KPUSVCHKBDTWAC-APWZRJJASA-N 2 0 357.567 4.281 20 0 FIADRP Cc1sc(CC[NH2+][C@@H](Cc2ccccc2)[C@@H](C)[NH3+])nc1-c1ccccc1 ZINC000422927543 1096526913 /nfs/dbraw/zinc/52/69/13/1096526913.db2.gz GQWYIYNTFAWMLB-UZLBHIALSA-N 2 0 365.546 4.209 20 0 FIADRP c1sc(CCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)nc1-c1ccncc1 ZINC000422956887 1096538921 /nfs/dbraw/zinc/53/89/21/1096538921.db2.gz RHGWZVGQSAHWJU-GBESFXJTSA-N 2 0 370.566 4.038 20 0 FIADRP c1ccc(COc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)ccn2)cc1 ZINC000422972082 1096542156 /nfs/dbraw/zinc/54/21/56/1096542156.db2.gz KOTHHHCNWMMYNQ-BHDDXSALSA-N 2 0 365.521 4.061 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)s2)cc1 ZINC000422978984 1096545109 /nfs/dbraw/zinc/54/51/09/1096545109.db2.gz IJKIBIUOZLNIBS-AJSFGMTHSA-N 2 0 357.523 4.061 20 0 FIADRP FC(F)(F)COCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423000697 1096546800 /nfs/dbraw/zinc/54/68/00/1096546800.db2.gz HEMJRCWGXKUGTE-CEXWTWQISA-N 2 0 370.459 4.166 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]CC1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC000423008071 1096548172 /nfs/dbraw/zinc/54/81/72/1096548172.db2.gz ZGAVQXIREIBJIF-WMQCIHAUSA-N 2 0 358.570 4.138 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423005256 1096548618 /nfs/dbraw/zinc/54/86/18/1096548618.db2.gz QYFLGWOXYSHOJF-NQIIRXRSSA-N 2 0 372.896 4.084 20 0 FIADRP Cc1oc2ccccc2c1CC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423051604 1096565363 /nfs/dbraw/zinc/56/53/63/1096565363.db2.gz OTIMMDCLHKXZLA-OFNKIYASSA-N 2 0 362.473 4.129 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)ccn1 ZINC000423082030 1096567615 /nfs/dbraw/zinc/56/76/15/1096567615.db2.gz DSKPGLBXGZETAD-NZSAHSFTSA-N 2 0 355.457 4.023 20 0 FIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423092005 1096572371 /nfs/dbraw/zinc/57/23/71/1096572371.db2.gz ACUYERBTVRUBHS-ZPFMKOPRSA-N 2 0 370.443 4.056 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096962 1096573949 /nfs/dbraw/zinc/57/39/49/1096573949.db2.gz QDXAQPSXTVWVGW-YEWWUXTCSA-N 2 0 363.427 4.464 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096961 1096574258 /nfs/dbraw/zinc/57/42/58/1096574258.db2.gz QDXAQPSXTVWVGW-DDUZABMNSA-N 2 0 363.427 4.464 20 0 FIADRP CCSc1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423129442 1096580844 /nfs/dbraw/zinc/58/08/44/1096580844.db2.gz LXLUFLNCBZEPBL-CTNGQTDRSA-N 2 0 354.519 4.144 20 0 FIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106548 1096582164 /nfs/dbraw/zinc/58/21/64/1096582164.db2.gz ZZOXYBCMXJEUHV-ISFWSWAHSA-N 2 0 366.480 4.307 20 0 FIADRP CCOc1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1Cl ZINC000423107726 1096583549 /nfs/dbraw/zinc/58/35/49/1096583549.db2.gz QCGWJNXLMGLUKU-RXVVDRJESA-N 2 0 372.896 4.084 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112052 1096585741 /nfs/dbraw/zinc/58/57/41/1096585741.db2.gz XGZVPQVDHFNTRE-QFIXIFRTSA-N 2 0 354.519 4.315 20 0 FIADRP Brc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423144832 1096586959 /nfs/dbraw/zinc/58/69/59/1096586959.db2.gz ZNGMICYPQNWMJN-XFUTXVRSSA-N 2 0 363.343 4.205 20 0 FIADRP Clc1ccccc1[C@H]1C[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423150891 1096588485 /nfs/dbraw/zinc/58/84/85/1096588485.db2.gz ZMIXPDXRUKYFGB-AJYGTSELSA-N 2 0 368.908 4.432 20 0 FIADRP C[C@@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@H]1C[NH3+] ZINC000414719003 1096588552 /nfs/dbraw/zinc/58/85/52/1096588552.db2.gz XENLKYXWYFLUOU-UTKZUKDTSA-N 2 0 372.557 4.042 20 0 FIADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000423139601 1096593689 /nfs/dbraw/zinc/59/36/89/1096593689.db2.gz VTTKPOCNUMJVPX-KFKAGJAMSA-N 2 0 350.428 4.271 20 0 FIADRP c1c2ccccc2sc1CC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423140920 1096594535 /nfs/dbraw/zinc/59/45/35/1096594535.db2.gz ZSOZLXJNTJVRDP-DENIHFKCSA-N 2 0 364.514 4.289 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000503913098 1096595115 /nfs/dbraw/zinc/59/51/15/1096595115.db2.gz SSNRVKSDAMDVOU-DGDSNLKDSA-N 2 0 364.480 4.322 20 0 FIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000503932285 1096599429 /nfs/dbraw/zinc/59/94/29/1096599429.db2.gz XYOAQQKGZXVBFY-JQIJEIRASA-N 2 0 370.459 4.151 20 0 FIADRP Cc1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc12 ZINC000423169031 1096600841 /nfs/dbraw/zinc/60/08/41/1096600841.db2.gz IOXHKYVOQWBESD-UPVQGACJSA-N 2 0 358.485 4.494 20 0 FIADRP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423172910 1096603159 /nfs/dbraw/zinc/60/31/59/1096603159.db2.gz VXVHZQRNSJKUDA-XXLATIFVSA-N 2 0 372.871 4.181 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000503943641 1096605511 /nfs/dbraw/zinc/60/55/11/1096605511.db2.gz FOVNTGBBTQIPNF-UHFFFAOYSA-N 2 0 366.553 4.047 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH]1 ZINC000503951804 1096609753 /nfs/dbraw/zinc/60/97/53/1096609753.db2.gz YFSXYPDPUSRVBG-DKUWSORSSA-N 2 0 359.517 4.496 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)[C@H]1CCC[NH2+]C1 ZINC000423221828 1096621776 /nfs/dbraw/zinc/62/17/76/1096621776.db2.gz YIDQPQNIDFQYGO-ZQIUZPCESA-N 2 0 359.514 4.304 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccc(F)cc2)CC1 ZINC000423229635 1096624461 /nfs/dbraw/zinc/62/44/61/1096624461.db2.gz HLCHUUUBGHZZCA-LZBANZJXSA-N 3 0 361.549 4.238 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253304 1096630931 /nfs/dbraw/zinc/63/09/31/1096630931.db2.gz VSAWDNYXDZIKCE-XJKSGUPXSA-N 2 0 361.942 4.430 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423255550 1096631327 /nfs/dbraw/zinc/63/13/27/1096631327.db2.gz CHCJNQZOLGRYKC-WMLDXEAASA-N 2 0 359.514 4.306 20 0 FIADRP Brc1ccccc1[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000423254520 1096631418 /nfs/dbraw/zinc/63/14/18/1096631418.db2.gz YHQICKSSCPSHFQ-DNVCBOLYSA-N 2 0 359.311 4.128 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423256437 1096631535 /nfs/dbraw/zinc/63/15/35/1096631535.db2.gz DZZVBFLCSOVHKV-OXQOHEQNSA-N 2 0 360.448 4.357 20 0 FIADRP Brc1ccccc1[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000423254522 1096631923 /nfs/dbraw/zinc/63/19/23/1096631923.db2.gz YHQICKSSCPSHFQ-KXBFYZLASA-N 2 0 359.311 4.128 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423258705 1096632708 /nfs/dbraw/zinc/63/27/08/1096632708.db2.gz MMPQJPDWJSMZBN-UZUQRXQVSA-N 2 0 363.480 4.443 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](Cc2ccccc2Cl)[C@H]2CCCO2)cc1 ZINC000423291729 1096635881 /nfs/dbraw/zinc/63/58/81/1096635881.db2.gz JPZJSSNSPQEEAR-ONGXBYRLSA-N 2 0 358.913 4.240 20 0 FIADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423317045 1096642039 /nfs/dbraw/zinc/64/20/39/1096642039.db2.gz BEVFFEHEIGQPBM-LBPRGKRZSA-N 2 0 351.288 4.236 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2F)cc1 ZINC000423293997 1096643608 /nfs/dbraw/zinc/64/36/08/1096643608.db2.gz SUOYGRVBYXUYKC-RYUDHWBXSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2Br)cc1 ZINC000423295690 1096644835 /nfs/dbraw/zinc/64/48/35/1096644835.db2.gz XFJYTGSOJVKXJZ-NEPJUHHUSA-N 2 0 351.263 4.459 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423330278 1096648577 /nfs/dbraw/zinc/64/85/77/1096648577.db2.gz BSYDENMKJKQAQB-INIZCTEOSA-N 2 0 359.926 4.350 20 0 FIADRP CC1(C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]CC1 ZINC000423343672 1096651803 /nfs/dbraw/zinc/65/18/03/1096651803.db2.gz XANVJPUGKNWOEO-INIZCTEOSA-N 2 0 359.514 4.306 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2Cl)CC[NH2+]CC1 ZINC000423396580 1096665151 /nfs/dbraw/zinc/66/51/51/1096665151.db2.gz RTYGZITZVHSVAG-NSHDSACASA-N 2 0 365.732 4.314 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(Br)cc1C(F)(F)F ZINC000423403261 1096672481 /nfs/dbraw/zinc/67/24/81/1096672481.db2.gz RYOBCOCJAQGUKX-ISTVAULSSA-N 2 0 365.237 4.117 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)nc1 ZINC000423406257 1096673899 /nfs/dbraw/zinc/67/38/99/1096673899.db2.gz UMYLPTRRAHIGLJ-URZJWIJPSA-N 2 0 371.956 4.039 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000423453557 1096679134 /nfs/dbraw/zinc/67/91/34/1096679134.db2.gz AQBALJDXXAGXGT-XKQJLSEDSA-N 2 0 359.514 4.434 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccc(OC)cc2)cc1 ZINC000423471275 1096694570 /nfs/dbraw/zinc/69/45/70/1096694570.db2.gz DXWUSYAMGXWNNR-REWPJTCUSA-N 2 0 368.521 4.109 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423478690 1096696748 /nfs/dbraw/zinc/69/67/48/1096696748.db2.gz UJWNTZZVOBVZEM-QKYXUNIQSA-N 2 0 360.448 4.485 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000423482436 1096696975 /nfs/dbraw/zinc/69/69/75/1096696975.db2.gz XRMPACFEBABUFD-SQMBMXPBSA-N 2 0 367.512 4.230 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423480481 1096697784 /nfs/dbraw/zinc/69/77/84/1096697784.db2.gz NIXIPJJVEGICRN-SJLPKXTDSA-N 2 0 371.550 4.318 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)nc1 ZINC000423498125 1096699248 /nfs/dbraw/zinc/69/92/48/1096699248.db2.gz GMQLZBVSCQZKDV-BWAGFHJFSA-N 2 0 371.956 4.168 20 0 FIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cncn2)cc1Cl ZINC000423507781 1096702152 /nfs/dbraw/zinc/70/21/52/1096702152.db2.gz QKOGOLFSIAQYQT-QRWLVFNGSA-N 2 0 369.900 4.052 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423483965 1096703069 /nfs/dbraw/zinc/70/30/69/1096703069.db2.gz QLWDAXAVVUNCHH-DLBZAZTESA-N 2 0 359.514 4.448 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCC[C@H]3CCC[NH2+]3)s2)cc1 ZINC000423487398 1096704476 /nfs/dbraw/zinc/70/44/76/1096704476.db2.gz UGQFXSQPIQXQLS-PBHICJAKSA-N 2 0 359.539 4.310 20 0 FIADRP NC1(C[NH2+][C@@H]2CCCCC23CCCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000423528010 1096707503 /nfs/dbraw/zinc/70/75/03/1096707503.db2.gz NHKPYTGJHFGVFU-OAQYLSRUSA-N 2 0 355.570 4.073 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000423512699 1096710300 /nfs/dbraw/zinc/71/03/00/1096710300.db2.gz QXKNVZXHDCELGM-ZXIHIIQKSA-N 2 0 357.723 4.271 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423524511 1096713073 /nfs/dbraw/zinc/71/30/73/1096713073.db2.gz XHLPQCNRVMYRKU-PXNSSMCTSA-N 2 0 356.510 4.013 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423536469 1096715762 /nfs/dbraw/zinc/71/57/62/1096715762.db2.gz AIDUUHCDPPXTBB-BWCYYRKRSA-N 2 0 369.734 4.068 20 0 FIADRP COc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2ccccc2Cl)c1 ZINC000423542236 1096717461 /nfs/dbraw/zinc/71/74/61/1096717461.db2.gz MEUXNVLJQQEPPS-IDVKNYFZSA-N 2 0 370.924 4.416 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)C2)cc1 ZINC000423542149 1096717665 /nfs/dbraw/zinc/71/76/65/1096717665.db2.gz LRWDPOOLWAKQTB-RFXPCRSYSA-N 2 0 352.444 4.319 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc2ccccc2c1OC(F)F ZINC000423547920 1096718522 /nfs/dbraw/zinc/71/85/22/1096718522.db2.gz QNNPPVQQLGFGHR-PQEBFOHHSA-N 2 0 360.448 4.480 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423551174 1096720128 /nfs/dbraw/zinc/72/01/28/1096720128.db2.gz TZWRJORJNMJKCS-JEDBISTDSA-N 2 0 355.551 4.466 20 0 FIADRP COc1ccccc1[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1Cl ZINC000423554576 1096721386 /nfs/dbraw/zinc/72/13/86/1096721386.db2.gz WWOAWLSFXQQAEY-NRVIRDBHSA-N 2 0 370.924 4.416 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436284552 1098888167 /nfs/dbraw/zinc/88/81/67/1098888167.db2.gz BUPYWZIPMXMPAF-OZOXKJRCSA-N 2 0 356.485 4.363 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)cc1OC ZINC000436296608 1098910171 /nfs/dbraw/zinc/91/01/71/1098910171.db2.gz VFUZGRDKELLIDE-XLIONFOSSA-N 2 0 360.542 4.022 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)C1 ZINC000436304949 1098917867 /nfs/dbraw/zinc/91/78/67/1098917867.db2.gz GBSZJCBHOMIWAY-BHIFYINESA-N 2 0 356.554 4.058 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)C1 ZINC000436304952 1098918312 /nfs/dbraw/zinc/91/83/12/1098918312.db2.gz GBSZJCBHOMIWAY-FSSWDIPSSA-N 2 0 356.554 4.058 20 0 FIADRP CCCO[C@@H]1CCC[NH+](CC(C)C[N@H+]2CCC[C@@H](OCCC)CC2)CC1 ZINC000533280628 1098944402 /nfs/dbraw/zinc/94/44/02/1098944402.db2.gz LRGIUMLOLVNAOK-FGZHOGPDSA-N 2 0 368.606 4.185 20 0 FIADRP FC(F)(F)COc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533534555 1099161514 /nfs/dbraw/zinc/16/15/14/1099161514.db2.gz XKJSPPFOYHAONC-LPHOPBHVSA-N 2 0 368.443 4.076 20 0 FIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000437083789 1099589609 /nfs/dbraw/zinc/58/96/09/1099589609.db2.gz JDDREDCXJUCMKR-MANSERQUSA-N 2 0 354.460 4.464 20 0 FIADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000261638409 1099628819 /nfs/dbraw/zinc/62/88/19/1099628819.db2.gz AAIOGQSUSDHMKN-INIZCTEOSA-N 2 0 359.311 4.157 20 0 FIADRP Cc1ccc([C@H]([NH3+])C(=O)Nc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000262629019 1099725787 /nfs/dbraw/zinc/72/57/87/1099725787.db2.gz GPUSRTCGZZSDQK-UTKZUKDTSA-N 2 0 351.494 4.008 20 0 FIADRP C[C@H](CN(C)Cc1ccccc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693250 1099826206 /nfs/dbraw/zinc/82/62/06/1099826206.db2.gz CQOQVFOKGYJMOR-DPLHUUCSSA-N 2 0 365.565 4.007 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508698487 1099832041 /nfs/dbraw/zinc/83/20/41/1099832041.db2.gz OPJHTDOSPOBOBW-KNQAVFIVSA-N 2 0 352.522 4.046 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1OC(F)F ZINC000162557653 1099841830 /nfs/dbraw/zinc/84/18/30/1099841830.db2.gz NOVNXHLIXDJUPF-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000162576808 1099884891 /nfs/dbraw/zinc/88/48/91/1099884891.db2.gz YRQDOISNLLZIHK-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713938 1099886055 /nfs/dbraw/zinc/88/60/55/1099886055.db2.gz AQHMRHPIGYHDDE-YLJYHZDGSA-N 2 0 374.475 4.331 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508709952 1099899520 /nfs/dbraw/zinc/89/95/20/1099899520.db2.gz KMABGVMTWSFDSH-KNQAVFIVSA-N 2 0 351.538 4.379 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(OC)cc1 ZINC000516882462 1099906917 /nfs/dbraw/zinc/90/69/17/1099906917.db2.gz BJTCJZVUFXOGAO-HSZRJFAPSA-N 2 0 368.521 4.409 20 0 FIADRP COCCSc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459401215 1100109052 /nfs/dbraw/zinc/10/90/52/1100109052.db2.gz CYLQEZPDSAAVKD-QGZVFWFLSA-N 2 0 371.550 4.140 20 0 FIADRP CC(C)(C)OCc1cccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459404287 1100110874 /nfs/dbraw/zinc/11/08/74/1100110874.db2.gz RVLWZJBRRNUADM-UHFFFAOYSA-N 2 0 353.510 4.155 20 0 FIADRP COc1ccccc1SC[C@@H](C)C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459402245 1100111072 /nfs/dbraw/zinc/11/10/72/1100111072.db2.gz FSTVUHVHANIWOL-KRWDZBQOSA-N 2 0 371.550 4.077 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(N3CCCC3)nc2)CC1 ZINC000536664485 1100135743 /nfs/dbraw/zinc/13/57/43/1100135743.db2.gz FJIIBEWNFLEUIP-FQEVSTJZSA-N 2 0 370.585 4.158 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000536675589 1100163609 /nfs/dbraw/zinc/16/36/09/1100163609.db2.gz YWYMHWSKRINHIP-UHFFFAOYSA-N 2 0 362.514 4.097 20 0 FIADRP Clc1ccc2c(c1Cl)OC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459431636 1100168546 /nfs/dbraw/zinc/16/85/46/1100168546.db2.gz SBBDRDYZZLIHJM-MRXNPFEDSA-N 2 0 364.276 4.081 20 0 FIADRP C[N@H+](CCCOc1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536713039 1100213641 /nfs/dbraw/zinc/21/36/41/1100213641.db2.gz CZFVRJMSLVLAER-UHFFFAOYSA-N 2 0 353.510 4.089 20 0 FIADRP CCN1CCC[C@@H](C[N@H+](C)CCc2cccc(Cl)c2)[C@@H]1c1cnn(C)c1 ZINC000459487231 1100221457 /nfs/dbraw/zinc/22/14/57/1100221457.db2.gz LTYLZJGIOUXKAJ-GHTZIAJQSA-N 2 0 374.960 4.021 20 0 FIADRP CC[N@@H+](Cc1cccc(COC)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536708663 1100226482 /nfs/dbraw/zinc/22/64/82/1100226482.db2.gz LZGMJIAPVFEFMJ-QHCPKHFHSA-N 2 0 352.522 4.177 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000379628433 1100245051 /nfs/dbraw/zinc/24/50/51/1100245051.db2.gz JAOGPJPPFIUSTM-LVCYWYKZSA-N 2 0 366.505 4.162 20 0 FIADRP Brc1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)s1 ZINC000666856631 1100268236 /nfs/dbraw/zinc/26/82/36/1100268236.db2.gz VKUZKNCEZSIBIC-CYBMUJFWSA-N 2 0 365.340 4.409 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666856644 1100268987 /nfs/dbraw/zinc/26/89/87/1100268987.db2.gz VVZYOCWUDLXTSA-HXUWFJFHSA-N 2 0 360.505 4.079 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000425944711 1100403151 /nfs/dbraw/zinc/40/31/51/1100403151.db2.gz YEAVJDFEWCJOPC-MRXNPFEDSA-N 2 0 356.485 4.494 20 0 FIADRP CC(C)Oc1c(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)ccc(F)c1F ZINC001280194813 1100408948 /nfs/dbraw/zinc/40/89/48/1100408948.db2.gz AAAOGEBXUBBDCM-UHFFFAOYSA-N 2 0 352.469 4.060 20 0 FIADRP C[C@@]1(c2ccccc2)CC[C@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000438116807 1100443320 /nfs/dbraw/zinc/44/33/20/1100443320.db2.gz KCRUERIFKQSUOZ-JTHBVZDNSA-N 2 0 356.554 4.074 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000517537323 1100475521 /nfs/dbraw/zinc/47/55/21/1100475521.db2.gz QEQXMSGDSJPLAX-UHFFFAOYSA-N 2 0 369.347 4.059 20 0 FIADRP Cc1c(F)cccc1NC(=O)CC[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000517557168 1100482415 /nfs/dbraw/zinc/48/24/15/1100482415.db2.gz ZSKXHAIZMBTEFI-UHFFFAOYSA-N 2 0 371.500 4.093 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426035769 1100694771 /nfs/dbraw/zinc/69/47/71/1100694771.db2.gz KOVVVBCVJJOWFP-NRFANRHFSA-N 2 0 357.929 4.340 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC[NH2+]1 ZINC000414946498 1100902739 /nfs/dbraw/zinc/90/27/39/1100902739.db2.gz JSJLFUFZGSNCSF-HOCLYGCPSA-N 2 0 360.933 4.189 20 0 FIADRP Cc1cnn(-c2cc[nH+]cc2N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000518236809 1101036013 /nfs/dbraw/zinc/03/60/13/1101036013.db2.gz ZSYDPMBQPJPBAP-QUCCMNQESA-N 2 0 361.493 4.041 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000518267988 1101051882 /nfs/dbraw/zinc/05/18/82/1101051882.db2.gz YWCNUUXMEPKTRK-MRXNPFEDSA-N 2 0 368.949 4.349 20 0 FIADRP CC(C)COc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000518277620 1101061521 /nfs/dbraw/zinc/06/15/21/1101061521.db2.gz ZATHUHSRXURPDK-QHCPKHFHSA-N 2 0 366.549 4.376 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOCCc2ccccc2)C1 ZINC000506474788 1101110695 /nfs/dbraw/zinc/11/06/95/1101110695.db2.gz PPFKYGICIASALG-GGAORHGYSA-N 2 0 358.570 4.222 20 0 FIADRP C[C@H]([NH3+])c1ccc(NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)cc1 ZINC000414981978 1101153996 /nfs/dbraw/zinc/15/39/96/1101153996.db2.gz YLIDTWCLYWUANU-KRWDZBQOSA-N 2 0 366.509 4.379 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138719 1101194755 /nfs/dbraw/zinc/19/47/55/1101194755.db2.gz DQSULFJRVABSLN-HNNXBMFYSA-N 2 0 357.361 4.283 20 0 FIADRP [NH3+]CCc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccc(Cl)cc12 ZINC001167964210 1101261928 /nfs/dbraw/zinc/26/19/28/1101261928.db2.gz NUAIIMFFBOFDIX-DFNIBXOVSA-N 2 0 357.929 4.374 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc(F)cc1 ZINC000414991365 1101291119 /nfs/dbraw/zinc/29/11/19/1101291119.db2.gz BBOYVOCWRISYLV-PXNSSMCTSA-N 2 0 372.484 4.020 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)ccc1OCc1cccs1 ZINC000459734883 1101351130 /nfs/dbraw/zinc/35/11/30/1101351130.db2.gz OSYXXMTZBUTOKE-QGZVFWFLSA-N 2 0 374.550 4.157 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)cc1OC ZINC000537059343 1101415668 /nfs/dbraw/zinc/41/56/68/1101415668.db2.gz CRNUIPVQJPFNGY-OAQYLSRUSA-N 2 0 368.521 4.063 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@H](C)[C@@H](C)C2)cc1)c1cncs1 ZINC000537093170 1101460850 /nfs/dbraw/zinc/46/08/50/1101460850.db2.gz AANNPMVQVYOPRD-BZSNNMDCSA-N 2 0 373.566 4.003 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000414999511 1101483620 /nfs/dbraw/zinc/48/36/20/1101483620.db2.gz JEIVHIOUXMTUSS-IUODEOHRSA-N 2 0 369.456 4.436 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190271 1101524628 /nfs/dbraw/zinc/52/46/28/1101524628.db2.gz YVYNWLTWZUIEAF-FRGLQRNOSA-N 2 0 362.517 4.498 20 0 FIADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190013 1101542460 /nfs/dbraw/zinc/54/24/60/1101542460.db2.gz OBZABMVZXSLYRQ-VCOUNFBDSA-N 2 0 372.553 4.015 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000537344632 1101679140 /nfs/dbraw/zinc/67/91/40/1101679140.db2.gz GJNDHQQTFXOWCS-UHFFFAOYSA-N 2 0 372.516 4.199 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000537355707 1101690990 /nfs/dbraw/zinc/69/09/90/1101690990.db2.gz AXWRGEDXWCASDF-DYXWJJEUSA-N 2 0 352.522 4.130 20 0 FIADRP Brc1cccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CCC2)c1 ZINC000537422492 1101773921 /nfs/dbraw/zinc/77/39/21/1101773921.db2.gz KTFPIGMYAAEKKZ-UHFFFAOYSA-N 2 0 363.343 4.292 20 0 FIADRP Cc1csc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)n1 ZINC000237639026 1101778937 /nfs/dbraw/zinc/77/89/37/1101778937.db2.gz PMXOWHVQGPIBNW-UHFFFAOYSA-N 2 0 357.567 4.276 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccc(F)cc2)CC1 ZINC001168169609 1101871429 /nfs/dbraw/zinc/87/14/29/1101871429.db2.gz ZMTQQAAEIZNVPR-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP CO[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC001168170301 1101889365 /nfs/dbraw/zinc/88/93/65/1101889365.db2.gz JHKVAUHEZZTYSH-VOQZNFBZSA-N 2 0 372.940 4.150 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001168183352 1102088082 /nfs/dbraw/zinc/08/80/82/1102088082.db2.gz PRBVIPKZWMSDIA-APWZRJJASA-N 2 0 364.961 4.283 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+]C2CCC(C(F)(F)F)CC2)cc1 ZINC000415014341 1102260809 /nfs/dbraw/zinc/26/08/09/1102260809.db2.gz ZINLSIXHJJIAQL-RYKRPPSOSA-N 2 0 358.423 4.230 20 0 FIADRP Clc1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1Br ZINC001204742427 1102296464 /nfs/dbraw/zinc/29/64/64/1102296464.db2.gz NWYNKYBUDVUPPB-UHFFFAOYSA-N 2 0 357.723 4.068 20 0 FIADRP CC(C)CC[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000532449817 1102347220 /nfs/dbraw/zinc/34/72/20/1102347220.db2.gz LTONJEGAJAVFEL-OAQYLSRUSA-N 2 0 365.993 4.435 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(CO)c1 ZINC000121224647 1102348821 /nfs/dbraw/zinc/34/88/21/1102348821.db2.gz GYZATURYCFVEKU-MOPGFXCFSA-N 2 0 352.522 4.262 20 0 FIADRP C[N@H+](CC(c1ccc(F)cc1)c1ccc(F)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000262030953 1102377768 /nfs/dbraw/zinc/37/77/68/1102377768.db2.gz XEOCRBWSMWPTQK-WCRBZPEASA-N 2 0 356.460 4.312 20 0 FIADRP C[C@@H]([NH2+]CC(C)(C)c1ccccc1Br)C1CC[NH+](C)CC1 ZINC000678602738 1102421757 /nfs/dbraw/zinc/42/17/57/1102421757.db2.gz FZHLUPOVDGIKNJ-CQSZACIVSA-N 2 0 353.348 4.047 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4Cl)cc2)CC1 ZINC000532485183 1102426045 /nfs/dbraw/zinc/42/60/45/1102426045.db2.gz KYOTXFVYVYDJFV-JOCHJYFZSA-N 2 0 370.924 4.074 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1 ZINC000121643078 1102430142 /nfs/dbraw/zinc/43/01/42/1102430142.db2.gz ZDAVCHXGRZNWBE-SFHVURJKSA-N 2 0 374.573 4.333 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000532524396 1102442915 /nfs/dbraw/zinc/44/29/15/1102442915.db2.gz FSFSHFVWLILMJS-RKVPGOIHSA-N 2 0 354.460 4.445 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000121750848 1102450019 /nfs/dbraw/zinc/45/00/19/1102450019.db2.gz BZPGQBQWGKCTKR-OAHLLOKOSA-N 2 0 358.555 4.286 20 0 FIADRP CC1CCC([N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@H]3COCC3CC3)C2)CC1 ZINC001168211350 1102473135 /nfs/dbraw/zinc/47/31/35/1102473135.db2.gz CUCGQOUXJHGXAA-LWZIIBGRSA-N 2 0 360.586 4.026 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000121907133 1102482858 /nfs/dbraw/zinc/48/28/58/1102482858.db2.gz RUFVWCVFWIMFPT-QFIPXVFZSA-N 2 0 373.585 4.031 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000550881723 1102652926 /nfs/dbraw/zinc/65/29/26/1102652926.db2.gz BFOHWTZCDGSBII-WBMJQRKESA-N 2 0 373.766 4.310 20 0 FIADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550886444 1102658297 /nfs/dbraw/zinc/65/82/97/1102658297.db2.gz PDTVVMMAYCVIDK-XPWALMASSA-N 2 0 370.581 4.330 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)ccn1 ZINC000550886011 1102658583 /nfs/dbraw/zinc/65/85/83/1102658583.db2.gz AWFJFXYFTZUTET-ROUUACIJSA-N 2 0 353.510 4.315 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000551002148 1102771273 /nfs/dbraw/zinc/77/12/73/1102771273.db2.gz RRHNVSDIFBVLQS-HNNXBMFYSA-N 2 0 360.448 4.289 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000551002149 1102771722 /nfs/dbraw/zinc/77/17/22/1102771722.db2.gz RRHNVSDIFBVLQS-OAHLLOKOSA-N 2 0 360.448 4.289 20 0 FIADRP CC[N@@H+](Cc1ccc(-n2cccn2)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660320 1102784489 /nfs/dbraw/zinc/78/44/89/1102784489.db2.gz CNCSFDFPLCPDBX-HSZRJFAPSA-N 2 0 374.532 4.216 20 0 FIADRP C[C@H](CCN[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000551034749 1102823445 /nfs/dbraw/zinc/82/34/45/1102823445.db2.gz ONDWSQHSIROEJV-AGILITTLSA-N 2 0 365.565 4.322 20 0 FIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000459358597 1102912393 /nfs/dbraw/zinc/91/23/93/1102912393.db2.gz BKTSKKLISONWFQ-SNXGKTBFSA-N 2 0 362.517 4.353 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2cccc(C)c2)CC1 ZINC000506862066 1102924609 /nfs/dbraw/zinc/92/46/09/1102924609.db2.gz OGSAXKSTHYOKRH-UHFFFAOYSA-N 2 0 354.542 4.329 20 0 FIADRP Cc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)cc(C)c1OCc1ccccn1 ZINC000506878616 1102925619 /nfs/dbraw/zinc/92/56/19/1102925619.db2.gz ZZQKMXAFSMZBEY-UHFFFAOYSA-N 2 0 367.537 4.051 20 0 FIADRP CC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000459372196 1102999236 /nfs/dbraw/zinc/99/92/36/1102999236.db2.gz UGPRDCGTYBXEES-GOSISDBHSA-N 2 0 361.436 4.393 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CC[C@H]3C3CCC3)C3(C2)CCOCC3)cc1 ZINC000551265619 1103023793 /nfs/dbraw/zinc/02/37/93/1103023793.db2.gz WZSJKWBFFVXCFF-VABKMULXSA-N 2 0 368.565 4.084 20 0 FIADRP Cc1cc(C)c(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000551269367 1103031566 /nfs/dbraw/zinc/03/15/66/1103031566.db2.gz NTYVRPKBQUWKCP-UHFFFAOYSA-N 2 0 352.522 4.375 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCN1CCc3ccccc3C1)CCS2 ZINC000467407199 1103038720 /nfs/dbraw/zinc/03/87/20/1103038720.db2.gz MSCJPEYANHCYIN-NRFANRHFSA-N 2 0 368.546 4.270 20 0 FIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[C@@H](O)Cc1ccccc1 ZINC000551316880 1103072680 /nfs/dbraw/zinc/07/26/80/1103072680.db2.gz NVQNQYWHZUNPAX-LTKAXEJJSA-N 2 0 366.549 4.011 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)ccc1OCc1ccccc1 ZINC000666996724 1103356230 /nfs/dbraw/zinc/35/62/30/1103356230.db2.gz BLATZTCWTPUFAY-HXUWFJFHSA-N 2 0 366.505 4.039 20 0 FIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000507464020 1103410370 /nfs/dbraw/zinc/41/03/70/1103410370.db2.gz WAZISVKBHFEFDX-CEXWTWQISA-N 2 0 367.537 4.104 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)[C@H]1CCCOC1 ZINC000507489106 1103437311 /nfs/dbraw/zinc/43/73/11/1103437311.db2.gz WENFUIDYFDDMHJ-REWPJTCUSA-N 2 0 358.570 4.126 20 0 FIADRP COc1ccc(C2([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)CC2)cc1 ZINC000507519400 1103443501 /nfs/dbraw/zinc/44/35/01/1103443501.db2.gz IEXYWXKDJFBEKV-WTIAFYNJSA-N 2 0 362.517 4.185 20 0 FIADRP Clc1cc(Cl)c(OCC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000246829225 1103714458 /nfs/dbraw/zinc/71/44/58/1103714458.db2.gz QEFOKVMJPRCDIC-STQMWFEESA-N 2 0 363.716 4.242 20 0 FIADRP Oc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000312010631 1103831866 /nfs/dbraw/zinc/83/18/66/1103831866.db2.gz RSYITHVEBYTHCC-AUSIDOKSSA-N 2 0 350.506 4.271 20 0 FIADRP COC(=O)c1coc([C@H](C)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000519787707 1103870988 /nfs/dbraw/zinc/87/09/88/1103870988.db2.gz CXVQTGGHIQGYMU-HKUYNNGSSA-N 2 0 370.493 4.019 20 0 FIADRP C[N@H+](Cc1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167992673 1104411984 /nfs/dbraw/zinc/41/19/84/1104411984.db2.gz JKMVSRFJZSHFMO-DFNIBXOVSA-N 2 0 363.343 4.286 20 0 FIADRP CSCc1cccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000188725032 1104752065 /nfs/dbraw/zinc/75/20/65/1104752065.db2.gz PYJGVHFBBFDIBJ-KRWDZBQOSA-N 2 0 358.551 4.341 20 0 FIADRP CC[NH+]1CCC(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)CC1 ZINC001168004361 1105031764 /nfs/dbraw/zinc/03/17/64/1105031764.db2.gz UWMJDGZJBADQQS-VSGJHWFKSA-N 3 0 373.629 4.226 20 0 FIADRP C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1OCc1ccccc1 ZINC000152404418 1105086813 /nfs/dbraw/zinc/08/68/13/1105086813.db2.gz VEFFDCGSLILGOV-UYAOXDASSA-N 2 0 350.506 4.401 20 0 FIADRP C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1OCc1ccccc1 ZINC000152404312 1105087382 /nfs/dbraw/zinc/08/73/82/1105087382.db2.gz VEFFDCGSLILGOV-AZUAARDMSA-N 2 0 350.506 4.401 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152406698 1105087899 /nfs/dbraw/zinc/08/78/99/1105087899.db2.gz AIKTVXSDKUICLE-ZWKOTPCHSA-N 2 0 350.506 4.497 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)Cc1cccc(Br)c1 ZINC000247133789 1105091146 /nfs/dbraw/zinc/09/11/46/1105091146.db2.gz XAEDLBHPNVTFNA-SNRMKQJTSA-N 2 0 365.359 4.234 20 0 FIADRP COc1ccc2nc(C[NH2+]C3CCC([NH+]4CCC(C)CC4)CC3)sc2c1 ZINC000474006511 1105128943 /nfs/dbraw/zinc/12/89/43/1105128943.db2.gz OSTYLJNKUURNDQ-UHFFFAOYSA-N 2 0 373.566 4.438 20 0 FIADRP CC[C@@H]1C[C@H](C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCO1 ZINC000507809874 1105175714 /nfs/dbraw/zinc/17/57/14/1105175714.db2.gz FQEQHJPFZFDARW-SSGKUCQKSA-N 2 0 356.554 4.178 20 0 FIADRP CCSc1cc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)ccn1 ZINC000427868047 1105303695 /nfs/dbraw/zinc/30/36/95/1105303695.db2.gz VUAFITZFRVBWOS-PCCBWWKXSA-N 2 0 367.562 4.194 20 0 FIADRP C[C@]1(C[NH2+]C2CCC3(CCOCC3)CC2)CCCN1Cc1ccccc1 ZINC000427895298 1105312150 /nfs/dbraw/zinc/31/21/50/1105312150.db2.gz SLSGQVDSSMZHKL-JOCHJYFZSA-N 2 0 356.554 4.370 20 0 FIADRP CC[C@@H](Cc1ccccc1)[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000475351401 1106742220 /nfs/dbraw/zinc/74/22/20/1106742220.db2.gz GLOIRXVKPBIPSL-VIQWUECVSA-N 2 0 354.460 4.403 20 0 FIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530220508 1106915191 /nfs/dbraw/zinc/91/51/91/1106915191.db2.gz NOOIICFUAVILAO-SBHAEUEKSA-N 2 0 354.881 4.173 20 0 FIADRP C[C@H]([NH2+]CCc1ccccc1OC(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530513406 1107105395 /nfs/dbraw/zinc/10/53/95/1107105395.db2.gz WAZSFDIVKLHGFQ-PXNSSMCTSA-N 2 0 374.475 4.331 20 0 FIADRP Cc1[nH+]c2ccccc2c(NCc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1C ZINC000302164396 1107324090 /nfs/dbraw/zinc/32/40/90/1107324090.db2.gz OOVKHIGIIWHRPE-HXUWFJFHSA-N 2 0 361.489 4.030 20 0 FIADRP CC[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CCCc3ccc(F)cc32)CC1 ZINC000475485009 1107512836 /nfs/dbraw/zinc/51/28/36/1107512836.db2.gz FXBLGKXGZFPYPH-QFIPXVFZSA-N 2 0 367.512 4.135 20 0 FIADRP [NH3+]CC1CC[NH+](Cc2ccc(N[C@@H]3C[C@H]3c3ccc(F)c(F)c3)cc2)CC1 ZINC001168069786 1107667669 /nfs/dbraw/zinc/66/76/69/1107667669.db2.gz IUPIZCIYFJWQLJ-SIKLNZKXSA-N 2 0 371.475 4.104 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000152455142 1107719257 /nfs/dbraw/zinc/71/92/57/1107719257.db2.gz RVWISXDVBIFTQH-GDBMZVCRSA-N 2 0 371.550 4.262 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000475577522 1107787978 /nfs/dbraw/zinc/78/79/78/1107787978.db2.gz ZBEIYJCPGCQEJR-FXAWDEMLSA-N 2 0 350.441 4.141 20 0 FIADRP CCc1nc(C)c(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)o1 ZINC000428366706 1107898788 /nfs/dbraw/zinc/89/87/88/1107898788.db2.gz YWLBLOUMVNMRIY-VQTJNVASSA-N 2 0 353.510 4.032 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccsc2)cc1 ZINC000444658088 1108052472 /nfs/dbraw/zinc/05/24/72/1108052472.db2.gz AFYCSLINWWBDRQ-NJDAHSKKSA-N 2 0 356.535 4.099 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2cccnc21)c1cccc(OCC[NH+](C)C)c1 ZINC000531687403 1108054335 /nfs/dbraw/zinc/05/43/35/1108054335.db2.gz SRRBHMLLLIKZEQ-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP Cn1nccc1-c1ccccc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508504548 1108066463 /nfs/dbraw/zinc/06/64/63/1108066463.db2.gz NASUXRGCXLCIAG-NRFANRHFSA-N 2 0 374.532 4.041 20 0 FIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000531705510 1108084442 /nfs/dbraw/zinc/08/44/42/1108084442.db2.gz CZEWRWWHWABVMI-OPAMFIHVSA-N 2 0 356.485 4.179 20 0 FIADRP CC(C[NH+]1CC[C@@H](CC(F)(F)F)C1)C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444714762 1108087227 /nfs/dbraw/zinc/08/72/27/1108087227.db2.gz KSZILCIPCHAYBN-KBPBESRZSA-N 2 0 360.386 4.171 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1C ZINC000531710491 1108088671 /nfs/dbraw/zinc/08/86/71/1108088671.db2.gz SHZNBABAHPUCFR-URXFXBBRSA-N 2 0 365.565 4.251 20 0 FIADRP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531725758 1108098799 /nfs/dbraw/zinc/09/87/99/1108098799.db2.gz BVGTZUNCEDYKDZ-ZWKOTPCHSA-N 2 0 365.521 4.133 20 0 FIADRP CCC1(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000453186673 1108255568 /nfs/dbraw/zinc/25/55/68/1108255568.db2.gz WZMBFWNAUUPWLN-AZUAARDMSA-N 2 0 352.526 4.171 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453194819 1108263800 /nfs/dbraw/zinc/26/38/00/1108263800.db2.gz IGLUSVHWENVHJE-ZRCGQRJVSA-N 2 0 351.538 4.293 20 0 FIADRP C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncn1 ZINC000453231308 1108304237 /nfs/dbraw/zinc/30/42/37/1108304237.db2.gz XTVHCCYALQEPPH-MXPIYFSTSA-N 2 0 370.928 4.395 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453270582 1108345428 /nfs/dbraw/zinc/34/54/28/1108345428.db2.gz OKCRATLMOPVHSR-LLGFUMIMSA-N 2 0 354.494 4.190 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC(C)(C)CO)c2ccc(F)cc2)CC1 ZINC000453285331 1108361642 /nfs/dbraw/zinc/36/16/42/1108361642.db2.gz XIZSIALZDSYKIX-OAQYLSRUSA-N 2 0 364.549 4.377 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CCOC4(CCC4)C3)[C@H]3CCC[C@H]32)cc1 ZINC000453331657 1108387336 /nfs/dbraw/zinc/38/73/36/1108387336.db2.gz ZQCFLUHLEUHZHB-BXXSPATCSA-N 2 0 368.565 4.369 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000531939570 1108415765 /nfs/dbraw/zinc/41/57/65/1108415765.db2.gz KVRHFABHVYHCPQ-HXUWFJFHSA-N 2 0 357.586 4.413 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC2(CO)CC2)c2ccc(F)cc2)CC1 ZINC000453334799 1108428422 /nfs/dbraw/zinc/42/84/22/1108428422.db2.gz IHQMWKXLOPWLRE-OAQYLSRUSA-N 2 0 362.533 4.131 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@@H](c3ccco3)[NH+]3CCCCC3)CC2)C1 ZINC000531947994 1108430639 /nfs/dbraw/zinc/43/06/39/1108430639.db2.gz DCAJTNNZECYQNC-HJNYFJLDSA-N 2 0 373.585 4.439 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531957887 1108447775 /nfs/dbraw/zinc/44/77/75/1108447775.db2.gz JMSKWYJDCNFTFG-PGRDOPGGSA-N 2 0 369.578 4.048 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@]4(CCSC4)C2)C3)cc1 ZINC000453353450 1108453020 /nfs/dbraw/zinc/45/30/20/1108453020.db2.gz JEPVYILWXPZJAY-CBPXPLCBSA-N 2 0 356.579 4.401 20 0 FIADRP C[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc2ccccc2c1 ZINC000531965310 1108461562 /nfs/dbraw/zinc/46/15/62/1108461562.db2.gz VJJRDJMNDNEXRZ-CPJSRVTESA-N 2 0 373.544 4.479 20 0 FIADRP CC[C@@H](C[NH2+]C1CC[NH+](C(C)C)CC1)Cc1cccc(Br)c1 ZINC000531969148 1108477858 /nfs/dbraw/zinc/47/78/58/1108477858.db2.gz JAMDAUIPIOXOEB-MRXNPFEDSA-N 2 0 367.375 4.480 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531973154 1108484888 /nfs/dbraw/zinc/48/48/88/1108484888.db2.gz WYEDFUKCTBSEMP-LJQANCHMSA-N 2 0 354.542 4.488 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)Oc1cccc(C(F)(F)F)c1 ZINC000531979223 1108495614 /nfs/dbraw/zinc/49/56/14/1108495614.db2.gz ZBQHZYLMKRBCMN-KJGCVMFHSA-N 2 0 358.448 4.181 20 0 FIADRP c1ccc2c(c1)CCSC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532200117 1108704857 /nfs/dbraw/zinc/70/48/57/1108704857.db2.gz QOHHIRVQQXKALK-JOCHJYFZSA-N 2 0 352.547 4.403 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000532227436 1108723737 /nfs/dbraw/zinc/72/37/37/1108723737.db2.gz NTAZOQYEWXNMSL-XMSQKQJNSA-N 2 0 356.485 4.050 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000532227435 1108723979 /nfs/dbraw/zinc/72/39/79/1108723979.db2.gz NTAZOQYEWXNMSL-PGRDOPGGSA-N 2 0 356.485 4.050 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(C(=O)NCC(C)C)c2)CC1 ZINC000524177137 1108885817 /nfs/dbraw/zinc/88/58/17/1108885817.db2.gz RIALHPQMSDKWFR-UHFFFAOYSA-N 2 0 373.585 4.016 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(CC[NH+](C)C)cc2)cc1 ZINC000524406882 1108993360 /nfs/dbraw/zinc/99/33/60/1108993360.db2.gz AVPURLAEJOWYCT-UHFFFAOYSA-N 2 0 367.537 4.275 20 0 FIADRP Clc1cccc(Cl)c1CC[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459457376 1109042655 /nfs/dbraw/zinc/04/26/55/1109042655.db2.gz CDPWPJHPYONZPO-UHFFFAOYSA-N 2 0 350.293 4.190 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000524812103 1109161905 /nfs/dbraw/zinc/16/19/05/1109161905.db2.gz OMWYUTXFAYSGLR-KDURUIRLSA-N 2 0 352.522 4.161 20 0 FIADRP C[C@@H](C[NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000446886311 1109382706 /nfs/dbraw/zinc/38/27/06/1109382706.db2.gz YMTGDPIPRWQWRF-AWEZNQCLSA-N 2 0 351.332 4.017 20 0 FIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000446933894 1109394111 /nfs/dbraw/zinc/39/41/11/1109394111.db2.gz QIJMYVLRVSNDCJ-QHCPKHFHSA-N 2 0 367.537 4.129 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)C2CCCC2)cc1 ZINC000446935835 1109394556 /nfs/dbraw/zinc/39/45/56/1109394556.db2.gz IDIFMYFMXKPRML-YTFSRNRJSA-N 2 0 356.554 4.194 20 0 FIADRP C[N@H+](CC/C=C\c1ccc(Br)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000525518128 1109410184 /nfs/dbraw/zinc/41/01/84/1109410184.db2.gz YSCXEGCPAHMOLH-SVEBXFOSSA-N 2 0 351.332 4.126 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@@H](C)c3cccc4ccccc43)C2)CC1 ZINC000525779469 1109515920 /nfs/dbraw/zinc/51/59/20/1109515920.db2.gz RRDRXWIPBGAYKG-FPOVZHCZSA-N 2 0 351.538 4.001 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447563480 1109583015 /nfs/dbraw/zinc/58/30/15/1109583015.db2.gz QAAAYCKXEVCNRD-NEWJYFPISA-N 2 0 364.533 4.029 20 0 FIADRP Clc1ccc([C@H](Cc2cccnc2)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447565838 1109584168 /nfs/dbraw/zinc/58/41/68/1109584168.db2.gz OCFNLJBHOHIYDI-QFIPXVFZSA-N 2 0 369.940 4.483 20 0 FIADRP c1c2ccccc2oc1[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccnc1 ZINC000447580272 1109594807 /nfs/dbraw/zinc/59/48/07/1109594807.db2.gz PZNZYFRZZSHQHQ-HSZRJFAPSA-N 2 0 361.489 4.381 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527640615 1109792118 /nfs/dbraw/zinc/79/21/18/1109792118.db2.gz NFRMZBWEYVBEBW-GOTSBHOMSA-N 2 0 357.586 4.110 20 0 FIADRP C[NH+](C)C[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000528009102 1109884669 /nfs/dbraw/zinc/88/46/69/1109884669.db2.gz NPMPQSSKCCHYDQ-LJQANCHMSA-N 2 0 370.368 4.060 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccnc2C)cc1C[NH+]1CCCCC1 ZINC000527984863 1109886705 /nfs/dbraw/zinc/88/67/05/1109886705.db2.gz DUALDDPXSCVGDV-QGZVFWFLSA-N 2 0 353.510 4.235 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cccc4ccoc43)CC2)CC1 ZINC000449035194 1109961475 /nfs/dbraw/zinc/96/14/75/1109961475.db2.gz GEQLREKYXNBFDX-UHFFFAOYSA-N 2 0 369.553 4.061 20 0 FIADRP C[C@@H](CC(C)(C)C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000449119068 1109979929 /nfs/dbraw/zinc/97/99/29/1109979929.db2.gz WBVCLQLISODLPX-SFHVURJKSA-N 2 0 362.558 4.091 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449112721 1109983375 /nfs/dbraw/zinc/98/33/75/1109983375.db2.gz SEHUMUPMDPXEIK-PXNSSMCTSA-N 2 0 350.934 4.067 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3c(OC)cccc23)[C@H](C)C1 ZINC000449137084 1109983943 /nfs/dbraw/zinc/98/39/43/1109983943.db2.gz DJJXNOLKXCRUQB-XMSQKQJNSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC[C@H]2n2cccn2)CC1 ZINC000449188605 1109995157 /nfs/dbraw/zinc/99/51/57/1109995157.db2.gz SMYCPGZMJPIHBH-WTIAFYNJSA-N 2 0 366.553 4.052 20 0 FIADRP COc1cccc2c(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)cccc12 ZINC000449205238 1109995495 /nfs/dbraw/zinc/99/54/95/1109995495.db2.gz NQHPWXYDSYRHMQ-UHFFFAOYSA-N 2 0 352.453 4.339 20 0 FIADRP CCc1cnccc1[C@@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449207915 1109995901 /nfs/dbraw/zinc/99/59/01/1109995901.db2.gz RQUBWMITDRJQIU-RBUKOAKNSA-N 2 0 351.538 4.390 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000449202766 1109998201 /nfs/dbraw/zinc/99/82/01/1109998201.db2.gz GMVTXKSMLVBYFG-BVYCBKJFSA-N 2 0 358.570 4.265 20 0 FIADRP CO[C@H](CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C(F)(F)F ZINC000449270384 1110012375 /nfs/dbraw/zinc/01/23/75/1110012375.db2.gz QLYGSNKQMIVBJS-OAHLLOKOSA-N 2 0 352.485 4.223 20 0 FIADRP C[N@H+](Cc1ccnc2c(Br)cccc12)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000449318713 1110031947 /nfs/dbraw/zinc/03/19/47/1110031947.db2.gz DQCZLYIGHMRCAT-XYPWUTKMSA-N 2 0 374.326 4.054 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C2CC2)cn1 ZINC000528854470 1110136096 /nfs/dbraw/zinc/13/60/96/1110136096.db2.gz VNLIRYXNRQPCIW-HSZRJFAPSA-N 2 0 365.521 4.317 20 0 FIADRP CCOc1ccc(C[N@H+](CCCn2ccnc2)Cc2cccc(C)n2)cc1 ZINC000450650723 1110324502 /nfs/dbraw/zinc/32/45/02/1110324502.db2.gz NYIULMYFXVLIEJ-UHFFFAOYSA-N 2 0 364.493 4.078 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000538446016 1111144000 /nfs/dbraw/zinc/14/40/00/1111144000.db2.gz NARAAJOZHDGWJS-UHFFFAOYSA-N 2 0 372.944 4.310 20 0 FIADRP c1c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)[nH]nc1-c1ccccc1 ZINC000538750840 1111281312 /nfs/dbraw/zinc/28/13/12/1111281312.db2.gz BLNAJACPSBFTGE-UHFFFAOYSA-N 2 0 352.526 4.165 20 0 FIADRP Fc1ccccc1CC(Cc1ccccc1F)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000461798065 1111359706 /nfs/dbraw/zinc/35/97/06/1111359706.db2.gz SZRQNIHBGAKDCO-KRWDZBQOSA-N 2 0 370.487 4.193 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(NC(=O)N(CC)CC)cc2)CC1 ZINC000461798391 1111361000 /nfs/dbraw/zinc/36/10/00/1111361000.db2.gz UCWCIERGHDGTOG-KRWDZBQOSA-N 2 0 360.546 4.085 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000539041300 1111395295 /nfs/dbraw/zinc/39/52/95/1111395295.db2.gz IUGRGKUDOIYXML-QGZVFWFLSA-N 2 0 371.525 4.050 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539057032 1111403845 /nfs/dbraw/zinc/40/38/45/1111403845.db2.gz KXLUIIKCAMJVKA-OFAXGOBFSA-N 2 0 358.570 4.304 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2ccccc12 ZINC000539072431 1111419311 /nfs/dbraw/zinc/41/93/11/1111419311.db2.gz RMCHPOUSTDYFHY-OTWHNJEPSA-N 2 0 370.537 4.388 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000539075835 1111420958 /nfs/dbraw/zinc/42/09/58/1111420958.db2.gz MPEIJHVRAPDZOP-WMZHIEFXSA-N 2 0 354.538 4.109 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000539161041 1111454904 /nfs/dbraw/zinc/45/49/04/1111454904.db2.gz RXFJDDTWRMWCGC-LJQANCHMSA-N 2 0 370.368 4.060 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000539161040 1111455231 /nfs/dbraw/zinc/45/52/31/1111455231.db2.gz RXFJDDTWRMWCGC-IBGZPJMESA-N 2 0 370.368 4.060 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC000462037963 1111469662 /nfs/dbraw/zinc/46/96/62/1111469662.db2.gz JYVONCBJMZAVCD-UHFFFAOYSA-N 3 0 371.613 4.185 20 0 FIADRP COc1ccccc1[C@H]([NH2+]CC(C)(C)N1CCC(OC)CC1)C1CCCC1 ZINC000539202166 1111470371 /nfs/dbraw/zinc/47/03/71/1111470371.db2.gz HNYDDSVPMKPLPT-JOCHJYFZSA-N 2 0 374.569 4.406 20 0 FIADRP CC[NH+]1CCC(Nc2ccc(C[N@H+](C[C@@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000462070058 1111488093 /nfs/dbraw/zinc/48/80/93/1111488093.db2.gz VDNKNBWHMGWMDK-QHCPKHFHSA-N 2 0 373.585 4.362 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2CCN(CC)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000539296722 1111506534 /nfs/dbraw/zinc/50/65/34/1111506534.db2.gz KGSLQOLNNHKDBE-PMACEKPBSA-N 2 0 367.940 4.078 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccc(F)cc2)CC1 ZINC000643521888 1111547617 /nfs/dbraw/zinc/54/76/17/1111547617.db2.gz DXNOUGQYAWGACI-FGZHOGPDSA-N 3 0 361.549 4.111 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccc(F)cc2)CC1 ZINC000643521887 1111547739 /nfs/dbraw/zinc/54/77/39/1111547739.db2.gz DXNOUGQYAWGACI-FCHUYYIVSA-N 3 0 361.549 4.111 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000552062517 1111563039 /nfs/dbraw/zinc/56/30/39/1111563039.db2.gz ZZXNOASOXDEVDS-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)[C@H](C)C1 ZINC000477855784 1111579444 /nfs/dbraw/zinc/57/94/44/1111579444.db2.gz IUSUUQNLMCZSAM-MLGOLLRUSA-N 2 0 354.325 4.337 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477857902 1111579879 /nfs/dbraw/zinc/57/98/79/1111579879.db2.gz RRLPBZKXROPFHE-NQIIRXRSSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000477868252 1111582826 /nfs/dbraw/zinc/58/28/26/1111582826.db2.gz WQSSNYLFULWKJB-GHTZIAJQSA-N 2 0 360.542 4.160 20 0 FIADRP Clc1cc2[nH]cc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c2c(Cl)c1 ZINC000477867465 1111583512 /nfs/dbraw/zinc/58/35/12/1111583512.db2.gz UCWSHUSEOJQNHC-LSDHHAIUSA-N 2 0 352.309 4.234 20 0 FIADRP COC[C@@H](Cc1ccccc1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552252149 1111629844 /nfs/dbraw/zinc/62/98/44/1111629844.db2.gz DDENSGLASDGVAM-NSQNTRMNSA-N 2 0 366.549 4.277 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552247506 1111637600 /nfs/dbraw/zinc/63/76/00/1111637600.db2.gz RXKMWARPJAPIJN-SFHVURJKSA-N 2 0 374.447 4.127 20 0 FIADRP COCCC[C@@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Cl)cc1 ZINC000552319719 1111667434 /nfs/dbraw/zinc/66/74/34/1111667434.db2.gz OWVUHRUIUFIBNZ-IBGZPJMESA-N 2 0 364.961 4.314 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@H](OCC2CC2)c2ccc(Cl)cc2)CC1 ZINC000552323975 1111669213 /nfs/dbraw/zinc/66/92/13/1111669213.db2.gz XHSRVAZPXQTEGX-FQEVSTJZSA-N 2 0 350.934 4.272 20 0 FIADRP Cn1cc2c(n1)CCC[C@@H]2[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000479348631 1111995586 /nfs/dbraw/zinc/99/55/86/1111995586.db2.gz QYMHSSAOEJIVIE-QFIPXVFZSA-N 2 0 366.553 4.352 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000553548681 1112002386 /nfs/dbraw/zinc/00/23/86/1112002386.db2.gz KGOFDEIWQCEHPY-UHFFFAOYSA-N 2 0 366.534 4.337 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4nn(C)cc43)cc2)C1 ZINC000479363208 1112006586 /nfs/dbraw/zinc/00/65/86/1112006586.db2.gz PKJZDGMOLBFEPQ-SVMVAKDDSA-N 2 0 366.553 4.065 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)ccc1F ZINC000479438049 1112023253 /nfs/dbraw/zinc/02/32/53/1112023253.db2.gz NRSRHHFKXQTKGD-SIKLNZKXSA-N 2 0 374.475 4.018 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)ccc1F ZINC000479438050 1112023333 /nfs/dbraw/zinc/02/33/33/1112023333.db2.gz NRSRHHFKXQTKGD-UGKGYDQZSA-N 2 0 374.475 4.018 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466324 1112041832 /nfs/dbraw/zinc/04/18/32/1112041832.db2.gz RNJXXHOVNAUDEW-IRLDBZIGSA-N 2 0 350.506 4.320 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000479466315 1112042017 /nfs/dbraw/zinc/04/20/17/1112042017.db2.gz RLQLWBDPXIQRPN-XLIONFOSSA-N 2 0 356.510 4.474 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000479557906 1112070881 /nfs/dbraw/zinc/07/08/81/1112070881.db2.gz YTJGHOUKHDFSCM-IBGZPJMESA-N 2 0 367.537 4.359 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000479765606 1112135235 /nfs/dbraw/zinc/13/52/35/1112135235.db2.gz DIDHZRUVWPDPEY-KXBFYZLASA-N 2 0 373.368 4.263 20 0 FIADRP Cc1c([C@@H](C)NCCC[NH+](C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000479877350 1112174546 /nfs/dbraw/zinc/17/45/46/1112174546.db2.gz XFCZJRGKONEURM-GFCCVEGCSA-N 2 0 355.313 4.090 20 0 FIADRP COc1cc(OC)c([C@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC000480050111 1112253458 /nfs/dbraw/zinc/25/34/58/1112253458.db2.gz UDTOYGJNZXIGOK-LBPRGKRZSA-N 2 0 354.922 4.317 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480142235 1112299627 /nfs/dbraw/zinc/29/96/27/1112299627.db2.gz AYXYDQXMNUOFNI-QGZVFWFLSA-N 2 0 359.514 4.402 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000480166100 1112312620 /nfs/dbraw/zinc/31/26/20/1112312620.db2.gz BDQHXFVNQVNCCJ-QGZVFWFLSA-N 2 0 373.928 4.103 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)c3ccsc3)CC2)c1 ZINC000480229455 1112339784 /nfs/dbraw/zinc/33/97/84/1112339784.db2.gz OYIOUTFFDRFCDF-IBGZPJMESA-N 2 0 357.567 4.310 20 0 FIADRP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000480243862 1112341885 /nfs/dbraw/zinc/34/18/85/1112341885.db2.gz WMEGSOFSCBASAI-JXQFQVJHSA-N 2 0 364.533 4.381 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480241363 1112345722 /nfs/dbraw/zinc/34/57/22/1112345722.db2.gz MVPITPLIZVICAJ-UFYCRDLUSA-N 2 0 352.522 4.455 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000554561063 1112401895 /nfs/dbraw/zinc/40/18/95/1112401895.db2.gz OOSUKGFRHUIIMB-QHCPKHFHSA-N 2 0 364.533 4.464 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC000554742525 1112467513 /nfs/dbraw/zinc/46/75/13/1112467513.db2.gz XUBKGVOWGCOGSW-YADHBBJMSA-N 2 0 367.537 4.228 20 0 FIADRP c1ccc2c(c1)CCc1ccccc1C2C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168363141 1112469780 /nfs/dbraw/zinc/46/97/80/1112469780.db2.gz UJQSEKGFTBIHGF-UHFFFAOYSA-N 2 0 360.545 4.381 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000480608973 1112499274 /nfs/dbraw/zinc/49/92/74/1112499274.db2.gz IJQLPHNNTZOJAP-XPNTWCBSSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480623130 1112514864 /nfs/dbraw/zinc/51/48/64/1112514864.db2.gz HTYCBQARDDGFRR-DLBZAZTESA-N 2 0 357.542 4.222 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc2c(c1)OCO2 ZINC000480635486 1112523506 /nfs/dbraw/zinc/52/35/06/1112523506.db2.gz AIJMLZTYJKSCJK-QZTJIDSGSA-N 2 0 366.505 4.498 20 0 FIADRP CC(C)C[C@@H](CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@@H](C)c1ccccc1 ZINC000667727647 1112551330 /nfs/dbraw/zinc/55/13/30/1112551330.db2.gz DXDHLQFHJLUWTJ-UWJYYQICSA-N 2 0 368.525 4.032 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000480703403 1112554414 /nfs/dbraw/zinc/55/44/14/1112554414.db2.gz YCDGGLYRSXEDSA-IBGZPJMESA-N 2 0 366.553 4.027 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480744276 1112582981 /nfs/dbraw/zinc/58/29/81/1112582981.db2.gz YFLYOXDUVBMKPJ-UGQVUOCMSA-N 2 0 357.325 4.366 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000480782769 1112595245 /nfs/dbraw/zinc/59/52/45/1112595245.db2.gz XTIPIWJXZSJJMV-UYAOXDASSA-N 2 0 357.567 4.086 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1OC(F)F ZINC000480900111 1112662501 /nfs/dbraw/zinc/66/25/01/1112662501.db2.gz MHFOJOFTQUHWMC-GJZGRUSLSA-N 2 0 356.457 4.069 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2CO[C@@H](C3CC3)C2)cc1 ZINC000667778282 1112671233 /nfs/dbraw/zinc/67/12/33/1112671233.db2.gz ZFWXMVVPDCICIP-FYYLOGMGSA-N 2 0 350.506 4.072 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(C)cc4)sc32)C1 ZINC000481302051 1112887199 /nfs/dbraw/zinc/88/71/99/1112887199.db2.gz BYJKTPLNOAJDCV-FUHWJXTLSA-N 2 0 355.551 4.427 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)[C@H](C)C1 ZINC000481421639 1112937947 /nfs/dbraw/zinc/93/79/47/1112937947.db2.gz IYXVJBXQOZCBCD-IIBYNOLFSA-N 2 0 357.542 4.011 20 0 FIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CC/C=C/c3ccc(Br)cc3)C2)C1 ZINC000555597410 1112941552 /nfs/dbraw/zinc/94/15/52/1112941552.db2.gz HGBFDRYFPFRVPH-KPUAHBEZSA-N 2 0 363.343 4.270 20 0 FIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000481651077 1113012042 /nfs/dbraw/zinc/01/20/42/1113012042.db2.gz CUUKVQZVYMEAGN-ZACQAIPSSA-N 2 0 372.475 4.115 20 0 FIADRP CC[NH+](CC)[C@H]1CCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877306 1113041469 /nfs/dbraw/zinc/04/14/69/1113041469.db2.gz RFMAHQRSNYGDOQ-ZDUSSCGKSA-N 2 0 353.388 4.054 20 0 FIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCCO2 ZINC000481740829 1113063954 /nfs/dbraw/zinc/06/39/54/1113063954.db2.gz IPBLHPFNWRJCIU-OAQYLSRUSA-N 2 0 368.521 4.247 20 0 FIADRP O=c1[nH]c2ccccc2cc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000600625129 1113114982 /nfs/dbraw/zinc/11/49/82/1113114982.db2.gz MAUQAQZVXDSEBU-UHFFFAOYSA-N 2 0 353.510 4.028 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc4c(c3)CCCO4)cc2)CC[N@@H+]1C ZINC000482121603 1113181639 /nfs/dbraw/zinc/18/16/39/1113181639.db2.gz DCSBZUIGEAFHPB-JTSKRJEESA-N 2 0 350.506 4.251 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCCO3)cc1 ZINC000482127662 1113183835 /nfs/dbraw/zinc/18/38/35/1113183835.db2.gz ORJIPHNLNIBYTG-JTSKRJEESA-N 2 0 350.506 4.108 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccccc2Cl)[C@H](C)C1 ZINC000482236616 1113206600 /nfs/dbraw/zinc/20/66/00/1113206600.db2.gz ASMMRCJABMSOPW-YLJYHZDGSA-N 2 0 366.977 4.344 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCCO2 ZINC000162902172 1113206845 /nfs/dbraw/zinc/20/68/45/1113206845.db2.gz WNPBAHCUBWGSGK-JOCHJYFZSA-N 2 0 366.505 4.295 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000162911151 1113225205 /nfs/dbraw/zinc/22/52/05/1113225205.db2.gz MLQMETXWUVJKQP-IBGZPJMESA-N 2 0 368.521 4.158 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000482339590 1113229231 /nfs/dbraw/zinc/22/92/31/1113229231.db2.gz VRUXCEIQJXEZJM-GBXCKJPGSA-N 3 0 365.565 4.139 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3cc(Br)ccc32)C1 ZINC000482343615 1113229969 /nfs/dbraw/zinc/22/99/69/1113229969.db2.gz LIAWHCXJUMKDQX-KSSFIOAISA-N 2 0 351.332 4.146 20 0 FIADRP Cc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)c21 ZINC000482438103 1113259890 /nfs/dbraw/zinc/25/98/90/1113259890.db2.gz LHOPUTYIGGDINO-SFHVURJKSA-N 2 0 365.521 4.310 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)OCCCO2 ZINC000162941283 1113268218 /nfs/dbraw/zinc/26/82/18/1113268218.db2.gz JQFBYTKZLRYXAV-SFHVURJKSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482532791 1113285844 /nfs/dbraw/zinc/28/58/44/1113285844.db2.gz KGUVJHKEAFFKGL-VFNWGFHPSA-N 2 0 371.475 4.055 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000482543626 1113292806 /nfs/dbraw/zinc/29/28/06/1113292806.db2.gz NJDJYXOHYQYAIB-HTAPYJJXSA-N 2 0 367.512 4.224 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000482547646 1113294480 /nfs/dbraw/zinc/29/44/80/1113294480.db2.gz CIQMIXFWUSJNED-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482638264 1113317281 /nfs/dbraw/zinc/31/72/81/1113317281.db2.gz ZPZLQYNQPXRBIB-WMZHIEFXSA-N 2 0 367.537 4.156 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](C3CCCC3)CC2)cc1 ZINC000482640263 1113317515 /nfs/dbraw/zinc/31/75/15/1113317515.db2.gz UIICSCPAMUIPNM-UHFFFAOYSA-N 2 0 371.569 4.055 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cccc(-c2ccccc2)c1 ZINC000482883667 1113392058 /nfs/dbraw/zinc/39/20/58/1113392058.db2.gz AJDHXUOMHUKMDX-AUSIDOKSSA-N 2 0 352.522 4.241 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(OC)c1 ZINC000482899691 1113395656 /nfs/dbraw/zinc/39/56/56/1113395656.db2.gz MLHLMPDSCVUXCW-QHCPKHFHSA-N 2 0 368.521 4.411 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@H]2CCCC[NH+]2C)cc1 ZINC000483276403 1113478581 /nfs/dbraw/zinc/47/85/81/1113478581.db2.gz NAAJYYYSENOOFV-WIYYLYMNSA-N 2 0 357.542 4.264 20 0 FIADRP Cc1nn(-c2ccccc2)cc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486376486 1113556485 /nfs/dbraw/zinc/55/64/85/1113556485.db2.gz OYSGEFHMBCYIHN-DENIHFKCSA-N 2 0 374.532 4.181 20 0 FIADRP C[C@H](NCc1csc(-c2ccco2)n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486514877 1113585678 /nfs/dbraw/zinc/58/56/78/1113585678.db2.gz FKAZJYGKBUNHNM-WMZOPIPTSA-N 2 0 367.518 4.403 20 0 FIADRP COc1cc(C)c(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000486522135 1113587709 /nfs/dbraw/zinc/58/77/09/1113587709.db2.gz YCJRZYCGTHPXMR-UYAOXDASSA-N 2 0 368.521 4.012 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 ZINC000488107718 1113855808 /nfs/dbraw/zinc/85/58/08/1113855808.db2.gz GZIBMBSDYPZAJW-BRKWEVRTSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000488117330 1113859317 /nfs/dbraw/zinc/85/93/17/1113859317.db2.gz YEJCEYWWTCUQKI-YCZSINBZSA-N 2 0 354.538 4.108 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000488433628 1113929495 /nfs/dbraw/zinc/92/94/95/1113929495.db2.gz JLZCFFRCHJTCCS-SFHVURJKSA-N 2 0 373.585 4.192 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000488445350 1113933293 /nfs/dbraw/zinc/93/32/93/1113933293.db2.gz FRQKCBYZDFIVPS-SNJCGAMXSA-N 2 0 358.570 4.439 20 0 FIADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000489887921 1114182765 /nfs/dbraw/zinc/18/27/65/1114182765.db2.gz WIIIOVVRYXNGDL-GOSISDBHSA-N 2 0 367.493 4.011 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000490157423 1114219445 /nfs/dbraw/zinc/21/94/45/1114219445.db2.gz MEQPYUUCCCVRAL-LJQANCHMSA-N 2 0 361.327 4.470 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000570964754 1114418555 /nfs/dbraw/zinc/41/85/55/1114418555.db2.gz ARYQTRIFOHPKHX-GAJHUEQPSA-N 2 0 350.506 4.498 20 0 FIADRP CSC1(C[NH2+]Cc2csc(-c3ccc(C)cc3)n2)CC[NH+](C)CC1 ZINC000571035266 1114425442 /nfs/dbraw/zinc/42/54/42/1114425442.db2.gz BPYGDGWNJBUONO-UHFFFAOYSA-N 2 0 361.580 4.036 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccn1 ZINC000571466597 1114466266 /nfs/dbraw/zinc/46/62/66/1114466266.db2.gz BTYAFUDKVIUIDA-ROUUACIJSA-N 2 0 353.510 4.315 20 0 FIADRP C[C@H](C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000571730450 1114501064 /nfs/dbraw/zinc/50/10/64/1114501064.db2.gz CGGVAGZAEIAOOQ-OAQYLSRUSA-N 2 0 366.549 4.451 20 0 FIADRP CN(Cc1ccccc1OC1CC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000571806194 1114539851 /nfs/dbraw/zinc/53/98/51/1114539851.db2.gz AFHRTIARXSWSBX-FQEVSTJZSA-N 2 0 350.506 4.182 20 0 FIADRP c1ccc2nc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)cnc2c1 ZINC000589840848 1114848010 /nfs/dbraw/zinc/84/80/10/1114848010.db2.gz VRQSVJGYPVZTRS-UHFFFAOYSA-N 2 0 360.505 4.296 20 0 FIADRP c1c(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2n1Cc1ccccc1 ZINC000590611268 1114952787 /nfs/dbraw/zinc/95/27/87/1114952787.db2.gz DTLBNZVGTCDUOR-HXUWFJFHSA-N 2 0 359.517 4.264 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001168400309 1115033229 /nfs/dbraw/zinc/03/32/29/1115033229.db2.gz MBNUCMNKLJMXPA-JLLPCOHGSA-N 2 0 364.508 4.468 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CCC[C@@H]([NH+]4CCCC4)C3)c2cc1OCC ZINC000591652205 1115119817 /nfs/dbraw/zinc/11/98/17/1115119817.db2.gz ULLSATLCRLIKTI-QGZVFWFLSA-N 2 0 369.509 4.097 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000573609583 1115146726 /nfs/dbraw/zinc/14/67/26/1115146726.db2.gz BRYBNLGBFNXSNI-ZFWWWQNUSA-N 2 0 374.941 4.275 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCC(O)(c4ccccc4)CC3)CC2)C1 ZINC000760908722 1115170203 /nfs/dbraw/zinc/17/02/03/1115170203.db2.gz QJCPUEOEEOVRHB-LDOASJGRSA-N 2 0 370.581 4.450 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)CCc2ccc(F)cc2F)[C@@H](C)C1 ZINC000574062426 1115288404 /nfs/dbraw/zinc/28/84/04/1115288404.db2.gz TZZIUVHSOJESPB-FVJLSDCUSA-N 2 0 368.512 4.013 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCc2ccc(NC(=O)OC(C)(C)C)cc2)CC1 ZINC000167706519 1115324816 /nfs/dbraw/zinc/32/48/16/1115324816.db2.gz PHAZUAVWTPPUJV-UHFFFAOYSA-N 2 0 361.530 4.040 20 0 FIADRP Clc1ccc(/C=C\C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc1 ZINC001168402980 1115355543 /nfs/dbraw/zinc/35/55/43/1115355543.db2.gz MOWLDCVGKVQWMN-IWQZZHSRSA-N 2 0 362.945 4.178 20 0 FIADRP C[N@@H+]1CC[C@H](NC2CC[NH+](C3CCCCC3)CC2)C[C@@H]1c1ccccc1 ZINC000574624092 1115429669 /nfs/dbraw/zinc/42/96/69/1115429669.db2.gz HOQPEPGMJRQEHT-JTHBVZDNSA-N 2 0 355.570 4.209 20 0 FIADRP CC(C)C[C@H](CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000575178043 1115546713 /nfs/dbraw/zinc/54/67/13/1115546713.db2.gz HJGCJRGEQVAAKV-KGVIQGDOSA-N 2 0 367.537 4.202 20 0 FIADRP Brc1cccc(CCC[NH2+]Cc2ccc(-n3ccnc3)cc2)c1 ZINC000595626856 1115551546 /nfs/dbraw/zinc/55/15/46/1115551546.db2.gz ZKZLCDZZCJLRGW-UHFFFAOYSA-N 2 0 370.294 4.357 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000669614186 1115665949 /nfs/dbraw/zinc/66/59/49/1115665949.db2.gz CTEQNYKJCMBZHJ-WOJBJXKFSA-N 2 0 359.517 4.137 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000669614183 1115665983 /nfs/dbraw/zinc/66/59/83/1115665983.db2.gz CTEQNYKJCMBZHJ-PMACEKPBSA-N 2 0 359.517 4.137 20 0 FIADRP COc1cccc(CNCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1F ZINC000669679704 1115773876 /nfs/dbraw/zinc/77/38/76/1115773876.db2.gz DGHVSJHRLXQPTK-QGZVFWFLSA-N 2 0 356.485 4.356 20 0 FIADRP COc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1F ZINC000669709016 1115844414 /nfs/dbraw/zinc/84/44/14/1115844414.db2.gz JKHVKPAKSAJEFP-UHFFFAOYSA-N 2 0 368.496 4.322 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000606470825 1115948385 /nfs/dbraw/zinc/94/83/85/1115948385.db2.gz YDSZUUDRBPPFQQ-GMAHTHKFSA-N 2 0 352.522 4.128 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccccc2OCc2ccncc2)c1 ZINC000642196037 1116155567 /nfs/dbraw/zinc/15/55/67/1116155567.db2.gz MHLNGDBXGSZTLQ-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000534238068 1116174229 /nfs/dbraw/zinc/17/42/29/1116174229.db2.gz CCJCXQXJDRMYIV-FQEVSTJZSA-N 2 0 358.913 4.448 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509164 1116313855 /nfs/dbraw/zinc/31/38/55/1116313855.db2.gz YPCXXDFXVZXQCU-MEDUHNTESA-N 2 0 357.723 4.021 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000539544148 1116341296 /nfs/dbraw/zinc/34/12/96/1116341296.db2.gz GDEQLTCLSYPELV-UHFFFAOYSA-N 2 0 361.283 4.061 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH+]1CCC3(CC[N@H+](Cc4ccoc4)C3)CC1)C2 ZINC001168432552 1117747117 /nfs/dbraw/zinc/74/71/17/1117747117.db2.gz WKCFBMSQUGQYNP-QFIPXVFZSA-N 2 0 368.496 4.264 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000462796804 1117779266 /nfs/dbraw/zinc/77/92/66/1117779266.db2.gz XFXBTHRUISUTPR-XPWALMASSA-N 2 0 356.554 4.357 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCC2 ZINC000539968624 1117786365 /nfs/dbraw/zinc/78/63/65/1117786365.db2.gz XCAOYIWKLBSTKP-IBGZPJMESA-N 2 0 363.343 4.291 20 0 FIADRP CO[C@H](C)CC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462806284 1117788520 /nfs/dbraw/zinc/78/85/20/1117788520.db2.gz JIZYHLFIGXHOKS-WIYYLYMNSA-N 2 0 350.522 4.394 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@](C)(O)C2CC2)c2ccc(F)cc2)CC1 ZINC000462815471 1117793565 /nfs/dbraw/zinc/79/35/65/1117793565.db2.gz HYZFZBXGEPJNHE-VXKWHMMOSA-N 2 0 362.533 4.130 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1OC(F)F ZINC000540172695 1117913394 /nfs/dbraw/zinc/91/33/94/1117913394.db2.gz SBTCVUCLFZKZSR-SOLBZPMBSA-N 2 0 370.484 4.218 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCCOc3c(Cl)cccc32)C[C@H](C)O1 ZINC000540175433 1117915782 /nfs/dbraw/zinc/91/57/82/1117915782.db2.gz IJWNCXBTOIOHQF-FCEWJHQRSA-N 2 0 366.933 4.033 20 0 FIADRP CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540178729 1117923300 /nfs/dbraw/zinc/92/33/00/1117923300.db2.gz FCXFGJUNQSGZQH-VGSWGCGISA-N 2 0 368.521 4.364 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(Cl)s1)c1cccc(OCC[NH+](C)C)c1 ZINC000540192645 1117934155 /nfs/dbraw/zinc/93/41/55/1117934155.db2.gz KSLTWRUUPLNDEL-AWEZNQCLSA-N 2 0 352.931 4.235 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000463108857 1117968678 /nfs/dbraw/zinc/96/86/78/1117968678.db2.gz UZVIPCYTXGWVQI-OAQYLSRUSA-N 2 0 368.569 4.179 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540300116 1117975395 /nfs/dbraw/zinc/97/53/95/1117975395.db2.gz YVFZQUKKKIPHGH-HXUWFJFHSA-N 2 0 371.456 4.221 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000540300707 1117975890 /nfs/dbraw/zinc/97/58/90/1117975890.db2.gz CJUVRYRJAYNFGX-HXUWFJFHSA-N 2 0 359.514 4.476 20 0 FIADRP CC(C)[NH+](CCC[NH2+]C1CCN(Cc2ccccc2Cl)CC1)C(C)C ZINC000463207685 1118021492 /nfs/dbraw/zinc/02/14/92/1118021492.db2.gz TWNCPTQNAAGOJF-UHFFFAOYSA-N 2 0 365.993 4.403 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000540406740 1118036148 /nfs/dbraw/zinc/03/61/48/1118036148.db2.gz LXJVKTGACQDTAK-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2c3cc(Br)ccc3SC[C@H]2C)C1 ZINC000540409275 1118037762 /nfs/dbraw/zinc/03/77/62/1118037762.db2.gz UZFOLHSJSAKFIN-PBFPGSCMSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000540418020 1118044469 /nfs/dbraw/zinc/04/44/69/1118044469.db2.gz YPUPTGMXJUVKHC-BLLLJJGKSA-N 2 0 357.361 4.163 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)C[C@@H]1C ZINC000540548437 1118120390 /nfs/dbraw/zinc/12/03/90/1118120390.db2.gz UXEDXITUXVNQAH-FPOVZHCZSA-N 2 0 374.569 4.187 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000540596738 1118140609 /nfs/dbraw/zinc/14/06/09/1118140609.db2.gz GYIQURGYHTUKIW-GOSISDBHSA-N 2 0 365.521 4.264 20 0 FIADRP CCc1cnccc1[C@H](C)[NH2+]CC[C@H](C)[NH2+][C@@H](C)c1ccncc1CC ZINC000541193405 1118414593 /nfs/dbraw/zinc/41/45/93/1118414593.db2.gz QCEOUGFJAZGQRA-BZSNNMDCSA-N 2 0 354.542 4.381 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cn1 ZINC000491316104 1118479548 /nfs/dbraw/zinc/47/95/48/1118479548.db2.gz KBBKSPDDPMCVBN-LLGFUMIMSA-N 2 0 371.500 4.071 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000541378713 1118494965 /nfs/dbraw/zinc/49/49/65/1118494965.db2.gz WSQYQGAZBBCAHA-NRFANRHFSA-N 2 0 362.452 4.441 20 0 FIADRP CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000541533906 1118553134 /nfs/dbraw/zinc/55/31/34/1118553134.db2.gz HKNBYTWHGNCZFY-QFIPXVFZSA-N 2 0 362.477 4.312 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC(=O)Nc3ccccc32)c1 ZINC000541565562 1118557607 /nfs/dbraw/zinc/55/76/07/1118557607.db2.gz GIEAWWUMLSZFEN-HXUWFJFHSA-N 2 0 351.494 4.090 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCC(=O)Nc2ccccc21 ZINC000541550168 1118559133 /nfs/dbraw/zinc/55/91/33/1118559133.db2.gz XRIADRUQMXIYHW-FQEVSTJZSA-N 2 0 351.494 4.092 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541662173 1118601050 /nfs/dbraw/zinc/60/10/50/1118601050.db2.gz LAEUGOPGAMNKHY-HXUWFJFHSA-N 2 0 365.565 4.250 20 0 FIADRP COc1cccc(CCC[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464843897 1118718406 /nfs/dbraw/zinc/71/84/06/1118718406.db2.gz ZKRZLWDQAFDRIR-JOCHJYFZSA-N 2 0 352.522 4.082 20 0 FIADRP C[C@@H](CCCCO)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000670161068 1118749723 /nfs/dbraw/zinc/74/97/23/1118749723.db2.gz GHFAJUQERLZYAH-ZBUUHCTJSA-N 2 0 364.961 4.395 20 0 FIADRP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492404598 1119088048 /nfs/dbraw/zinc/08/80/48/1119088048.db2.gz ZNKKENJBTDWIKQ-IRLDBZIGSA-N 2 0 352.522 4.346 20 0 FIADRP Cc1nn(C)cc1[C@@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000178046277 1119367992 /nfs/dbraw/zinc/36/79/92/1119367992.db2.gz ZJQCUCBDLOYZAB-LJQANCHMSA-N 2 0 368.569 4.114 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000178134541 1119373241 /nfs/dbraw/zinc/37/32/41/1119373241.db2.gz VSMYYTMQGZMOCK-BZSNNMDCSA-N 2 0 354.542 4.057 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000178216268 1119377594 /nfs/dbraw/zinc/37/75/94/1119377594.db2.gz KOSIWDIGSRAVOA-LOTPSLMQSA-N 2 0 369.475 4.250 20 0 FIADRP Cc1cc(N2CCC([NH2+][C@@H]3CC(C)(C)c4ccccc43)CC2)nc(C)n1 ZINC000178322268 1119383979 /nfs/dbraw/zinc/38/39/79/1119383979.db2.gz FDJYQCUQUWUUCG-HXUWFJFHSA-N 2 0 350.510 4.074 20 0 FIADRP CC(C)Oc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311704814 1119385437 /nfs/dbraw/zinc/38/54/37/1119385437.db2.gz VAQGWMPFZFZQKZ-UGKGYDQZSA-N 2 0 352.522 4.474 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(C)c3ncccc3c2)CC1 ZINC000542466635 1119461681 /nfs/dbraw/zinc/46/16/81/1119461681.db2.gz OHWQWUPYJVCGHW-UHFFFAOYSA-N 2 0 369.553 4.114 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCc3cc(Br)cc(C)c32)C1 ZINC000493916681 1119506279 /nfs/dbraw/zinc/50/62/79/1119506279.db2.gz MCLNFWTYHCWWTE-WMLDXEAASA-N 2 0 351.332 4.066 20 0 FIADRP Cc1nc2ccc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cc2s1 ZINC000494202835 1119558641 /nfs/dbraw/zinc/55/86/41/1119558641.db2.gz YIKAJWUVYNMDMB-UHFFFAOYSA-N 2 0 352.507 4.006 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCCO2 ZINC000183199236 1119568181 /nfs/dbraw/zinc/56/81/81/1119568181.db2.gz PGCFDOKNDJNRLX-JENIJYKNSA-N 2 0 358.526 4.152 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000186130754 1119707542 /nfs/dbraw/zinc/70/75/42/1119707542.db2.gz DNUIPVCOYMQCGZ-ULQDDVLXSA-N 2 0 374.550 4.217 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc(Br)c1OC ZINC000187088458 1119765915 /nfs/dbraw/zinc/76/59/15/1119765915.db2.gz BMOQKZSXPOOPOV-AWEZNQCLSA-N 2 0 357.336 4.058 20 0 FIADRP O=C1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c2ccccc2N1 ZINC000542480492 1119822455 /nfs/dbraw/zinc/82/24/55/1119822455.db2.gz DJSKNBFGGCUNFF-NRFANRHFSA-N 2 0 363.505 4.236 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000494481467 1119876350 /nfs/dbraw/zinc/87/63/50/1119876350.db2.gz AIJQKRHIJASPAB-LEWJYISDSA-N 2 0 367.880 4.454 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000189379102 1119890277 /nfs/dbraw/zinc/89/02/77/1119890277.db2.gz QKLOHHZCUTZXOK-LAUBAEHRSA-N 2 0 354.494 4.110 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000494530347 1119895717 /nfs/dbraw/zinc/89/57/17/1119895717.db2.gz XGXZCHQBNMDVMR-SFHVURJKSA-N 2 0 363.343 4.209 20 0 FIADRP COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cn(-c3cc[nH+]cc3)nc1C)[C@@H]2C ZINC000542485523 1119932877 /nfs/dbraw/zinc/93/28/77/1119932877.db2.gz POURVGZGJQXGKM-NVXWUHKLSA-N 2 0 362.477 4.092 20 0 FIADRP COc1ccc([C@@H]2CCCCC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000191401620 1119975378 /nfs/dbraw/zinc/97/53/78/1119975378.db2.gz ZNKHXVMLUGWKNU-QHCPKHFHSA-N 2 0 373.585 4.028 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccnn1-c1ccccc1 ZINC000467374498 1119981528 /nfs/dbraw/zinc/98/15/28/1119981528.db2.gz XRAFDDDNGBPDSX-TZIWHRDSSA-N 2 0 360.505 4.045 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000192790006 1120083147 /nfs/dbraw/zinc/08/31/47/1120083147.db2.gz JCHAIZZINBGEQP-HXUWFJFHSA-N 2 0 367.528 4.058 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000192789993 1120083334 /nfs/dbraw/zinc/08/33/34/1120083334.db2.gz JCHAIZZINBGEQP-FQEVSTJZSA-N 2 0 367.528 4.058 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000192833583 1120086582 /nfs/dbraw/zinc/08/65/82/1120086582.db2.gz SMAMVBAOFQGPRZ-HNNXBMFYSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3sccc3Cl)cc2)C[C@@H](C)O1 ZINC000192994896 1120093542 /nfs/dbraw/zinc/09/35/42/1120093542.db2.gz QXIRDQYTPJOIAN-HUUCEWRRSA-N 2 0 364.942 4.301 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000195133632 1120120257 /nfs/dbraw/zinc/12/02/57/1120120257.db2.gz ZYHVIROFDURBMO-RXVVDRJESA-N 2 0 368.546 4.344 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494774772 1120184454 /nfs/dbraw/zinc/18/44/54/1120184454.db2.gz LCSBGDPSHBXSFA-LBVMUVSTSA-N 2 0 352.522 4.263 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCc3ccc(Br)cc32)cc1 ZINC000193971244 1120222407 /nfs/dbraw/zinc/22/24/07/1120222407.db2.gz KQVFIEJNHXRPFL-LJQANCHMSA-N 2 0 359.311 4.288 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000193989980 1120226580 /nfs/dbraw/zinc/22/65/80/1120226580.db2.gz ATPIIAJYWZUOLH-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000495017135 1120424174 /nfs/dbraw/zinc/42/41/74/1120424174.db2.gz LPCIRUUPNDZUKV-IRXDYDNUSA-N 2 0 354.485 4.493 20 0 FIADRP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)C1CCCC1 ZINC000495076346 1120459333 /nfs/dbraw/zinc/45/93/33/1120459333.db2.gz ZFHHEMBUIWYDRW-XXBNENTESA-N 2 0 356.554 4.317 20 0 FIADRP Fc1ccc([C@@H](C[C@H]2CCOC2)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000495077988 1120462525 /nfs/dbraw/zinc/46/25/25/1120462525.db2.gz HAXPCPGZTMLTIU-VGOFRKELSA-N 2 0 360.517 4.290 20 0 FIADRP C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495186298 1120532178 /nfs/dbraw/zinc/53/21/78/1120532178.db2.gz WORFMZLOALWTKN-TZIWHRDSSA-N 2 0 356.554 4.226 20 0 FIADRP COc1cccc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)oc21 ZINC000914796059 1120541485 /nfs/dbraw/zinc/54/14/85/1120541485.db2.gz UBBABOAUXQXMHR-UHFFFAOYSA-N 2 0 350.462 4.327 20 0 FIADRP COC[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000670160978 1120763307 /nfs/dbraw/zinc/76/33/07/1120763307.db2.gz ITWZZECWBUEZBN-OOHWTWPMSA-N 2 0 362.945 4.269 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495380982 1120768603 /nfs/dbraw/zinc/76/86/03/1120768603.db2.gz TXVRJVQADCGNPC-KPLVRAHFSA-N 2 0 350.506 4.183 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(F)ccc1F ZINC000495548488 1120882345 /nfs/dbraw/zinc/88/23/45/1120882345.db2.gz QKTSKVNBZAVJOM-IXDOHACOSA-N 2 0 374.475 4.425 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccccc2C)CC1 ZINC000236985814 1120972283 /nfs/dbraw/zinc/97/22/83/1120972283.db2.gz FQVWOWYJTDIDER-SFHVURJKSA-N 2 0 355.501 4.127 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000237161310 1120973957 /nfs/dbraw/zinc/97/39/57/1120973957.db2.gz CVMBNCIXHFTNGN-UHFFFAOYSA-N 2 0 352.400 4.397 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000237146070 1120974036 /nfs/dbraw/zinc/97/40/36/1120974036.db2.gz KRTWHBPBNPCPSU-KDURUIRLSA-N 2 0 352.522 4.148 20 0 FIADRP Fc1cc(F)cc(Oc2ccc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cc2)c1 ZINC000237811487 1120984536 /nfs/dbraw/zinc/98/45/36/1120984536.db2.gz BQQMCRYERQIQCU-MRXNPFEDSA-N 2 0 358.432 4.331 20 0 FIADRP Cc1ccc([C@@H](O)C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000762926439 1120998203 /nfs/dbraw/zinc/99/82/03/1120998203.db2.gz JYWLWDCKILXPRZ-QHCPKHFHSA-N 2 0 364.533 4.017 20 0 FIADRP C[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(Br)c(Cl)c1F ZINC001235717988 1121101327 /nfs/dbraw/zinc/10/13/27/1121101327.db2.gz RARQNXMTVVSEHR-UHFFFAOYSA-N 2 0 363.702 4.063 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)C1CC[NH+](C)CC1 ZINC000155089605 1121180663 /nfs/dbraw/zinc/18/06/63/1121180663.db2.gz PWAPMOVJOOGSOZ-CQSZACIVSA-N 2 0 355.507 4.376 20 0 FIADRP CCn1nc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000397494532 1121191783 /nfs/dbraw/zinc/19/17/83/1121191783.db2.gz AHBDXPVLCZLOAE-UHFFFAOYSA-N 2 0 362.521 4.058 20 0 FIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000397501616 1121196922 /nfs/dbraw/zinc/19/69/22/1121196922.db2.gz ANKYEPAEDXLTEF-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397664196 1121271875 /nfs/dbraw/zinc/27/18/75/1121271875.db2.gz FFFJXXSOHMSICW-SFHVURJKSA-N 2 0 370.562 4.086 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(OC)c1 ZINC000397706148 1121289850 /nfs/dbraw/zinc/28/98/50/1121289850.db2.gz XKXSXYGBOZWSDB-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC001649048815 1121317072 /nfs/dbraw/zinc/31/70/72/1121317072.db2.gz ZZQYNTSRPSDYTG-TZIWHRDSSA-N 2 0 374.569 4.235 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CSc2ccccc21 ZINC000398014185 1121333464 /nfs/dbraw/zinc/33/34/64/1121333464.db2.gz FKSMNHSAZSLHGV-QFUCXCTJSA-N 2 0 352.547 4.376 20 0 FIADRP Cc1ccccc1C1(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC001649029621 1121394167 /nfs/dbraw/zinc/39/41/67/1121394167.db2.gz VSAHBBHGBQNZRX-UHFFFAOYSA-N 2 0 364.533 4.291 20 0 FIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Cl)cc2Br)CC1 ZINC000715514266 1121526690 /nfs/dbraw/zinc/52/66/90/1121526690.db2.gz UYFKMVKXIDMOSN-UHFFFAOYSA-N 2 0 359.739 4.455 20 0 FIADRP CSc1cccc(F)c1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000671724057 1121544458 /nfs/dbraw/zinc/54/44/58/1121544458.db2.gz UDCVVVLKKFDUOM-UHFFFAOYSA-N 2 0 374.525 4.312 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc(Cl)c3)CC2)cc1 ZINC000063319632 1121559417 /nfs/dbraw/zinc/55/94/17/1121559417.db2.gz KRBSCFKJBVZSBX-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP Cc1cc2cc(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)ccc2[nH]1 ZINC000671730970 1121567392 /nfs/dbraw/zinc/56/73/92/1121567392.db2.gz NEFPCKKXBGMWCR-UHFFFAOYSA-N 2 0 363.505 4.241 20 0 FIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)o2)cc1 ZINC000123611928 1121617977 /nfs/dbraw/zinc/61/79/77/1121617977.db2.gz ADZJPTUHPRYMRL-QGZVFWFLSA-N 2 0 356.514 4.160 20 0 FIADRP CC(C)Oc1ncccc1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671741476 1121637061 /nfs/dbraw/zinc/63/70/61/1121637061.db2.gz AQJJJNSKGKFTRX-UHFFFAOYSA-N 2 0 367.537 4.402 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(OC)cc32)c1 ZINC000123899775 1121643996 /nfs/dbraw/zinc/64/39/96/1121643996.db2.gz CPNINQADEUDCOK-OAQYLSRUSA-N 2 0 354.494 4.150 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000063917671 1121727975 /nfs/dbraw/zinc/72/79/75/1121727975.db2.gz ZKLHAIZGHJFTHS-GOSISDBHSA-N 2 0 374.550 4.157 20 0 FIADRP Cc1cc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc2cccnc12 ZINC001649101727 1121794506 /nfs/dbraw/zinc/79/45/06/1121794506.db2.gz OKNAAQASIGCNGQ-UHFFFAOYSA-N 2 0 363.505 4.164 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(-c3ccccc3)c2C)c1 ZINC000765775977 1121971605 /nfs/dbraw/zinc/97/16/05/1121971605.db2.gz OKQXXULIWJQNCG-SFHVURJKSA-N 2 0 362.521 4.483 20 0 FIADRP Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126725779 1121981344 /nfs/dbraw/zinc/98/13/44/1121981344.db2.gz OJPJVKVBXNXVGM-ZWKOTPCHSA-N 2 0 355.501 4.298 20 0 FIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000126757504 1121983632 /nfs/dbraw/zinc/98/36/32/1121983632.db2.gz IXJPMWZMOXYIEY-ZWKOTPCHSA-N 2 0 355.501 4.298 20 0 FIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765780614 1121983916 /nfs/dbraw/zinc/98/39/16/1121983916.db2.gz RKKBPHPQUGNVBP-HTAPYJJXSA-N 2 0 367.512 4.224 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccccc3F)cc2)C1 ZINC000917006695 1121999656 /nfs/dbraw/zinc/99/96/56/1121999656.db2.gz UQXFLZGXLSOVHN-IEGUWTFLSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3F)cc2)C1 ZINC000917009119 1122001852 /nfs/dbraw/zinc/00/18/52/1122001852.db2.gz XXUBUMVOUICRDY-OPAMFIHVSA-N 2 0 374.475 4.020 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2CC)CC1 ZINC000066960733 1122115960 /nfs/dbraw/zinc/11/59/60/1122115960.db2.gz WRLPQXMDNFETTL-SFHVURJKSA-N 2 0 359.558 4.020 20 0 FIADRP COc1ccc([C@H]2C[C@H]([N@H+](C3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168623442 1122178735 /nfs/dbraw/zinc/17/87/35/1122178735.db2.gz IUXGZRCWBYXNPQ-KTDPBYDISA-N 2 0 372.553 4.430 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000497409953 1122220942 /nfs/dbraw/zinc/22/09/42/1122220942.db2.gz BWUPZKQLKROGHO-GOUWZUTHSA-N 2 0 364.533 4.264 20 0 FIADRP Cc1cc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)ccc1Cl ZINC000542710254 1122314082 /nfs/dbraw/zinc/31/40/82/1122314082.db2.gz FMDDHAYZJIPZCV-UHFFFAOYSA-N 2 0 371.956 4.469 20 0 FIADRP CS[C@@H]1CCC[C@@H]([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000129308042 1122567639 /nfs/dbraw/zinc/56/76/39/1122567639.db2.gz BOYMVNILFJBRNV-WOJBJXKFSA-N 2 0 350.547 4.096 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(F)c2ccccc21 ZINC000556119348 1122670927 /nfs/dbraw/zinc/67/09/27/1122670927.db2.gz WIQLWPSMTDZINN-ARBPTSGCSA-N 2 0 356.485 4.007 20 0 FIADRP CN1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)cc3)C2)C[C@H]1c1ccccc1 ZINC000556131840 1122678619 /nfs/dbraw/zinc/67/86/19/1122678619.db2.gz XPFRXZPGHLNBNT-ONTIZHBOSA-N 2 0 369.940 4.344 20 0 FIADRP CSc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000069833298 1122690118 /nfs/dbraw/zinc/69/01/18/1122690118.db2.gz UDRXLYBRMGWCJJ-HDICACEKSA-N 2 0 370.562 4.308 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(=O)OC)cc1 ZINC000556178777 1122717896 /nfs/dbraw/zinc/71/78/96/1122717896.db2.gz ISLFBGVYDQMBFL-DENIHFKCSA-N 2 0 366.505 4.036 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000556204455 1122729630 /nfs/dbraw/zinc/72/96/30/1122729630.db2.gz HRDNUSWREUBULJ-OZOXKJRCSA-N 2 0 356.485 4.363 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000556233980 1122750253 /nfs/dbraw/zinc/75/02/53/1122750253.db2.gz UJYVMEQNCIFCKZ-DENIHFKCSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cc(C(F)(F)F)ccn2)CC1 ZINC000556233357 1122751094 /nfs/dbraw/zinc/75/10/94/1122751094.db2.gz NRIWHJSECBUIIC-BEFAXECRSA-N 2 0 369.475 4.276 20 0 FIADRP COc1cc(OC)c([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1Cl ZINC000556231837 1122757507 /nfs/dbraw/zinc/75/75/07/1122757507.db2.gz XOVLWJFFQQOKDE-HNNXBMFYSA-N 2 0 354.922 4.274 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC[C@H]2CCCC[C@H]2O)CC1 ZINC000556263530 1122773319 /nfs/dbraw/zinc/77/33/19/1122773319.db2.gz ZMPNRNZFPOYXLP-WYZYGFAWSA-N 2 0 358.570 4.351 20 0 FIADRP C[N@H+](Cc1cc(Br)cc(C(F)(F)F)c1)C1(C)CC[NH2+]CC1 ZINC001236226519 1123118149 /nfs/dbraw/zinc/11/81/49/1123118149.db2.gz NTURBEJYOVCPAW-UHFFFAOYSA-N 2 0 365.237 4.042 20 0 FIADRP Cc1ccn2cc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)nc2c1 ZINC000556872022 1123155478 /nfs/dbraw/zinc/15/54/78/1123155478.db2.gz VYSYRVFDUCSLEP-UHFFFAOYSA-N 2 0 362.521 4.176 20 0 FIADRP CCc1nn(C)c(CC)c1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556885848 1123162381 /nfs/dbraw/zinc/16/23/81/1123162381.db2.gz PMBHJQRVOKWYRE-UHFFFAOYSA-N 2 0 368.569 4.078 20 0 FIADRP Cc1cccc(CCC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)n1 ZINC000556913181 1123221903 /nfs/dbraw/zinc/22/19/03/1123221903.db2.gz WTCRQXALKDFQOV-UHFFFAOYSA-N 2 0 351.538 4.355 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]CC4(c5ccccn5)CCC4)[C@H]3C2)cc1 ZINC000556925577 1123226699 /nfs/dbraw/zinc/22/66/99/1123226699.db2.gz VGDWAZLWPUJYIH-FKBYEOEOSA-N 2 0 361.533 4.004 20 0 FIADRP Cc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4C[C@@H]([NH+](C)C)CC[C@H]43)s2)cc1 ZINC000557013826 1123308814 /nfs/dbraw/zinc/30/88/14/1123308814.db2.gz KZRICRPFQJQPRW-CEWLAPEOSA-N 2 0 370.562 4.407 20 0 FIADRP CCOc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499201978 1123321705 /nfs/dbraw/zinc/32/17/05/1123321705.db2.gz KWEYDIIHLDWHDP-NUNAXRQHSA-N 2 0 364.533 4.413 20 0 FIADRP Fc1ccc(F)c(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499237891 1123349437 /nfs/dbraw/zinc/34/94/37/1123349437.db2.gz PIMTWJLRYXSLFT-MZADTFQBSA-N 2 0 356.460 4.293 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCCc4ccccc43)cc2)CC1 ZINC000132772647 1123358635 /nfs/dbraw/zinc/35/86/35/1123358635.db2.gz SVERLIFPJNMWAC-XMMPIXPASA-N 2 0 364.533 4.201 20 0 FIADRP CCCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133105276 1123420549 /nfs/dbraw/zinc/42/05/49/1123420549.db2.gz YOYGSVIHMVHQFK-UXHICEINSA-N 2 0 374.569 4.407 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CCOCC1 ZINC000133422096 1123485799 /nfs/dbraw/zinc/48/57/99/1123485799.db2.gz PDTMNGUSYGJYJO-SFHVURJKSA-N 2 0 352.522 4.320 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000134013937 1123583762 /nfs/dbraw/zinc/58/37/62/1123583762.db2.gz YCPHFKMMOTUISK-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000134023765 1123585285 /nfs/dbraw/zinc/58/52/85/1123585285.db2.gz UFHRQXAQZUVVSZ-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)nn(-c3ccccc3)c2Cl)CC1 ZINC000921231360 1123593727 /nfs/dbraw/zinc/59/37/27/1123593727.db2.gz XXBMGAJBZGCZHR-UHFFFAOYSA-N 2 0 374.960 4.388 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1 ZINC000237105495 1123594376 /nfs/dbraw/zinc/59/43/76/1123594376.db2.gz GUEZANHZKLHHDL-UHFFFAOYSA-N 2 0 372.475 4.475 20 0 FIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(C(C)C)cc3C(C)C)C2)CC1 ZINC000609338381 1123674365 /nfs/dbraw/zinc/67/43/65/1123674365.db2.gz ARRUUXORIRORMF-QFIPXVFZSA-N 2 0 357.586 4.145 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(C)cc2F)c1 ZINC000079307386 1123874587 /nfs/dbraw/zinc/87/45/87/1123874587.db2.gz LEJGWAHNIPYIRD-QGZVFWFLSA-N 2 0 371.500 4.093 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4[nH]ccc43)cc2)C[C@H](C)O1 ZINC000237781223 1124075409 /nfs/dbraw/zinc/07/54/09/1124075409.db2.gz WWUDQVPUDANEND-HDICACEKSA-N 2 0 363.505 4.067 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245687159 1124195767 /nfs/dbraw/zinc/19/57/67/1124195767.db2.gz JSYFDZQTRXCCOG-BKFWDETESA-N 3 0 363.549 4.033 20 0 FIADRP COc1ccccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245689303 1124201101 /nfs/dbraw/zinc/20/11/01/1124201101.db2.gz KBBYHZGCHCPMMX-KOUNCHBCSA-N 2 0 350.506 4.023 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245756045 1124241265 /nfs/dbraw/zinc/24/12/65/1124241265.db2.gz UWDSUTWGZVLODV-JOZNFPNDSA-N 3 0 363.549 4.033 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)c1ccc2ccccc2c1 ZINC000765881159 1124326919 /nfs/dbraw/zinc/32/69/19/1124326919.db2.gz NMYMKODQZMAEFV-NGXZDTIWSA-N 2 0 374.528 4.373 20 0 FIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccs1 ZINC000246541139 1124527471 /nfs/dbraw/zinc/52/74/71/1124527471.db2.gz VXFZUAIGDOGFTA-IPMKNSEASA-N 2 0 350.572 4.193 20 0 FIADRP Cc1ncc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1-c1ccccc1 ZINC000084018089 1124560362 /nfs/dbraw/zinc/56/03/62/1124560362.db2.gz ZRNLWWVTHCYJON-UHFFFAOYSA-N 2 0 362.521 4.311 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc(OC)c1OC ZINC000247110005 1124591430 /nfs/dbraw/zinc/59/14/30/1124591430.db2.gz QLCPMLXACPDFMO-IAGOWNOFSA-N 2 0 364.530 4.018 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnn(Cc2ccccc2)c1 ZINC000247233870 1124601667 /nfs/dbraw/zinc/60/16/67/1124601667.db2.gz YLRGIQDUCOUXKQ-VQTJNVASSA-N 2 0 354.542 4.094 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H]3CCN(C)[C@@H](C)C3)s2)cc1 ZINC000247971804 1124734772 /nfs/dbraw/zinc/73/47/72/1124734772.db2.gz HKIYKLDEBJUXKO-ZQIUZPCESA-N 2 0 359.539 4.260 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1 ZINC000248001215 1124736824 /nfs/dbraw/zinc/73/68/24/1124736824.db2.gz KKMHAEVLYACEAZ-HKUYNNGSSA-N 2 0 350.572 4.075 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccs1 ZINC000248443174 1124769306 /nfs/dbraw/zinc/76/93/06/1124769306.db2.gz LIGITNKMTSMPKS-UXHICEINSA-N 2 0 358.551 4.192 20 0 FIADRP Clc1ccc(N2CCC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c(Cl)c1 ZINC000248961370 1124830524 /nfs/dbraw/zinc/83/05/24/1124830524.db2.gz BEBPRBNURUORCJ-ULQDDVLXSA-N 2 0 368.352 4.179 20 0 FIADRP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089214539 1124891353 /nfs/dbraw/zinc/89/13/53/1124891353.db2.gz QZTBSQDPJQFJDS-NRFANRHFSA-N 2 0 363.505 4.334 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000089520330 1124913065 /nfs/dbraw/zinc/91/30/65/1124913065.db2.gz ZSJVKBKDDFDEBK-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000089520318 1124913293 /nfs/dbraw/zinc/91/32/93/1124913293.db2.gz PRTDLILWIIORCH-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000090417513 1124994969 /nfs/dbraw/zinc/99/49/69/1124994969.db2.gz HVHOJONUWFKUQC-JPYJTQIMSA-N 2 0 356.554 4.278 20 0 FIADRP Cc1nc2ccccc2nc1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000476976124 1125004671 /nfs/dbraw/zinc/00/46/71/1125004671.db2.gz VNIPEFBUZKDWAY-SFHVURJKSA-N 2 0 366.553 4.415 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H](CO)c3ccc(Cl)cc3)CC2)C1 ZINC000672619102 1125195609 /nfs/dbraw/zinc/19/56/09/1125195609.db2.gz IOBFRPLVQVSKPP-HGHGUNKESA-N 2 0 364.961 4.049 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H](CO)c2ccc(Cl)cc2)CC1 ZINC000672620777 1125198208 /nfs/dbraw/zinc/19/82/08/1125198208.db2.gz ZFHKECPGXNUSJB-HGHGUNKESA-N 2 0 364.961 4.049 20 0 FIADRP C[C@H](c1cccc(O)c1)[NH+](C)C/C=C\C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000255165598 1125209143 /nfs/dbraw/zinc/20/91/43/1125209143.db2.gz CIQQRCAGPRWCLO-OSFIAYCASA-N 2 0 354.494 4.340 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(C)ccc1OC ZINC000093403369 1125320555 /nfs/dbraw/zinc/32/05/55/1125320555.db2.gz ODYAKVDWUDOLKW-FQEVSTJZSA-N 2 0 356.510 4.185 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccc(C#N)c2)ccc1OC ZINC000182353340 1125424440 /nfs/dbraw/zinc/42/44/40/1125424440.db2.gz JHNATDUKSXZQPI-KRWDZBQOSA-N 2 0 351.494 4.259 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(Cl)c2)CC1 ZINC000521430104 568030237 /nfs/dbraw/zinc/03/02/37/568030237.db2.gz OBCRNRFUCZFYCW-INIZCTEOSA-N 2 0 365.949 4.111 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)c1ccsc1 ZINC000563119849 568224614 /nfs/dbraw/zinc/22/46/14/568224614.db2.gz JPUMPQLUMXKNFC-SFTDATJTSA-N 2 0 369.578 4.138 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2cc(C)ccc2C)c1 ZINC000056184865 568583295 /nfs/dbraw/zinc/58/32/95/568583295.db2.gz KSOLKYRFVNUOBI-LJQANCHMSA-N 2 0 367.537 4.262 20 0 FIADRP CC[NH+](CC)C1CCN(c2[nH+]c(N3CCCC3)cc3ccccc32)CC1 ZINC001165054727 722006353 /nfs/dbraw/zinc/00/63/53/722006353.db2.gz ZRZYUGHZXJDPNC-UHFFFAOYSA-N 2 0 352.526 4.146 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(OC)c(O)c2)ccc1OC ZINC000182747403 1125612917 /nfs/dbraw/zinc/61/29/17/1125612917.db2.gz WGPOAIGIARSXDU-INIZCTEOSA-N 2 0 372.509 4.102 20 0 FIADRP Cc1ccccc1-c1noc([C@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)n1 ZINC000123499219 1079592762 /nfs/dbraw/zinc/59/27/62/1079592762.db2.gz FPWWGYLJOZIXJF-KRWDZBQOSA-N 2 0 356.514 4.160 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000579744268 1079607288 /nfs/dbraw/zinc/60/72/88/1079607288.db2.gz YGCGUXVJAZVIFV-MGPQQGTHSA-N 2 0 371.388 4.251 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)cc1 ZINC000620125638 1125785180 /nfs/dbraw/zinc/78/51/80/1125785180.db2.gz ZUHXUURUNOJDIF-UHFFFAOYSA-N 2 0 356.510 4.094 20 0 FIADRP CCC(CC)[N@H+](C[C@@H]1CCCN(C)C1)C1CCN(Cc2ccccc2)CC1 ZINC001208614978 1080016961 /nfs/dbraw/zinc/01/69/61/1080016961.db2.gz GJJZRYNJGZMXSN-JOCHJYFZSA-N 2 0 371.613 4.483 20 0 FIADRP CC[N@H+](CC1(COC)CCC1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000463108505 1080027850 /nfs/dbraw/zinc/02/78/50/1080027850.db2.gz WOVGMUINLPGDHV-UHFFFAOYSA-N 2 0 374.573 4.016 20 0 FIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCCCn1ccnc1 ZINC000079923462 1080522416 /nfs/dbraw/zinc/52/24/16/1080522416.db2.gz JTJBSCSVQBUILP-UHFFFAOYSA-N 2 0 371.916 4.416 20 0 FIADRP CCOc1cc(C[NH2+]C[C@@H]2CC[N@H+](CC)C2)ccc1OCc1ccccc1 ZINC000120783443 1080651683 /nfs/dbraw/zinc/65/16/83/1080651683.db2.gz KJLKBTJWAJJFPH-NRFANRHFSA-N 2 0 368.521 4.096 20 0 FIADRP Cc1nccn1CC[NH2+]Cc1sc(Sc2ccccc2)nc1Cl ZINC000748095549 1080657550 /nfs/dbraw/zinc/65/75/50/1080657550.db2.gz IGJRPKIDNFWDGY-UHFFFAOYSA-N 2 0 364.927 4.242 20 0 FIADRP CCn1nc(C)c(C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)c1C ZINC000533583910 1080752115 /nfs/dbraw/zinc/75/21/15/1080752115.db2.gz NMKNZVIOUCWKFF-UHFFFAOYSA-N 2 0 368.569 4.302 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000237066213 1080920898 /nfs/dbraw/zinc/92/08/98/1080920898.db2.gz YZYBOYJGANQPCI-UHFFFAOYSA-N 2 0 371.956 4.156 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c(-c2ccnn2C)c1 ZINC001648810959 1081123644 /nfs/dbraw/zinc/12/36/44/1081123644.db2.gz AKXLYAARWDRJOI-PMACEKPBSA-N 2 0 368.569 4.243 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)C3)cc1 ZINC000655788840 1081201659 /nfs/dbraw/zinc/20/16/59/1081201659.db2.gz PYZDMZDNWMKKNY-SPHOGXRMSA-N 2 0 354.538 4.119 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc2c(cnn2C(C)C)c1 ZINC000530952997 1081226730 /nfs/dbraw/zinc/22/67/30/1081226730.db2.gz LWVRSPIOYMVOOY-QUCCMNQESA-N 2 0 357.546 4.002 20 0 FIADRP Cc1nn(-c2ccccc2F)cc1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC001648817035 1081239355 /nfs/dbraw/zinc/23/93/55/1081239355.db2.gz RMDLWOMVWFEBDL-KRWDZBQOSA-N 2 0 358.505 4.064 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397573041 1081261212 /nfs/dbraw/zinc/26/12/12/1081261212.db2.gz ZNBFREQSHMXRTA-HSZRJFAPSA-N 2 0 366.549 4.317 20 0 FIADRP CCSc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccn1 ZINC000547979461 1081316314 /nfs/dbraw/zinc/31/63/14/1081316314.db2.gz QYUKPSSLLQGEJC-XLIONFOSSA-N 2 0 355.551 4.194 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1cccc2nccn21)C1CCCCC1 ZINC001648891703 1081354918 /nfs/dbraw/zinc/35/49/18/1081354918.db2.gz PPJUABNERIEAED-UHFFFAOYSA-N 2 0 362.521 4.389 20 0 FIADRP O=C(CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccccc1 ZINC000312591119 1081374932 /nfs/dbraw/zinc/37/49/32/1081374932.db2.gz WZLUJVYYWSHAKI-UHFFFAOYSA-N 2 0 362.517 4.248 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000397682212 1081431462 /nfs/dbraw/zinc/43/14/62/1081431462.db2.gz MDSPDLNVVWNLPK-OAQYLSRUSA-N 2 0 372.940 4.408 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1ccc2cnccc2c1 ZINC000683771613 1081532683 /nfs/dbraw/zinc/53/26/83/1081532683.db2.gz XGLGZNQMGMOABG-OALUTQOASA-N 2 0 359.517 4.481 20 0 FIADRP Cn1ccnc1C[C@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1 ZINC000683772642 1081534416 /nfs/dbraw/zinc/53/44/16/1081534416.db2.gz NVMPEOVUDDCFMT-KRWDZBQOSA-N 2 0 364.474 4.210 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2cccc(C(=O)Nc3ccccc3)c2)CC1 ZINC000118868243 1081556255 /nfs/dbraw/zinc/55/62/55/1081556255.db2.gz KGUQHKDDWUJLGK-UHFFFAOYSA-N 2 0 365.521 4.103 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000683816218 1081618481 /nfs/dbraw/zinc/61/84/81/1081618481.db2.gz NBZSUICJKYXKQM-NWSQWKLXSA-N 2 0 352.522 4.264 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000580249320 1081779925 /nfs/dbraw/zinc/77/99/25/1081779925.db2.gz CICCOUJTKOCEOC-CVDCTZTESA-N 2 0 350.506 4.053 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000471619845 1082161579 /nfs/dbraw/zinc/16/15/79/1082161579.db2.gz ODXDOEAOIUQDOX-ROUUACIJSA-N 2 0 357.567 4.092 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000127561842 1082226178 /nfs/dbraw/zinc/22/61/78/1082226178.db2.gz LJNILNBFIGFADB-AZUAARDMSA-N 2 0 360.542 4.160 20 0 FIADRP Cc1ccn(-c2ccccc2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000127580506 1082228828 /nfs/dbraw/zinc/22/88/28/1082228828.db2.gz MHWCLYXETQYXAB-UHFFFAOYSA-N 2 0 352.526 4.067 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000581065785 1082299009 /nfs/dbraw/zinc/29/90/09/1082299009.db2.gz SQHBENKWWHGBCY-BUNACBEFSA-N 2 0 372.896 4.060 20 0 FIADRP C[NH+](C)CCc1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000581489004 1082618161 /nfs/dbraw/zinc/61/81/61/1082618161.db2.gz JJNFSBKKKPZMJW-HSZRJFAPSA-N 2 0 363.549 4.400 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)C[C@@H](C)C1(F)F ZINC000625653338 1082741196 /nfs/dbraw/zinc/74/11/96/1082741196.db2.gz IWAWVRDXCPSICU-RUPPMWDTSA-N 2 0 352.460 4.213 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)C1 ZINC000647171287 1082772734 /nfs/dbraw/zinc/77/27/34/1082772734.db2.gz DWSYSRXXEMEJEB-JTHBVZDNSA-N 2 0 369.597 4.285 20 0 FIADRP COC[C@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000559095522 1082902006 /nfs/dbraw/zinc/90/20/06/1082902006.db2.gz ZJLVBAAOEGNECP-BUHWKMJWSA-N 2 0 350.934 4.126 20 0 FIADRP CN1CCC[C@H](C[NH2+][C@@H]2CCSC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000130379453 1082919735 /nfs/dbraw/zinc/91/97/35/1082919735.db2.gz ZDAXOPCWIBHVSS-OIISXLGYSA-N 2 0 358.473 4.183 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)CCO2 ZINC000178221882 1082988330 /nfs/dbraw/zinc/98/83/30/1082988330.db2.gz HWWINECOMPODEY-INIZCTEOSA-N 2 0 356.535 4.246 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H](Cc2ccccc2)c2ccc(OC)cc2)CC1 ZINC000581914058 1083035661 /nfs/dbraw/zinc/03/56/61/1083035661.db2.gz MLMAWCLTMOTEQA-HSZRJFAPSA-N 2 0 352.522 4.443 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccc(F)cc1 ZINC000090971303 1083096609 /nfs/dbraw/zinc/09/66/09/1083096609.db2.gz WKQXCVAPQKVHKP-SFHVURJKSA-N 2 0 367.512 4.209 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]CCSCc3ccccc3)CC2)c1 ZINC000430755229 1083152707 /nfs/dbraw/zinc/15/27/07/1083152707.db2.gz ONGOHRPUHHPMEF-UHFFFAOYSA-N 2 0 360.592 4.483 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC([C@H](C)[NH3+])CC2)c1 ZINC000430965544 1083260610 /nfs/dbraw/zinc/26/06/10/1083260610.db2.gz KEIGURBZBPIYQS-PGRDOPGGSA-N 2 0 365.521 4.042 20 0 FIADRP C[C@@H]1[C@H](C(F)(F)F)CC[NH+]1CCCC[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000548427664 1083298044 /nfs/dbraw/zinc/29/80/44/1083298044.db2.gz XGNFURTYHORUTP-SYQHCUMBSA-N 2 0 360.386 4.312 20 0 FIADRP COc1ccc(F)c(F)c1C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001143413981 1083350466 /nfs/dbraw/zinc/35/04/66/1083350466.db2.gz XHSGAWPCUZVCMG-UHFFFAOYSA-N 2 0 372.459 4.071 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCSCC1 ZINC000658319169 1083406617 /nfs/dbraw/zinc/40/66/17/1083406617.db2.gz XWYDAVIWOOFKDC-WIYYLYMNSA-N 2 0 358.595 4.410 20 0 FIADRP COc1cccc(C2([NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)CCC2)c1 ZINC000658324185 1083409742 /nfs/dbraw/zinc/40/97/42/1083409742.db2.gz ZMCXJFKVYGTTSS-GOSISDBHSA-N 2 0 368.521 4.366 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(Br)cs1 ZINC000658354095 1083426511 /nfs/dbraw/zinc/42/65/11/1083426511.db2.gz WYIVMXMSSFYOPD-LBPRGKRZSA-N 2 0 357.361 4.283 20 0 FIADRP [NH3+][C@H](CCC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000582001095 1083475482 /nfs/dbraw/zinc/47/54/82/1083475482.db2.gz WKJOMGQSTLYPFQ-JOCHJYFZSA-N 2 0 365.521 4.134 20 0 FIADRP Cc1nccn1CCC[NH2+][C@H]1CCc2c1cc(Br)cc2Cl ZINC000510946559 1083523910 /nfs/dbraw/zinc/52/39/10/1083523910.db2.gz PDICQBZTSXSEHI-INIZCTEOSA-N 2 0 368.706 4.275 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@@H]([NH3+])c3ccccc3)c2C1 ZINC000236720975 1083973002 /nfs/dbraw/zinc/97/30/02/1083973002.db2.gz LAPMCMBFUCWNNV-HXUWFJFHSA-N 2 0 351.494 4.077 20 0 FIADRP Clc1ccc(C[C@@H](NCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000511381873 1084101971 /nfs/dbraw/zinc/10/19/71/1084101971.db2.gz KFGUYLILJBXOGV-OAQYLSRUSA-N 2 0 357.929 4.484 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)C1CC[NH+](C)CC1 ZINC000684677898 1084200069 /nfs/dbraw/zinc/20/00/69/1084200069.db2.gz IULDLAWAFHSFEC-RCBQFDQVSA-N 2 0 369.322 4.154 20 0 FIADRP FC(F)(F)c1ccccc1OCC[NH+]1CCC(Nc2ccccn2)CC1 ZINC000536370858 1084213362 /nfs/dbraw/zinc/21/33/62/1084213362.db2.gz MRFDYQAGZWZVNT-UHFFFAOYSA-N 2 0 365.399 4.056 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@@H]3CCCC[NH+]3C)cc2)C1 ZINC000431755846 1084409543 /nfs/dbraw/zinc/40/95/43/1084409543.db2.gz DWRSWJJOIHACBY-RXVVDRJESA-N 2 0 357.542 4.122 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cc2n(n1)CCC2 ZINC000414071837 1084439664 /nfs/dbraw/zinc/43/96/64/1084439664.db2.gz UOCWUVXJZULVIE-SFHVURJKSA-N 2 0 374.532 4.409 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2c(C3CC3)cnn2C)C1 ZINC000657312873 1084449192 /nfs/dbraw/zinc/44/91/92/1084449192.db2.gz OXLAUKROGBKWER-HDICACEKSA-N 2 0 366.553 4.065 20 0 FIADRP CCCn1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000657314071 1084454819 /nfs/dbraw/zinc/45/48/19/1084454819.db2.gz RANORTNQXIRPEN-OALUTQOASA-N 2 0 354.542 4.061 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1csc(-c2ccccc2)n1 ZINC000414106887 1084579933 /nfs/dbraw/zinc/57/99/33/1084579933.db2.gz YARHSHDONTXDKO-KURKYZTESA-N 2 0 373.566 4.350 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000414173487 1084738962 /nfs/dbraw/zinc/73/89/62/1084738962.db2.gz FSFJQVJXAJLVNI-UWJYYQICSA-N 2 0 357.929 4.340 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000414173475 1084739139 /nfs/dbraw/zinc/73/91/39/1084739139.db2.gz FSFJQVJXAJLVNI-DYESRHJHSA-N 2 0 357.929 4.340 20 0 FIADRP C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000414239800 1084889265 /nfs/dbraw/zinc/88/92/65/1084889265.db2.gz ZDTBSLPFIWMDEY-KRWDZBQOSA-N 2 0 355.526 4.170 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cc2ccccc2o1 ZINC000582426276 1084988971 /nfs/dbraw/zinc/98/89/71/1084988971.db2.gz IFTPMOUMERBAOT-JOCHJYFZSA-N 2 0 367.493 4.255 20 0 FIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657430780 1085009256 /nfs/dbraw/zinc/00/92/56/1085009256.db2.gz RABNLSMRQXXRIA-CQSZACIVSA-N 2 0 360.383 4.007 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+]CCCCC[NH+]3CCCC3)cn2)cc1 ZINC000657475077 1085174485 /nfs/dbraw/zinc/17/44/85/1085174485.db2.gz ZSFMQACGTIALSB-UHFFFAOYSA-N 2 0 357.473 4.369 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+]C1CCC2(CC1)OCCO2)C1CCCCC1 ZINC000161337190 1085232571 /nfs/dbraw/zinc/23/25/71/1085232571.db2.gz BFEPAEYVXHKUHL-UHFFFAOYSA-N 2 0 372.553 4.226 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000684954690 1085299745 /nfs/dbraw/zinc/29/97/45/1085299745.db2.gz CRLMXRLSXFZDRM-AVRDEDQJSA-N 2 0 368.496 4.323 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]CCCC[NH+]2CCC(C)CC2)c2ccccc21 ZINC000549526048 1085342049 /nfs/dbraw/zinc/34/20/49/1085342049.db2.gz HAJHQXMUHFJJNE-YADHBBJMSA-N 2 0 372.553 4.270 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000549528117 1085364558 /nfs/dbraw/zinc/36/45/58/1085364558.db2.gz SETIYOWSJLULMH-FGZHOGPDSA-N 2 0 366.505 4.020 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651720623 1085412056 /nfs/dbraw/zinc/41/20/56/1085412056.db2.gz GKRSYZYIHYXSFU-HSALFYBXSA-N 2 0 367.537 4.289 20 0 FIADRP Cc1cc2cc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)oc2cc1C ZINC000657535150 1085443909 /nfs/dbraw/zinc/44/39/09/1085443909.db2.gz GSWOXTJQYFOOKZ-UHFFFAOYSA-N 2 0 356.510 4.030 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000236871092 1085631989 /nfs/dbraw/zinc/63/19/89/1085631989.db2.gz OQENPMOBOWCHJH-QGZVFWFLSA-N 2 0 366.534 4.032 20 0 FIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)c1 ZINC000657613729 1085699882 /nfs/dbraw/zinc/69/98/82/1085699882.db2.gz PYLJUQIYBFOHJW-JTHBVZDNSA-N 2 0 364.537 4.005 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cc3c(ccc(C)c3C)[nH]2)CC1 ZINC000473134328 1085736416 /nfs/dbraw/zinc/73/64/16/1085736416.db2.gz XSWITTSALFYBEN-UHFFFAOYSA-N 2 0 357.542 4.108 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000153490037 1085823798 /nfs/dbraw/zinc/82/37/98/1085823798.db2.gz QHYRBYOGAZIVLP-DVECYGJZSA-N 2 0 372.516 4.144 20 0 FIADRP Brc1cccc(C[NH+]2CCC(C[NH2+][C@@H]3C[C@H]4C[C@H]4C3)CC2)c1 ZINC001167913166 1085919555 /nfs/dbraw/zinc/91/95/55/1085919555.db2.gz MKDKTYGAFVWHSC-IZZQQSIFSA-N 2 0 363.343 4.049 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC000652348697 1085924172 /nfs/dbraw/zinc/92/41/72/1085924172.db2.gz NVZVQCSMMNRVLT-ZRBLBEILSA-N 2 0 356.554 4.453 20 0 FIADRP CN(CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)c1ccccc1 ZINC001167646578 1086009730 /nfs/dbraw/zinc/00/97/30/1086009730.db2.gz FKJDLBKNWSNSFQ-ISKFKSNPSA-N 2 0 363.549 4.109 20 0 FIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(OCc4ccc(F)cc4)cc3)CC[C@H]21 ZINC001167648329 1086027592 /nfs/dbraw/zinc/02/75/92/1086027592.db2.gz SMCFXJIYYUDDTP-NZQKXSOJSA-N 2 0 368.496 4.321 20 0 FIADRP Clc1ccc(SCC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000466912082 1086066615 /nfs/dbraw/zinc/06/66/15/1086066615.db2.gz CWFQNLVHCRTGMW-UHFFFAOYSA-N 2 0 368.974 4.009 20 0 FIADRP COc1ccccc1-c1nc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)cs1 ZINC000662295111 1086399503 /nfs/dbraw/zinc/39/95/03/1086399503.db2.gz SXGGNXVIHUJBDS-KRWDZBQOSA-N 2 0 371.550 4.030 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@@H]1CCC[NH3+] ZINC000662316532 1086414733 /nfs/dbraw/zinc/41/47/33/1086414733.db2.gz WSVQTWKDLVWVNN-XMSQKQJNSA-N 2 0 365.521 4.278 20 0 FIADRP C[C@H](c1ccc(F)cc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662326733 1086419017 /nfs/dbraw/zinc/41/90/17/1086419017.db2.gz AYMXWXSHJCPEKN-CQSZACIVSA-N 2 0 374.479 4.096 20 0 FIADRP C[C@H](c1cc(F)ccc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327712 1086419060 /nfs/dbraw/zinc/41/90/60/1086419060.db2.gz LJKINXUYFMWJAO-CQSZACIVSA-N 2 0 374.479 4.096 20 0 FIADRP FC(F)c1ccc(C[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)cc1 ZINC000662327524 1086419108 /nfs/dbraw/zinc/41/91/08/1086419108.db2.gz QQCGBOWQGAWBPO-UHFFFAOYSA-N 2 0 374.479 4.194 20 0 FIADRP Cc1ccc(C[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c(Cl)c1 ZINC000662326867 1086419228 /nfs/dbraw/zinc/41/92/28/1086419228.db2.gz FOHCFNPPZXSLPO-UHFFFAOYSA-N 2 0 372.944 4.218 20 0 FIADRP CN(C)Cc1cnc(C[NH2+]C(C)(C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000511969392 1086436032 /nfs/dbraw/zinc/43/60/32/1086436032.db2.gz CIWXDXUQWUEYGT-UHFFFAOYSA-N 2 0 371.472 4.334 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535987982 1086529601 /nfs/dbraw/zinc/52/96/01/1086529601.db2.gz PGCGMUFLPKVUBP-HNAYVOBHSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(Br)cs1 ZINC000663465833 1086565609 /nfs/dbraw/zinc/56/56/09/1086565609.db2.gz LRVLCSPCXWZJRZ-OCCSQVGLSA-N 2 0 357.361 4.283 20 0 FIADRP c1csc([C@H](Cc2ccncc2)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000663467040 1086569199 /nfs/dbraw/zinc/56/91/99/1086569199.db2.gz ZFCATSARAAPNIX-PMACEKPBSA-N 2 0 355.551 4.139 20 0 FIADRP CCn1nccc1C[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000663469681 1086576799 /nfs/dbraw/zinc/57/67/99/1086576799.db2.gz LOTFRCGOSDYZDQ-QFIPXVFZSA-N 2 0 372.532 4.385 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC([N@H+](CC)Cc2ccccc2)CC1 ZINC001167826533 1086616718 /nfs/dbraw/zinc/61/67/18/1086616718.db2.gz PTTVOPNKYQIHJD-NRFANRHFSA-N 3 0 359.602 4.483 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2ccc(F)c(-c3cccs3)c2)CCCO1 ZINC000432355965 1086655462 /nfs/dbraw/zinc/65/54/62/1086655462.db2.gz AMYOTLIXTKZROU-MRXNPFEDSA-N 2 0 362.514 4.145 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-n3cccn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000080338789 1086675192 /nfs/dbraw/zinc/67/51/92/1086675192.db2.gz UCPFJBOKVJZOSK-KNQAVFIVSA-N 2 0 360.505 4.015 20 0 FIADRP CCOc1ccc(NC2CC[NH+]([C@@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167834690 1086687665 /nfs/dbraw/zinc/68/76/65/1086687665.db2.gz LYJWTDISBCSZER-IBGZPJMESA-N 2 0 361.574 4.472 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2nc3ccccc3n2C)CC1 ZINC001167838377 1086710980 /nfs/dbraw/zinc/71/09/80/1086710980.db2.gz UDBDHYXIOUYMME-SFHVURJKSA-N 2 0 356.558 4.263 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC1)CC(=O)c1cc(C)ccc1O2 ZINC001167837913 1086711848 /nfs/dbraw/zinc/71/18/48/1086711848.db2.gz NTFRNFYXGNYOKF-LJQANCHMSA-N 2 0 372.553 4.305 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CCCO1 ZINC000432422560 1086747152 /nfs/dbraw/zinc/74/71/52/1086747152.db2.gz FUVMRCOJSCPNJG-GUYCJALGSA-N 2 0 357.325 4.071 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CCCO1 ZINC000432427658 1086757902 /nfs/dbraw/zinc/75/79/02/1086757902.db2.gz DEAAFLUMQFXEHA-CVDCTZTESA-N 2 0 370.512 4.200 20 0 FIADRP CCOC1CC([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000549626058 1086758117 /nfs/dbraw/zinc/75/81/17/1086758117.db2.gz QVOJYYHOLUBJDV-WKYDCOPISA-N 2 0 362.945 4.411 20 0 FIADRP CC1(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)COC1 ZINC000512123307 1086792666 /nfs/dbraw/zinc/79/26/66/1086792666.db2.gz NYJBMSONTZRKPO-UHFFFAOYSA-N 2 0 350.506 4.076 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657773614 1086829700 /nfs/dbraw/zinc/82/97/00/1086829700.db2.gz UDTYLCVBBCTCEZ-NRFANRHFSA-N 2 0 374.532 4.035 20 0 FIADRP C[C@H](C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1)c1ccc(C(F)(F)F)cc1 ZINC000650724480 1086836727 /nfs/dbraw/zinc/83/67/27/1086836727.db2.gz HAVLNZVUDXXYLF-ZWQIFLOQSA-N 2 0 370.459 4.170 20 0 FIADRP CCO[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000583660778 1086903256 /nfs/dbraw/zinc/90/32/56/1086903256.db2.gz MDMYYOSXXNQVBZ-UEVCKROQSA-N 2 0 352.522 4.264 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCc2cc(Br)cc(C)c21 ZINC000650756460 1086967685 /nfs/dbraw/zinc/96/76/85/1086967685.db2.gz BETZICGGACKQJS-SFHVURJKSA-N 2 0 359.311 4.254 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650763751 1086993313 /nfs/dbraw/zinc/99/33/13/1086993313.db2.gz IVHYGSAZDPOEPH-QGZVFWFLSA-N 2 0 359.514 4.306 20 0 FIADRP COCc1cc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)ccc1F ZINC000151205768 1087039508 /nfs/dbraw/zinc/03/95/08/1087039508.db2.gz MAUXXBZDOPKCBB-HNNXBMFYSA-N 2 0 353.441 4.317 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(-n2ccnc2)c1 ZINC000151661209 1087197087 /nfs/dbraw/zinc/19/70/87/1087197087.db2.gz MMKSWGMPYICNTE-SFHVURJKSA-N 2 0 352.526 4.320 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2cc1OC ZINC000657839566 1087267417 /nfs/dbraw/zinc/26/74/17/1087267417.db2.gz CEOWKLFVPGAGOZ-YSSFQJQWSA-N 2 0 354.494 4.134 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3cc(OC)c(OC)cc3c2)C1 ZINC000657845357 1087291569 /nfs/dbraw/zinc/29/15/69/1087291569.db2.gz NJAPFPCXTFDFPG-DLBZAZTESA-N 2 0 356.510 4.240 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000090707605 1087413628 /nfs/dbraw/zinc/41/36/28/1087413628.db2.gz RKNQHWCNIRMLHT-UHFFFAOYSA-N 2 0 363.977 4.014 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC1 ZINC000091285068 1087426785 /nfs/dbraw/zinc/42/67/85/1087426785.db2.gz JSILWYYUBRJTBL-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP CCOC1CCC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000657880069 1087524744 /nfs/dbraw/zinc/52/47/44/1087524744.db2.gz KSRPODWJPWRGKR-UHFFFAOYSA-N 2 0 364.961 4.489 20 0 FIADRP CCOC1CCC([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000657888659 1087544325 /nfs/dbraw/zinc/54/43/25/1087544325.db2.gz NGHZKWQCOJHALC-UHFFFAOYSA-N 2 0 356.510 4.349 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccc5cnccc5c4)C3)C2)cc1 ZINC000685443045 1087569165 /nfs/dbraw/zinc/56/91/65/1087569165.db2.gz KYLFULFSFIJGJY-DEOSSOPVSA-N 2 0 357.501 4.333 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000708567397 1087587040 /nfs/dbraw/zinc/58/70/40/1087587040.db2.gz AYRDENNWAUIKEL-ZRCGQRJVSA-N 2 0 366.549 4.374 20 0 FIADRP CC[NH+](C/C=C\C[N@@H+](CC)[C@@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685589914 1087634631 /nfs/dbraw/zinc/63/46/31/1087634631.db2.gz AEFZJLHSTRAIRH-BHGRFLGOSA-N 2 0 366.590 4.102 20 0 FIADRP CC[NH+](CC(C)C[N@@H+](CC)[C@@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685590228 1087634992 /nfs/dbraw/zinc/63/49/92/1087634992.db2.gz NAAGKURMOCFGEF-WOJBJXKFSA-N 2 0 368.606 4.182 20 0 FIADRP CC[NH+](CC(C)C[N@@H+](CC)[C@H]1CCOC(C)(C)C1)[C@H]1CCOC(C)(C)C1 ZINC000685590227 1087635244 /nfs/dbraw/zinc/63/52/44/1087635244.db2.gz NAAGKURMOCFGEF-PMACEKPBSA-N 2 0 368.606 4.182 20 0 FIADRP Fc1ccc(C2=CC[C@H]([NH2+]CC3CC[NH+](C4CCOCC4)CC3)CC2)cc1 ZINC000658067717 1087709809 /nfs/dbraw/zinc/70/98/09/1087709809.db2.gz PSFJPXZMMGAUFC-QFIPXVFZSA-N 2 0 372.528 4.242 20 0 FIADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658066491 1087709919 /nfs/dbraw/zinc/70/99/19/1087709919.db2.gz BAJUDDHAYBFSIY-GOTSBHOMSA-N 2 0 356.554 4.112 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(F)c(F)c1 ZINC000658136382 1087724858 /nfs/dbraw/zinc/72/48/58/1087724858.db2.gz GYXYEVUFTKRUHK-SIKLNZKXSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccnc4ccccc34)CC2)C1 ZINC000658125363 1087732117 /nfs/dbraw/zinc/73/21/17/1087732117.db2.gz BFJJAIOGLJLVSH-WIYYLYMNSA-N 2 0 351.538 4.410 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000658143154 1087734762 /nfs/dbraw/zinc/73/47/62/1087734762.db2.gz XBLBTDVJRHGEAL-WZONZLPQSA-N 2 0 352.522 4.057 20 0 FIADRP Cc1cc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)ccc1Oc1cccnc1 ZINC000414772265 1087738708 /nfs/dbraw/zinc/73/87/08/1087738708.db2.gz BOPVSHIKQGYFLG-UXHICEINSA-N 2 0 351.494 4.004 20 0 FIADRP CC1(C)CC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c2ccccc21 ZINC000658138412 1087743602 /nfs/dbraw/zinc/74/36/02/1087743602.db2.gz MXSKEEOFZTZICA-OFNKIYASSA-N 2 0 364.533 4.156 20 0 FIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658139908 1087744085 /nfs/dbraw/zinc/74/40/85/1087744085.db2.gz NZXVBPPOEODDBD-PXNSSMCTSA-N 2 0 364.489 4.159 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCS2 ZINC000658163708 1087757615 /nfs/dbraw/zinc/75/76/15/1087757615.db2.gz ABXXCRGGORZPET-FQEVSTJZSA-N 2 0 371.525 4.259 20 0 FIADRP C[C@]1(c2ccccc2)CC[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000658168109 1087762804 /nfs/dbraw/zinc/76/28/04/1087762804.db2.gz VUFGICHDZAYAPO-ZEQRLZLVSA-N 2 0 363.549 4.394 20 0 FIADRP Cc1ccc(C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658167865 1087763931 /nfs/dbraw/zinc/76/39/31/1087763931.db2.gz UNPPZUQXAXBYEJ-XMMPIXPASA-N 2 0 363.549 4.213 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc(OCC[NH+](C)C)c1 ZINC000658172508 1087766773 /nfs/dbraw/zinc/76/67/73/1087766773.db2.gz WEZVUXBSNGDUEZ-MRXNPFEDSA-N 2 0 372.484 4.158 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658206285 1087793483 /nfs/dbraw/zinc/79/34/83/1087793483.db2.gz IJJUEBKCPZCTPM-UQAQOTMJSA-N 2 0 364.533 4.059 20 0 FIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000504896669 1087968916 /nfs/dbraw/zinc/96/89/16/1087968916.db2.gz ZDYQTFLXIBOYHO-WMZHIEFXSA-N 2 0 363.549 4.081 20 0 FIADRP C[C@@H]([NH3+])c1ccc(CNCc2cc(Cl)ccc2Br)cc1 ZINC000414808155 1088178772 /nfs/dbraw/zinc/17/87/72/1088178772.db2.gz KKFWCVCUVSHYDR-LLVKDONJSA-N 2 0 353.691 4.412 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@H](C[NH3+])c2ccc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000423385591 1088183899 /nfs/dbraw/zinc/18/38/99/1088183899.db2.gz GRUWOCIHMFERQW-RBZQAINGSA-N 2 0 359.517 4.265 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cn(C)nc2-c2ccccc2Cl)cc1 ZINC000414815893 1088247263 /nfs/dbraw/zinc/24/72/63/1088247263.db2.gz YSGQQCQVNZDOTC-CQSZACIVSA-N 2 0 354.885 4.050 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Br)c(Cl)c2)cc1 ZINC000414819627 1088273592 /nfs/dbraw/zinc/27/35/92/1088273592.db2.gz ZDUAKJLAMLYRIS-LLVKDONJSA-N 2 0 353.691 4.412 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000311799330 1088728112 /nfs/dbraw/zinc/72/81/12/1088728112.db2.gz NEFMSHVYYFZOMY-IBGZPJMESA-N 2 0 352.522 4.128 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000514093587 1088739902 /nfs/dbraw/zinc/73/99/02/1088739902.db2.gz JTYISLIFZNNKKL-AUSIDOKSSA-N 2 0 367.537 4.228 20 0 FIADRP Cc1cc(C[NH+]2CCC3(CCC[N@H+](CCCC(F)(F)F)C3)CC2)on1 ZINC001280063596 1088746075 /nfs/dbraw/zinc/74/60/75/1088746075.db2.gz AAMNMBILTWCXDX-UHFFFAOYSA-N 2 0 359.436 4.004 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)c1 ZINC000514101133 1088746927 /nfs/dbraw/zinc/74/69/27/1088746927.db2.gz ZBFWQYCYAFLGGX-JFIYKMOQSA-N 2 0 354.416 4.253 20 0 FIADRP CO[C@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000514146329 1088797156 /nfs/dbraw/zinc/79/71/56/1088797156.db2.gz WVKIABNBLQBMGE-OAQYLSRUSA-N 2 0 373.928 4.271 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000415020305 1089047136 /nfs/dbraw/zinc/04/71/36/1089047136.db2.gz WZMTXXXTBCDCNB-JTQLQIEISA-N 2 0 353.226 4.075 20 0 FIADRP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415055311 1089098751 /nfs/dbraw/zinc/09/87/51/1089098751.db2.gz OGXAQEUJYPAFDK-UTKZUKDTSA-N 2 0 353.510 4.036 20 0 FIADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000415080265 1089134619 /nfs/dbraw/zinc/13/46/19/1089134619.db2.gz JDIJINLUOGXWOK-RHSMWYFYSA-N 2 0 370.368 4.078 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000415083146 1089140024 /nfs/dbraw/zinc/14/00/24/1089140024.db2.gz MZCTZVFJFWZNLJ-SJLPKXTDSA-N 2 0 358.555 4.038 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000415085895 1089146568 /nfs/dbraw/zinc/14/65/68/1089146568.db2.gz IYJODWJZXWIHNT-ZWKOTPCHSA-N 2 0 369.509 4.140 20 0 FIADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000415093802 1089153763 /nfs/dbraw/zinc/15/37/63/1089153763.db2.gz WCGCHMJKUGGZNW-GOEBONIOSA-N 2 0 371.352 4.162 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC([C@@H]4C[C@H]([NH3+])CCO4)CC3)s2)cc1 ZINC000415127311 1089180399 /nfs/dbraw/zinc/18/03/99/1089180399.db2.gz QXJOAKCAPGGWQE-CTNGQTDRSA-N 2 0 370.562 4.442 20 0 FIADRP Cc1ccc(-c2cccc(C[NH+]3CCC([C@H]4C[C@@H]([NH3+])CCO4)CC3)c2)cc1 ZINC000415126089 1089180972 /nfs/dbraw/zinc/18/09/72/1089180972.db2.gz PCUFXKGOXFUNGU-BJKOFHAPSA-N 2 0 364.533 4.380 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000415127270 1089180996 /nfs/dbraw/zinc/18/09/96/1089180996.db2.gz QRPVLSLESQHJEI-WZONZLPQSA-N 2 0 370.537 4.494 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3)CC2)C1 ZINC000415130258 1089195259 /nfs/dbraw/zinc/19/52/59/1089195259.db2.gz WOKSBOWIKROKAL-PKTZIBPZSA-N 2 0 350.506 4.072 20 0 FIADRP CCC[C@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000415135697 1089198558 /nfs/dbraw/zinc/19/85/58/1089198558.db2.gz QICRAWWMLZMNLV-HSZRJFAPSA-N 2 0 365.565 4.153 20 0 FIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CCC[NH2+]C1 ZINC000414863735 1089204065 /nfs/dbraw/zinc/20/40/65/1089204065.db2.gz YBHPQVLMNHKONJ-JQWIXIFHSA-N 2 0 354.338 4.202 20 0 FIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000549201424 1089216482 /nfs/dbraw/zinc/21/64/82/1089216482.db2.gz KDAHSVWQEOYZEH-HXUWFJFHSA-N 2 0 350.934 4.225 20 0 FIADRP C[NH+](C)C[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000549236689 1089309725 /nfs/dbraw/zinc/30/97/25/1089309725.db2.gz DNZKPMVFZUFKOF-QFIPXVFZSA-N 2 0 371.956 4.197 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C[C@H](C)O1 ZINC000549236938 1089310922 /nfs/dbraw/zinc/31/09/22/1089310922.db2.gz IQBLJMBOHYODJC-XSQFVWFVSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@H](CC1CCOCC1)C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435424761 1089640298 /nfs/dbraw/zinc/64/02/98/1089640298.db2.gz ALLWPVVKIBTRRC-YLJYHZDGSA-N 2 0 362.583 4.145 20 0 FIADRP c1ccc2c(c1)NCCC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000515331786 1089969972 /nfs/dbraw/zinc/96/99/72/1089969972.db2.gz AOXFJMBDQRRDGF-QHCPKHFHSA-N 2 0 365.521 4.198 20 0 FIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]CCCNCc1cccnc1 ZINC000414874580 1089980368 /nfs/dbraw/zinc/98/03/68/1089980368.db2.gz IGMYKJPQJGZUEQ-AWEZNQCLSA-N 2 0 352.309 4.089 20 0 FIADRP FC(F)(F)c1ccccc1OCC1CC[NH+](CCCn2ccnc2)CC1 ZINC000187840193 1090069386 /nfs/dbraw/zinc/06/93/86/1090069386.db2.gz YCBGAOQYQHQDDV-UHFFFAOYSA-N 2 0 367.415 4.083 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccc(-n2ccnc2)cc1 ZINC000378402490 1090346989 /nfs/dbraw/zinc/34/69/89/1090346989.db2.gz LVKSEXYNQWJGJU-KRWDZBQOSA-N 2 0 357.461 4.124 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cn(C)nc2C)cc1C[NH+]1CCCCC1 ZINC000182827840 1090376093 /nfs/dbraw/zinc/37/60/93/1090376093.db2.gz GTMMSQDOKUQJJI-DLBZAZTESA-N 2 0 370.541 4.135 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(C#N)cc2F)ccc1OC ZINC000182857275 1090378182 /nfs/dbraw/zinc/37/81/82/1090378182.db2.gz SBBBHFPVSQWATF-INIZCTEOSA-N 2 0 369.484 4.399 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312366426 1090626574 /nfs/dbraw/zinc/62/65/74/1090626574.db2.gz ADSRSPXZJDBOSG-JPYJTQIMSA-N 2 0 368.521 4.267 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(Br)cc(C)c32)CC1 ZINC000584756266 1090836615 /nfs/dbraw/zinc/83/66/15/1090836615.db2.gz TVNMEAAPLLUQFT-QGZVFWFLSA-N 2 0 351.332 4.066 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3cc(Br)cc(C)c32)CC1 ZINC000584756265 1090837007 /nfs/dbraw/zinc/83/70/07/1090837007.db2.gz TVNMEAAPLLUQFT-KRWDZBQOSA-N 2 0 351.332 4.066 20 0 FIADRP Cc1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)n(C)n1 ZINC000417865815 1090982945 /nfs/dbraw/zinc/98/29/45/1090982945.db2.gz VQUJZSJPCQDOFO-UHFFFAOYSA-N 2 0 374.532 4.281 20 0 FIADRP CCn1cncc1CNc1ccc(C[N@H+](C[C@H]2CCCCO2)C(C)C)cc1 ZINC000417999898 1091020399 /nfs/dbraw/zinc/02/03/99/1091020399.db2.gz WSGKRVHPCSCCLF-JOCHJYFZSA-N 2 0 370.541 4.295 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](CC2CCC2)[C@H](C)c2ccccc2)CC1 ZINC000500073471 1091023431 /nfs/dbraw/zinc/02/34/31/1091023431.db2.gz JRNYTHYOTDIRGO-OAQYLSRUSA-N 2 0 357.586 4.266 20 0 FIADRP C[C@@H]([NH2+][C@H](CO)c1ccc(C(F)(F)F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000925647120 1091046276 /nfs/dbraw/zinc/04/62/76/1091046276.db2.gz YCQZYJOGLQKAEI-AUUYWEPGSA-N 2 0 366.427 4.151 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000500402915 1091440137 /nfs/dbraw/zinc/44/01/37/1091440137.db2.gz LBSCZGAPHUKJQB-VBKZILBWSA-N 2 0 352.869 4.254 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000500402914 1091440588 /nfs/dbraw/zinc/44/05/88/1091440588.db2.gz LBSCZGAPHUKJQB-JLTOFOAXSA-N 2 0 352.869 4.254 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)sc1Br ZINC000511760047 1091628037 /nfs/dbraw/zinc/62/80/37/1091628037.db2.gz VOGAWBZNCNFOFX-LBPRGKRZSA-N 2 0 357.361 4.344 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2c(F)ccc(O)c2F)C[N@@H+]1Cc1ccccc1 ZINC000511778321 1091667306 /nfs/dbraw/zinc/66/73/06/1091667306.db2.gz ZIZDGZGORDPEGW-NVXWUHKLSA-N 2 0 360.448 4.061 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2c(F)ccc(O)c2F)C[N@@H+]1Cc1ccccc1 ZINC000511778322 1091667844 /nfs/dbraw/zinc/66/78/44/1091667844.db2.gz ZIZDGZGORDPEGW-RDJZCZTQSA-N 2 0 360.448 4.061 20 0 FIADRP CN(CC1CC[NH+](C)CC1)Cn1cc(-c2ccc(Cl)cc2)oc1=S ZINC000728906606 1091902053 /nfs/dbraw/zinc/90/20/53/1091902053.db2.gz DKHFOULSWCIBLG-UHFFFAOYSA-N 2 0 365.930 4.362 20 0 FIADRP CCOC(CCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)OCC ZINC001168011616 1092202582 /nfs/dbraw/zinc/20/25/82/1092202582.db2.gz QEIGLZWDYRPSGM-RTBURBONSA-N 2 0 362.558 4.197 20 0 FIADRP C[C@@H]1CC([NH2+]CCOc2ccc(F)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011717 1092206980 /nfs/dbraw/zinc/20/69/80/1092206980.db2.gz RNJYFLZXQLYKCK-QZTJIDSGSA-N 2 0 356.485 4.236 20 0 FIADRP [NH3+][C@@H]1C[C@@H](NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c2ccccc21 ZINC000665277185 1092505343 /nfs/dbraw/zinc/50/53/43/1092505343.db2.gz WEYUNZGNTFYORR-UEVCKROQSA-N 2 0 361.533 4.023 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CCC3)cc1 ZINC000665281236 1092597344 /nfs/dbraw/zinc/59/73/44/1092597344.db2.gz YBIHDVZURTZPEI-IAGOWNOFSA-N 2 0 359.539 4.159 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(OC)cc(OC)c3)cc2)CC1 ZINC000236920404 1092717780 /nfs/dbraw/zinc/71/77/80/1092717780.db2.gz NXZYQOMXMWKATG-UHFFFAOYSA-N 2 0 370.493 4.070 20 0 FIADRP C[N@H+](CCCCOc1ccccc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442758991 1092749958 /nfs/dbraw/zinc/74/99/58/1092749958.db2.gz CJYYHKUUWOBSPQ-XYPWUTKMSA-N 2 0 356.432 4.079 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCCC[C@@H]2C)cc1)C(C)C ZINC000110174932 1092786726 /nfs/dbraw/zinc/78/67/26/1092786726.db2.gz SCZOAGCHQQXZIO-FQEVSTJZSA-N 2 0 373.585 4.301 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCC(C)CC2)cc1)C(C)C ZINC000110164642 1092795701 /nfs/dbraw/zinc/79/57/01/1092795701.db2.gz UXDZESMPPQUYLA-UHFFFAOYSA-N 2 0 373.585 4.159 20 0 FIADRP CC[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000442871019 1092818084 /nfs/dbraw/zinc/81/80/84/1092818084.db2.gz FCTBYWMKVLCBRI-QGZVFWFLSA-N 2 0 358.357 4.060 20 0 FIADRP COCCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(F)cc1 ZINC000442871561 1092819886 /nfs/dbraw/zinc/81/98/86/1092819886.db2.gz LYWVWDPOGFOEFT-GHTZIAJQSA-N 2 0 350.522 4.251 20 0 FIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2cccs2)cc1 ZINC000442890524 1092844369 /nfs/dbraw/zinc/84/43/69/1092844369.db2.gz ONFPCDFEXYCOPA-KRWDZBQOSA-N 2 0 357.567 4.092 20 0 FIADRP Cc1ccccc1[C@@H]([C@@H](C)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000443193767 1092984174 /nfs/dbraw/zinc/98/41/74/1092984174.db2.gz NDLLPFLYWGUUIX-AUSIDOKSSA-N 2 0 357.586 4.373 20 0 FIADRP COC1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512648502 1093068941 /nfs/dbraw/zinc/06/89/41/1093068941.db2.gz NQPZAFHXJZZFDZ-CAYSGGIESA-N 2 0 356.554 4.082 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000512659449 1093095645 /nfs/dbraw/zinc/09/56/45/1093095645.db2.gz HATYFYVYOVJUAI-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)sc1C ZINC000512666370 1093105709 /nfs/dbraw/zinc/10/57/09/1093105709.db2.gz KFBQXQHTJHVQMR-PWRODBHTSA-N 2 0 369.578 4.193 20 0 FIADRP Cc1ccc(CCC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC001168020123 1093198947 /nfs/dbraw/zinc/19/89/47/1093198947.db2.gz KQKCFZOIYVEUAJ-PMACEKPBSA-N 2 0 351.538 4.354 20 0 FIADRP C[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000411335487 1093247300 /nfs/dbraw/zinc/24/73/00/1093247300.db2.gz QWMYRBLJMGARFB-AREMUKBSSA-N 2 0 370.562 4.042 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000248387706 1093248394 /nfs/dbraw/zinc/24/83/94/1093248394.db2.gz PPOQDKODRAACGW-OALUTQOASA-N 2 0 367.578 4.020 20 0 FIADRP c1c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)onc1-c1ccccc1 ZINC000443591150 1093291800 /nfs/dbraw/zinc/29/18/00/1093291800.db2.gz OIYMCSOQUGCTSK-UHFFFAOYSA-N 2 0 353.510 4.430 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3[C@H]2O)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168023852 1093367519 /nfs/dbraw/zinc/36/75/19/1093367519.db2.gz YLNJTDWMRZWJHR-HOSQYBKFSA-N 2 0 364.533 4.066 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168025318 1093432141 /nfs/dbraw/zinc/43/21/41/1093432141.db2.gz JJFKGNNSVATDHC-KZTDQWPFSA-N 2 0 366.549 4.275 20 0 FIADRP C[C@@H]1C[C@@H](NC2CC[NH+](C3CCCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168027988 1093528144 /nfs/dbraw/zinc/52/81/44/1093528144.db2.gz NWQLTFDDGDCBFH-JHDGKUDLSA-N 2 0 369.597 4.425 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)c3ccccc3C[NH+](C)C)cc2)CC1 ZINC000433304868 1093560496 /nfs/dbraw/zinc/56/04/96/1093560496.db2.gz OCWBUFAZADXRQO-UHFFFAOYSA-N 2 0 365.521 4.232 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(O)cc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168030224 1093575836 /nfs/dbraw/zinc/57/58/36/1093575836.db2.gz UXVMJCWOHMCJGA-AAUAJYIVSA-N 2 0 364.533 4.281 20 0 FIADRP CC(C)C[NH+]1CCC(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168031227 1093615624 /nfs/dbraw/zinc/61/56/24/1093615624.db2.gz YEFZJPMZTYLZBF-JHDGKUDLSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000513052912 1093697660 /nfs/dbraw/zinc/69/76/60/1093697660.db2.gz UHINXJVCYUNDCF-XXBNENTESA-N 2 0 359.517 4.420 20 0 FIADRP C[C@@H]1CC([NH2+]CC2CC[NH+](C3CCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033631 1093722516 /nfs/dbraw/zinc/72/25/16/1093722516.db2.gz MVKWEJVRTFTAJF-WOJBJXKFSA-N 3 0 369.597 4.282 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)c1ccco1 ZINC000513078778 1093780191 /nfs/dbraw/zinc/78/01/91/1093780191.db2.gz WBWGZPLONVMURT-HMXCVIKNSA-N 2 0 361.574 4.295 20 0 FIADRP CCCn1c2ccccc2nc1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000614388729 1093799399 /nfs/dbraw/zinc/79/93/99/1093799399.db2.gz XTEVUYMUHJWUSJ-OALUTQOASA-N 2 0 356.558 4.294 20 0 FIADRP CCCn1c2ccccc2nc1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000614388726 1093799667 /nfs/dbraw/zinc/79/96/67/1093799667.db2.gz XTEVUYMUHJWUSJ-KDURUIRLSA-N 2 0 356.558 4.294 20 0 FIADRP COC(=O)C(C)(C)CC[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000474482284 1093829107 /nfs/dbraw/zinc/82/91/07/1093829107.db2.gz KFDSYOJSQFSJTI-UHFFFAOYSA-N 2 0 368.521 4.094 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OC ZINC000474484543 1093830720 /nfs/dbraw/zinc/83/07/20/1093830720.db2.gz KOEMSMHQCJYNPG-IRXDYDNUSA-N 2 0 356.510 4.047 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccnn2-c2ccc(F)cc2)c1 ZINC000474489107 1093841282 /nfs/dbraw/zinc/84/12/82/1093841282.db2.gz NOTSHYJWUDNKMR-UHFFFAOYSA-N 2 0 366.484 4.143 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(F)cc23)CC1 ZINC000513231522 1094014340 /nfs/dbraw/zinc/01/43/40/1094014340.db2.gz DUWYDKRHUQFABQ-OPAMFIHVSA-N 2 0 357.517 4.482 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)[NH+]2CCCC2)o1 ZINC000513490392 1094159123 /nfs/dbraw/zinc/15/91/23/1094159123.db2.gz DXAXFZRWCQFUBI-COPCDDAFSA-N 2 0 373.585 4.358 20 0 FIADRP Cc1ccn2c(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cnc2c1 ZINC000513494345 1094162174 /nfs/dbraw/zinc/16/21/74/1094162174.db2.gz HONRAUYGRIUZEU-CTNGQTDRSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cnc(-c3ccccc3)[nH]2)C[N@@H+]1Cc1ccccc1 ZINC000513494782 1094163336 /nfs/dbraw/zinc/16/33/36/1094163336.db2.gz JRLNZVOTHZLVBI-FPOVZHCZSA-N 2 0 374.532 4.467 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2csc(C3CC3)n2)C[N@@H+]1Cc1ccccc1 ZINC000513500799 1094173864 /nfs/dbraw/zinc/17/38/64/1094173864.db2.gz OWWKLFCPPUTEMA-FUHWJXTLSA-N 2 0 355.551 4.411 20 0 FIADRP C[N@H+](CCCN[C@H](Cc1ccccn1)c1cccnc1)C1CCCCC1 ZINC000513501578 1094174062 /nfs/dbraw/zinc/17/40/62/1094174062.db2.gz UDQAIQUJJLWBNO-JOCHJYFZSA-N 2 0 352.526 4.005 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]CC2=Cc3ccccc3OC2)C[N@@H+]1Cc1ccccc1 ZINC000513513836 1094186617 /nfs/dbraw/zinc/18/66/17/1094186617.db2.gz UWKXZBBWDVQKNG-PZJWPPBQSA-N 2 0 362.517 4.353 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000513523827 1094196779 /nfs/dbraw/zinc/19/67/79/1094196779.db2.gz CLJKSDUQFJVJGA-KNQAVFIVSA-N 2 0 352.526 4.005 20 0 FIADRP COC1CCN(C(C)(C)C[NH2+]C/C(C)=C/c2ccc(Cl)cc2)CC1 ZINC000513545371 1094205652 /nfs/dbraw/zinc/20/56/52/1094205652.db2.gz QCZZHTZFTVYWMW-DTQAZKPQSA-N 2 0 350.934 4.222 20 0 FIADRP COc1ccc(OC)c(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513544619 1094205806 /nfs/dbraw/zinc/20/58/06/1094205806.db2.gz KKUNSNOPXMVSRL-UYAOXDASSA-N 2 0 368.521 4.094 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2)c2ccc(OC)cc2)C1 ZINC000576868154 1094232501 /nfs/dbraw/zinc/23/25/01/1094232501.db2.gz WYDJHKMFLHTCOQ-NFBKMPQASA-N 2 0 352.522 4.301 20 0 FIADRP C[C@@H](CCc1ccc(F)cc1F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000513678751 1094278291 /nfs/dbraw/zinc/27/82/91/1094278291.db2.gz RXULPRJEGMHNSB-INIZCTEOSA-N 2 0 359.464 4.187 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccc3cnn(C)c3c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168036395 1094282868 /nfs/dbraw/zinc/28/28/68/1094282868.db2.gz WHJONDBEFLJJFX-ROUUACIJSA-N 2 0 362.521 4.105 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(C)o1 ZINC000513696855 1094362382 /nfs/dbraw/zinc/36/23/82/1094362382.db2.gz FIFPJRSCQCZEAF-FUPPJEDESA-N 2 0 367.537 4.114 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000501007333 1094415911 /nfs/dbraw/zinc/41/59/11/1094415911.db2.gz KYXJXEPMVPXNSV-NRFANRHFSA-N 2 0 363.565 4.309 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@H](CCCc3ccccc3)C2)CC1 ZINC000501059141 1094470347 /nfs/dbraw/zinc/47/03/47/1094470347.db2.gz LIRHQKMGEWKTBE-DEOSSOPVSA-N 2 0 371.613 4.137 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000501089617 1094488763 /nfs/dbraw/zinc/48/87/63/1094488763.db2.gz OFJNEXUOTJWANN-KRWDZBQOSA-N 2 0 371.491 4.114 20 0 FIADRP CC(C)n1nccc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000474714754 1094536581 /nfs/dbraw/zinc/53/65/81/1094536581.db2.gz OSLNBGUGNCKZAV-UHFFFAOYSA-N 2 0 360.933 4.119 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000474716555 1094537925 /nfs/dbraw/zinc/53/79/25/1094537925.db2.gz YCDRLXMZPNDWKV-ZWKOTPCHSA-N 2 0 370.537 4.437 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCOc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000389222025 1094700271 /nfs/dbraw/zinc/70/02/71/1094700271.db2.gz WSEUTXIJKFPMOL-TYPHKJRUSA-N 2 0 350.506 4.053 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000420321416 1094881131 /nfs/dbraw/zinc/88/11/31/1094881131.db2.gz RFVRABUNELJADC-RTBURBONSA-N 2 0 354.542 4.186 20 0 FIADRP Cc1nc([C@@H](C)[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)oc1-c1ccc(Cl)cc1 ZINC000420331686 1094891562 /nfs/dbraw/zinc/89/15/62/1094891562.db2.gz IUDHKAYHUROWIZ-OIISXLGYSA-N 2 0 359.901 4.296 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420379811 1094905756 /nfs/dbraw/zinc/90/57/56/1094905756.db2.gz NPRJBIZRWRHIIU-NXOUGTEYSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420398867 1094911926 /nfs/dbraw/zinc/91/19/26/1094911926.db2.gz ZGIFIHOHJCFTAD-DWQUBVKVSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3sc4ccccc4c3Cl)CC2)C1 ZINC000420398931 1094913186 /nfs/dbraw/zinc/91/31/86/1094913186.db2.gz ZMAFOMFOVCKPLC-GDBMZVCRSA-N 2 0 364.942 4.273 20 0 FIADRP C[C@@H](CC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)OCc1ccccc1 ZINC000474960307 1094951082 /nfs/dbraw/zinc/95/10/82/1094951082.db2.gz OCUMPSZDQMGYLW-FQEVSTJZSA-N 2 0 367.537 4.225 20 0 FIADRP CN(C[C@H]1CCC[N@@H+]1C)C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000421033243 1095246917 /nfs/dbraw/zinc/24/69/17/1095246917.db2.gz AITFXPNJMRIBJH-HXUWFJFHSA-N 2 0 372.557 4.009 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000502281365 1095302806 /nfs/dbraw/zinc/30/28/06/1095302806.db2.gz AEAKEYRLHBIELQ-MOPGFXCFSA-N 2 0 362.558 4.187 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[NH+]3CCCCCC3)cc12 ZINC000894258812 1095622183 /nfs/dbraw/zinc/62/21/83/1095622183.db2.gz HZIVSDRVFYBJSH-UHFFFAOYSA-N 2 0 364.493 4.197 20 0 FIADRP OC1(C[NH2+]Cc2cc3ccccc3s2)CC[NH+](Cc2ccccc2)CC1 ZINC000414532024 1095707840 /nfs/dbraw/zinc/70/78/40/1095707840.db2.gz AJXRVMKVSHXNFQ-UHFFFAOYSA-N 2 0 366.530 4.018 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cnn(C2CCCC2)c1 ZINC000502684703 1095713469 /nfs/dbraw/zinc/71/34/69/1095713469.db2.gz HDJCPSLYQGGZHJ-SFHVURJKSA-N 2 0 352.526 4.445 20 0 FIADRP COCC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000502720315 1095742874 /nfs/dbraw/zinc/74/28/74/1095742874.db2.gz ATCGIPRWRFFNMM-NQIIRXRSSA-N 2 0 364.961 4.347 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000421890170 1095977909 /nfs/dbraw/zinc/97/79/09/1095977909.db2.gz XTUCDFZIFLJGOQ-DQPZFDDXSA-N 2 0 367.331 4.125 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CC[C@@H]2CCC[N@@H+]2C)c2ccc(OC)cc2)cc1 ZINC000503076956 1096053969 /nfs/dbraw/zinc/05/39/69/1096053969.db2.gz WOVQFOICAPMELG-NZQKXSOJSA-N 2 0 368.521 4.062 20 0 FIADRP CCCOc1c(Cl)cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)cc1OCC ZINC000414668331 1096388412 /nfs/dbraw/zinc/38/84/12/1096388412.db2.gz IWXNRLPPRJEWNQ-AWEZNQCLSA-N 2 0 354.922 4.087 20 0 FIADRP FC(F)(F)COc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422730281 1096463690 /nfs/dbraw/zinc/46/36/90/1096463690.db2.gz JMGJMSYAPVHWDC-IXDOHACOSA-N 2 0 356.432 4.028 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000422715849 1096469203 /nfs/dbraw/zinc/46/92/03/1096469203.db2.gz MUSVDZGCJOFMBK-UZLBHIALSA-N 2 0 354.473 4.024 20 0 FIADRP COc1cccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c1OC1CCCC1 ZINC000422727074 1096473833 /nfs/dbraw/zinc/47/38/33/1096473833.db2.gz GIHCMCHDVJHCJP-HNNXBMFYSA-N 2 0 369.509 4.030 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OCC ZINC000422760529 1096476052 /nfs/dbraw/zinc/47/60/52/1096476052.db2.gz QFWJWPYTLKBJCI-HUUCEWRRSA-N 2 0 357.498 4.058 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1c2cc(Br)ccc2SC[C@H]1C ZINC000422740856 1096476946 /nfs/dbraw/zinc/47/69/46/1096476946.db2.gz NNWROMFIVJGDEA-XHBSWPGZSA-N 2 0 357.361 4.339 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000422769363 1096486579 /nfs/dbraw/zinc/48/65/79/1096486579.db2.gz OTEVTTPRTZLNCV-YJGRUCBDSA-N 2 0 362.517 4.472 20 0 FIADRP [NH3+][C@@H]1C[C@H](NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000422778905 1096489159 /nfs/dbraw/zinc/48/91/59/1096489159.db2.gz FGMKEJRPCHZNAT-RTWAWAEBSA-N 2 0 355.913 4.039 20 0 FIADRP CSc1cccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2cc(F)ccc2F)c1 ZINC000422785345 1096489701 /nfs/dbraw/zinc/48/97/01/1096489701.db2.gz JKTBDKCVVVSARW-BFUOFWGJSA-N 2 0 350.478 4.493 20 0 FIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422815003 1096498556 /nfs/dbraw/zinc/49/85/56/1096498556.db2.gz ALRKEUQRCWZNBA-NWGLXNPWSA-N 2 0 368.443 4.201 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422837271 1096502350 /nfs/dbraw/zinc/50/23/50/1096502350.db2.gz LTHQNIJTJFIRCT-BBFBFANZSA-N 2 0 366.480 4.295 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cn2)c1 ZINC000422848829 1096504758 /nfs/dbraw/zinc/50/47/58/1096504758.db2.gz UIVHHFZYXRNXSJ-PCCBWWKXSA-N 2 0 369.484 4.413 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000422855853 1096505623 /nfs/dbraw/zinc/50/56/23/1096505623.db2.gz FLOWQKRUZOWOGW-ROUUACIJSA-N 3 0 366.553 4.074 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422857048 1096506053 /nfs/dbraw/zinc/50/60/53/1096506053.db2.gz GNKPNHGWLPPVTQ-BHDDXSALSA-N 2 0 366.505 4.034 20 0 FIADRP Cc1ccccc1Oc1ccccc1C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000422860769 1096506884 /nfs/dbraw/zinc/50/68/84/1096506884.db2.gz MYQWPZBRWLYVOC-NJDAHSKKSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911371 1096521385 /nfs/dbraw/zinc/52/13/85/1096521385.db2.gz KPUSVCHKBDTWAC-QFBILLFUSA-N 2 0 357.567 4.281 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCN(c2nc3ccccc3s2)CC1 ZINC000422929959 1096527100 /nfs/dbraw/zinc/52/71/00/1096527100.db2.gz ANJCEJKLWZYNSZ-SJLPKXTDSA-N 2 0 372.582 4.166 20 0 FIADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 ZINC000422938194 1096530202 /nfs/dbraw/zinc/53/02/02/1096530202.db2.gz GVSDTUOVZVXIBR-PMACEKPBSA-N 2 0 356.897 4.123 20 0 FIADRP COc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)cc2)cc1 ZINC000422918030 1096531940 /nfs/dbraw/zinc/53/19/40/1096531940.db2.gz HDGVZZGLRIYIFV-INIZCTEOSA-N 2 0 361.489 4.375 20 0 FIADRP CC[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc(F)ccc1F ZINC000422919199 1096532381 /nfs/dbraw/zinc/53/23/81/1096532381.db2.gz JWUNEFGMTGGITN-IRFCIJBXSA-N 2 0 358.432 4.261 20 0 FIADRP Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422964024 1096533349 /nfs/dbraw/zinc/53/33/49/1096533349.db2.gz KFWICMMXLXQLOH-YTFSRNRJSA-N 2 0 366.553 4.014 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]CC1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC000423008072 1096548540 /nfs/dbraw/zinc/54/85/40/1096548540.db2.gz ZGAVQXIREIBJIF-YYWHXJBOSA-N 2 0 358.570 4.138 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423032917 1096554848 /nfs/dbraw/zinc/55/48/48/1096554848.db2.gz NNVPDLMERWYRLD-CQSZACIVSA-N 2 0 358.357 4.065 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423037181 1096556290 /nfs/dbraw/zinc/55/62/90/1096556290.db2.gz VQAQDCQFIBICNQ-DSIZOQBWSA-N 2 0 355.929 4.108 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2ncsc2c1 ZINC000423061152 1096560539 /nfs/dbraw/zinc/56/05/39/1096560539.db2.gz JYIYPDKGNWKAJG-DHUIEDIVSA-N 2 0 365.502 4.203 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000414715541 1096564280 /nfs/dbraw/zinc/56/42/80/1096564280.db2.gz RBHQEPCWBPVIQR-QZTJIDSGSA-N 2 0 372.557 4.042 20 0 FIADRP CC(C)N1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423051215 1096565437 /nfs/dbraw/zinc/56/54/37/1096565437.db2.gz ZZNJJSLRMWPAPO-PNQJHCTGSA-N 2 0 367.940 4.110 20 0 FIADRP CCCN(C)[C@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(Cl)cc1 ZINC000423102709 1096567658 /nfs/dbraw/zinc/56/76/58/1096567658.db2.gz KKTRFOHYODPKFB-QVKFZJNVSA-N 2 0 374.960 4.236 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097830 1096574219 /nfs/dbraw/zinc/57/42/19/1096574219.db2.gz RGNSIOOXNGPJLL-YEWWUXTCSA-N 2 0 363.427 4.464 20 0 FIADRP c1cc2cc(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2s1 ZINC000423120915 1096578697 /nfs/dbraw/zinc/57/86/97/1096578697.db2.gz HVDUCMGSXFNWKE-GHTZIAJQSA-N 2 0 350.487 4.247 20 0 FIADRP CC(F)(F)c1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423125799 1096579727 /nfs/dbraw/zinc/57/97/27/1096579727.db2.gz AHMZEZJELVKRQY-RXVVDRJESA-N 2 0 358.432 4.144 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CCC[NH2+]CC1 ZINC000423127445 1096579973 /nfs/dbraw/zinc/57/99/73/1096579973.db2.gz TWHTVTHMGLPUEO-GUYCJALGSA-N 2 0 362.315 4.040 20 0 FIADRP FC1(F)CCCC[C@H](C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423123848 1096580250 /nfs/dbraw/zinc/58/02/50/1096580250.db2.gz FITQCVDDDXFRKU-KVSKMBFKSA-N 2 0 350.453 4.048 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cccc(Br)c1Cl ZINC000423168430 1096599947 /nfs/dbraw/zinc/59/99/47/1096599947.db2.gz HKDCKUVJDVHIAM-JTQLQIEISA-N 2 0 368.706 4.115 20 0 FIADRP CC[C@H](C[N@H+](Cc1nccs1)[C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000414723837 1096615180 /nfs/dbraw/zinc/61/51/80/1096615180.db2.gz QNLWZIAEXPSEMJ-MJGOQNOKSA-N 2 0 355.551 4.281 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)cc1OCC ZINC000414727684 1096628640 /nfs/dbraw/zinc/62/86/40/1096628640.db2.gz AUDRSBRSCWAKBL-MRXNPFEDSA-N 2 0 354.922 4.101 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]CC[C@@H]2CC[NH2+]C2)nc1 ZINC000423248305 1096628899 /nfs/dbraw/zinc/62/88/99/1096628899.db2.gz MYHQEIKEZPPHDP-UGKGYDQZSA-N 2 0 371.956 4.040 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccco2)cc1 ZINC000423260762 1096633824 /nfs/dbraw/zinc/63/38/24/1096633824.db2.gz QPZVIRXYYNAYHD-KDOFPFPSSA-N 2 0 363.299 4.111 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000423291462 1096635653 /nfs/dbraw/zinc/63/56/53/1096635653.db2.gz IJMKEVKONNHEMH-APPDUMDISA-N 2 0 363.274 4.385 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Br ZINC000423290675 1096635680 /nfs/dbraw/zinc/63/56/80/1096635680.db2.gz FAIZLYFBIKPLLU-STQMWFEESA-N 2 0 363.299 4.328 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cnn1-c1ccc(F)cc1 ZINC000423290907 1096635781 /nfs/dbraw/zinc/63/57/81/1096635781.db2.gz FWUIXTDDFFDNML-CABCVRRESA-N 2 0 352.457 4.190 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000423290428 1096636270 /nfs/dbraw/zinc/63/62/70/1096636270.db2.gz CXGJZLNMUPOLDH-ZMZPIMSZSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccccc2Br)s1 ZINC000423306776 1096640412 /nfs/dbraw/zinc/64/04/12/1096640412.db2.gz UTFGYGORRBWUOW-LLVKDONJSA-N 2 0 351.313 4.048 20 0 FIADRP CC1(C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)CC[NH2+]CC1 ZINC000423315790 1096641308 /nfs/dbraw/zinc/64/13/08/1096641308.db2.gz AJTDFYGAAJZRLS-QGZVFWFLSA-N 2 0 363.299 4.111 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000423315993 1096642362 /nfs/dbraw/zinc/64/23/62/1096642362.db2.gz BKAFFKFLZUBEAA-KRWDZBQOSA-N 2 0 354.828 4.359 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3(C)CC[NH2+]CC3)s2)cc1 ZINC000423316378 1096642488 /nfs/dbraw/zinc/64/24/88/1096642488.db2.gz ANYAOIPDSSPMDY-AWEZNQCLSA-N 2 0 359.539 4.167 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000423334645 1096649702 /nfs/dbraw/zinc/64/97/02/1096649702.db2.gz FTPTTYNTNLUDNX-LJQANCHMSA-N 2 0 364.386 4.443 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H](c2ccccc2)c2ccc(Br)cc2)CC[NH2+]1 ZINC000423387056 1096662640 /nfs/dbraw/zinc/66/26/40/1096662640.db2.gz SIIVUUVNWHAGQX-MDASCCDHSA-N 2 0 359.311 4.269 20 0 FIADRP COCC1(C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC[NH2+]CC1 ZINC000423404034 1096672036 /nfs/dbraw/zinc/67/20/36/1096672036.db2.gz IEQLJTRTOUYILR-QGZVFWFLSA-N 2 0 357.325 4.050 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423407446 1096673612 /nfs/dbraw/zinc/67/36/12/1096673612.db2.gz VVMKIARZVPCOHZ-ISTVAULSSA-N 2 0 354.338 4.373 20 0 FIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc2cc(Br)ccc2o1 ZINC000423475507 1096696066 /nfs/dbraw/zinc/69/60/66/1096696066.db2.gz ICXIIGPCGDIMQX-DOMZBBRYSA-N 2 0 351.288 4.378 20 0 FIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cnn1C(C)(C)C ZINC000423480376 1096698405 /nfs/dbraw/zinc/69/84/05/1096698405.db2.gz VXILPKYKTNKXJN-ZAAXVRCTSA-N 2 0 372.532 4.130 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]C1CCN(c2ccc(F)cc2F)CC1)c1ccccc1 ZINC000423494517 1096706324 /nfs/dbraw/zinc/70/63/24/1096706324.db2.gz ARODWHXKPJSXGL-FQEVSTJZSA-N 2 0 359.464 4.003 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000423493363 1096706943 /nfs/dbraw/zinc/70/69/43/1096706943.db2.gz BHQHDDSIPYGTCE-PSGMQZRDSA-N 2 0 362.489 4.493 20 0 FIADRP C[C@@H](NC[C@H]1C[NH2+]CCCO1)c1ccc(-c2ccccc2Cl)s1 ZINC000423512611 1096709895 /nfs/dbraw/zinc/70/98/95/1096709895.db2.gz KUZSEGKCARKLLC-ZIAGYGMSSA-N 2 0 350.915 4.098 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423516558 1096711073 /nfs/dbraw/zinc/71/10/73/1096711073.db2.gz YCDZXKSQPFEMGU-LAUBAEHRSA-N 2 0 368.525 4.347 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000423518616 1096712248 /nfs/dbraw/zinc/71/22/48/1096712248.db2.gz PFLOXMMJLDLOSJ-JLLPCOHGSA-N 3 0 363.549 4.252 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423537762 1096715528 /nfs/dbraw/zinc/71/55/28/1096715528.db2.gz DNCWBNYHSOGSJF-JEDBISTDSA-N 2 0 355.551 4.081 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423539349 1096716118 /nfs/dbraw/zinc/71/61/18/1096716118.db2.gz IEFBDQWZFCOHHH-LLUDDFSJSA-N 2 0 350.506 4.401 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423541688 1096716404 /nfs/dbraw/zinc/71/64/04/1096716404.db2.gz LJMZQCVWDVFKHX-ZKAWZIJESA-N 2 0 369.734 4.068 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)s2)cc1 ZINC000423540293 1096716462 /nfs/dbraw/zinc/71/64/62/1096716462.db2.gz JPDJCDBSICYUHU-XDKFSHSGSA-N 2 0 371.550 4.166 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000423546330 1096718443 /nfs/dbraw/zinc/71/84/43/1096718443.db2.gz CYONQLKKGUGSSC-KRWDZBQOSA-N 2 0 357.567 4.009 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423555611 1096721377 /nfs/dbraw/zinc/72/13/77/1096721377.db2.gz YDQILCJBNMFHOE-BSDSXHPESA-N 2 0 353.535 4.165 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1 ZINC000423579930 1096724947 /nfs/dbraw/zinc/72/49/47/1096724947.db2.gz XADRSGQWPNPJQE-SFHVURJKSA-N 2 0 369.578 4.053 20 0 FIADRP FC(F)(F)Oc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533075801 1098741272 /nfs/dbraw/zinc/74/12/72/1098741272.db2.gz PMTGKRHOBWOHTA-QAPCUYQASA-N 2 0 354.416 4.034 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000436233569 1098855841 /nfs/dbraw/zinc/85/58/41/1098855841.db2.gz TVTLEZASLNVVED-VXKWHMMOSA-N 2 0 352.522 4.095 20 0 FIADRP COCCC1(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CCCCC1 ZINC000436276939 1098880510 /nfs/dbraw/zinc/88/05/10/1098880510.db2.gz VUBVKEXIHPKATQ-UHFFFAOYSA-N 2 0 358.570 4.475 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cs1 ZINC000436281561 1098883672 /nfs/dbraw/zinc/88/36/72/1098883672.db2.gz PYJOKWQVBQDQFZ-UHFFFAOYSA-N 2 0 366.534 4.414 20 0 FIADRP CC1(C)CCc2ccccc2[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C1 ZINC000436292353 1098907349 /nfs/dbraw/zinc/90/73/49/1098907349.db2.gz NACOURMXBPEFQM-AVRDEDQJSA-N 2 0 356.554 4.181 20 0 FIADRP Cc1nc2scc(C3CC3)n2c1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000459384830 1098954857 /nfs/dbraw/zinc/95/48/57/1098954857.db2.gz YCMYVBXXCSXXQT-UHFFFAOYSA-N 2 0 360.571 4.135 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000533608572 1099224698 /nfs/dbraw/zinc/22/46/98/1099224698.db2.gz UTBVAXVTICEPFY-HXUWFJFHSA-N 2 0 370.562 4.164 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000414898226 1099594508 /nfs/dbraw/zinc/59/45/08/1099594508.db2.gz DJJBEARTCVWJBS-UHFFFAOYSA-N 2 0 366.292 4.074 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162265172 1099668482 /nfs/dbraw/zinc/66/84/82/1099668482.db2.gz OUTSXDCCGQOMGR-HOTGVXAUSA-N 2 0 360.473 4.187 20 0 FIADRP C[NH2+]CCC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000262002052 1099685509 /nfs/dbraw/zinc/68/55/09/1099685509.db2.gz PZTDHWCHNJBYKY-SFHVURJKSA-N 2 0 365.521 4.002 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccc(F)cc1 ZINC000508693183 1099823826 /nfs/dbraw/zinc/82/38/26/1099823826.db2.gz AFNKZPUQHSWWJZ-GGPKGHCWSA-N 2 0 356.485 4.093 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC000508693241 1099827628 /nfs/dbraw/zinc/82/76/28/1099827628.db2.gz CPNJAKCBBLYOLJ-MJGOQNOKSA-N 2 0 357.567 4.309 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508698488 1099830682 /nfs/dbraw/zinc/83/06/82/1099830682.db2.gz OPJHTDOSPOBOBW-SIKLNZKXSA-N 2 0 352.522 4.046 20 0 FIADRP Cc1csc(CCCC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000508698584 1099831409 /nfs/dbraw/zinc/83/14/09/1099831409.db2.gz PFBMYGOQBZXOLX-ICSRJNTNSA-N 2 0 357.567 4.274 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(OC(F)F)c1 ZINC000162558529 1099842773 /nfs/dbraw/zinc/84/27/73/1099842773.db2.gz HXLCAIQSKWTQKH-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H](NCCC[N@H+](C)Cc1ccccc1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508701309 1099842819 /nfs/dbraw/zinc/84/28/19/1099842819.db2.gz WNIYKKAQWZLLAT-ZJSXRUAMSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H](O)C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000508703607 1099856486 /nfs/dbraw/zinc/85/64/86/1099856486.db2.gz ZACGRANPGKTFFA-UWXQAFAOSA-N 2 0 366.549 4.041 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1cccc(F)c1 ZINC000508702108 1099857488 /nfs/dbraw/zinc/85/74/88/1099857488.db2.gz YNXRTPFAKIXUMC-WSTZPKSXSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@@H](Nc1ccc(CC[NH+](C)C)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715203 1099885913 /nfs/dbraw/zinc/88/59/13/1099885913.db2.gz XGUFJMUWVPPYFR-KNQAVFIVSA-N 2 0 351.538 4.113 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508711063 1099902585 /nfs/dbraw/zinc/90/25/85/1099902585.db2.gz OBHACPIRMGCZSK-JQVVWYNYSA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722898 1099943263 /nfs/dbraw/zinc/94/32/63/1099943263.db2.gz YQTRHQVGUUTNIR-CTNGQTDRSA-N 2 0 364.533 4.227 20 0 FIADRP CC1CC[NH+](C[C@H]2CCCN(Cc3c[nH]nc3-c3ccsc3)C2)CC1 ZINC000437703801 1100112479 /nfs/dbraw/zinc/11/24/79/1100112479.db2.gz WRWRJWWLQZPMQM-QGZVFWFLSA-N 2 0 358.555 4.082 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459431903 1100169136 /nfs/dbraw/zinc/16/91/36/1100169136.db2.gz ZBZYIUHDSAPVQQ-OFNKIYASSA-N 2 0 365.521 4.116 20 0 FIADRP COc1ccsc1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000536709385 1100228167 /nfs/dbraw/zinc/22/81/67/1100228167.db2.gz CPDPXZHVZCZERS-UHFFFAOYSA-N 2 0 356.535 4.245 20 0 FIADRP c1nnsc1C[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000459516940 1100254745 /nfs/dbraw/zinc/25/47/45/1100254745.db2.gz DZHGLBTUUOTLOJ-NRFANRHFSA-N 2 0 370.566 4.195 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666856643 1100269019 /nfs/dbraw/zinc/26/90/19/1100269019.db2.gz VVZYOCWUDLXTSA-FQEVSTJZSA-N 2 0 360.505 4.079 20 0 FIADRP Fc1ccc([C@H]2C[C@H]([NH2+]C3CCN(C4CC4)CC3)C2)cc1Br ZINC000459524875 1100271107 /nfs/dbraw/zinc/27/11/07/1100271107.db2.gz ZZWDFEULDLGRQS-CTYIDZIISA-N 2 0 367.306 4.051 20 0 FIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000425928067 1100297723 /nfs/dbraw/zinc/29/77/23/1100297723.db2.gz XHEPOESUNXCKRO-OAQYLSRUSA-N 2 0 357.929 4.484 20 0 FIADRP Brc1ccc(/C=C/C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459586654 1100310679 /nfs/dbraw/zinc/31/06/79/1100310679.db2.gz VSRZQMJTJACURY-OWOJBTEDSA-N 2 0 372.310 4.116 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@@H]4CC[N@H+](C)[C@H](C)C4)cc3)ccc2O1 ZINC000536842162 1100355331 /nfs/dbraw/zinc/35/53/31/1100355331.db2.gz WLQHAHIDKNDPLD-DRSNIGMVSA-N 2 0 350.506 4.249 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000536858597 1100373417 /nfs/dbraw/zinc/37/34/17/1100373417.db2.gz QZTWFYIBZIMBPR-BZSNNMDCSA-N 2 0 350.572 4.339 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(OC(F)(F)F)c1 ZINC000536859463 1100376421 /nfs/dbraw/zinc/37/64/21/1100376421.db2.gz UYNXXYJSRUBJBP-OAGGEKHMSA-N 2 0 374.447 4.125 20 0 FIADRP c1[nH+]cn2cc(C[NH2+]Cc3cc4ccccc4nc3N3CCCCC3)ccc12 ZINC000459656187 1100400811 /nfs/dbraw/zinc/40/08/11/1100400811.db2.gz FXWPAIICOMPKLC-UHFFFAOYSA-N 2 0 371.488 4.163 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]C/C=C/c3ccccc3)cc2)C[C@H](C)O1 ZINC000517538979 1100460762 /nfs/dbraw/zinc/46/07/62/1100460762.db2.gz VWIZDOLSTSJFHP-FMNOIEFDSA-N 2 0 350.506 4.099 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C[C@H]3C[C@@H]3c3ccccc3)cc2)CC1 ZINC000517543609 1100465275 /nfs/dbraw/zinc/46/52/75/1100465275.db2.gz LBBZNLDMZUTJNY-NFBKMPQASA-N 2 0 350.506 4.053 20 0 FIADRP COc1cc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc(Cl)c1OC ZINC000517537210 1100474930 /nfs/dbraw/zinc/47/49/30/1100474930.db2.gz KLXCKSXYLDVOSS-IYBDPMFKSA-N 2 0 368.949 4.205 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426036100 1100694398 /nfs/dbraw/zinc/69/43/98/1100694398.db2.gz MLZODXJDTUAPMG-HXUWFJFHSA-N 2 0 357.929 4.340 20 0 FIADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccccc3C[N@@H+]3CC[C@@H](O)C3)oc2c1 ZINC000426049728 1100716549 /nfs/dbraw/zinc/71/65/49/1100716549.db2.gz JWPSMBGIEFOEFI-LAUBAEHRSA-N 2 0 364.489 4.159 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000517936821 1100804566 /nfs/dbraw/zinc/80/45/66/1100804566.db2.gz ZLVATJAOEJHQSI-YJBOKZPZSA-N 2 0 371.912 4.152 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000438771450 1100907419 /nfs/dbraw/zinc/90/74/19/1100907419.db2.gz KYCRZRMWJQZRFS-NRFANRHFSA-N 2 0 355.526 4.018 20 0 FIADRP COCC[N@H+](C)CCC[NH2+]Cc1ccc(-c2cccc(Cl)c2)s1 ZINC000518265431 1101049573 /nfs/dbraw/zinc/04/95/73/1101049573.db2.gz XSOHFBYHXJSISV-UHFFFAOYSA-N 2 0 352.931 4.126 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc(C)ccc3C)CC2)cc1 ZINC000518280380 1101064746 /nfs/dbraw/zinc/06/47/46/1101064746.db2.gz JDOVGFFUQHHKRY-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000518280468 1101064980 /nfs/dbraw/zinc/06/49/80/1101064980.db2.gz PXDLMNKGMSIGDJ-UHFFFAOYSA-N 2 0 366.484 4.110 20 0 FIADRP C[C@H](C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1)CN1CC[NH+](C)CC1 ZINC000467383475 1101285838 /nfs/dbraw/zinc/28/58/38/1101285838.db2.gz TYVNWNUEQWRWPM-DYESRHJHSA-N 2 0 363.977 4.044 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000414994408 1101331754 /nfs/dbraw/zinc/33/17/54/1101331754.db2.gz DNEVFQGZFRXOLF-SJLPKXTDSA-N 2 0 366.534 4.208 20 0 FIADRP Fc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000537000349 1101387725 /nfs/dbraw/zinc/38/77/25/1101387725.db2.gz BKSROJDXAQVPRI-AUSIDOKSSA-N 2 0 352.497 4.431 20 0 FIADRP Fc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000537000351 1101388451 /nfs/dbraw/zinc/38/84/51/1101388451.db2.gz BKSROJDXAQVPRI-WMZHIEFXSA-N 2 0 352.497 4.431 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH2+][C@@H](C)c2ccc(OC)cc2)cc1 ZINC000537027159 1101406626 /nfs/dbraw/zinc/40/66/26/1101406626.db2.gz LDAHPXPCJKDNFO-BCDXTJNWSA-N 2 0 356.510 4.341 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)C1 ZINC000414998961 1101460392 /nfs/dbraw/zinc/46/03/92/1101460392.db2.gz REUJRKLOLOYQIL-QMTHXVAHSA-N 2 0 365.237 4.075 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000414999125 1101469805 /nfs/dbraw/zinc/46/98/05/1101469805.db2.gz IWADBKNEIRPRCX-DHJUGAMNSA-N 2 0 370.512 4.138 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2)C2CCCCC2)CC1 ZINC000537193197 1101528112 /nfs/dbraw/zinc/52/81/12/1101528112.db2.gz VLUGPMJSRORYHB-DNVJHFABSA-N 2 0 356.554 4.275 20 0 FIADRP CCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)s1 ZINC000518785024 1101565167 /nfs/dbraw/zinc/56/51/67/1101565167.db2.gz ITBLIEPXQWYDKM-UHFFFAOYSA-N 2 0 358.551 4.321 20 0 FIADRP C[C@H](C[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CC[NH+](C)CC1 ZINC000537295453 1101617478 /nfs/dbraw/zinc/61/74/78/1101617478.db2.gz LJPGBIQXTHZDCL-YLJYHZDGSA-N 2 0 365.993 4.290 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000325418990 1101798836 /nfs/dbraw/zinc/79/88/36/1101798836.db2.gz NGPUSZUJRWYCNL-LLVKDONJSA-N 2 0 354.338 4.156 20 0 FIADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC[NH+](C2CCCCC2)CC1 ZINC001167965505 1101863196 /nfs/dbraw/zinc/86/31/96/1101863196.db2.gz IJDMHQDGZNNVIU-BRTIRZTQSA-N 3 0 359.602 4.026 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC(COCC[NH+]2CCCC2)CC1 ZINC001168172047 1101922942 /nfs/dbraw/zinc/92/29/42/1101922942.db2.gz ZEQBCSZFLNOJOA-GOSISDBHSA-N 2 0 364.961 4.095 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415053691 1102269889 /nfs/dbraw/zinc/26/98/89/1102269889.db2.gz MRCRSJWIXCXUKY-JOCHJYFZSA-N 2 0 361.489 4.327 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)ccc1F ZINC000120938308 1102284851 /nfs/dbraw/zinc/28/48/51/1102284851.db2.gz MNLVOTIOBNCESH-HXUWFJFHSA-N 2 0 354.469 4.423 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCN(c2ccccc2F)C1)c1ccc(-n2ccnc2)cc1 ZINC000537961622 1102296050 /nfs/dbraw/zinc/29/60/50/1102296050.db2.gz RKSFULZDAIMOQE-HKUYNNGSSA-N 2 0 364.468 4.331 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1)CN1CC[NH+](C)CC1 ZINC000120988552 1102301297 /nfs/dbraw/zinc/30/12/97/1102301297.db2.gz DLQHWWHFQTXCHK-PMACEKPBSA-N 2 0 367.537 4.013 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532448475 1102345399 /nfs/dbraw/zinc/34/53/99/1102345399.db2.gz ZOVMGRKWOGTBQU-KRWDZBQOSA-N 2 0 365.521 4.262 20 0 FIADRP CC(C)[NH+]1CCC(NC[C@H](c2c(F)cccc2Cl)N2CCCC2)CC1 ZINC000532450099 1102347676 /nfs/dbraw/zinc/34/76/76/1102347676.db2.gz VVRUNHUVPZFCCB-LJQANCHMSA-N 2 0 367.940 4.078 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1O ZINC000519543710 1102370477 /nfs/dbraw/zinc/37/04/77/1102370477.db2.gz IHWAEIDDQXCUSZ-OAHLLOKOSA-N 2 0 360.523 4.025 20 0 FIADRP C[C@H](NC[C@@H](O)C[NH+]1CCCC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000532479641 1102422635 /nfs/dbraw/zinc/42/26/35/1102422635.db2.gz LJHLELNHPRDGFZ-WMLDXEAASA-N 2 0 364.942 4.176 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000120026514 1102430136 /nfs/dbraw/zinc/43/01/36/1102430136.db2.gz NYBOMVNQOPYACS-MRXNPFEDSA-N 2 0 359.558 4.426 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000121686332 1102434488 /nfs/dbraw/zinc/43/44/88/1102434488.db2.gz VWYSEPHRUXQKKH-CQSZACIVSA-N 2 0 356.457 4.069 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c(C)s1 ZINC000532497824 1102440273 /nfs/dbraw/zinc/44/02/73/1102440273.db2.gz UTWODYXGGTULQY-DYESRHJHSA-N 2 0 357.567 4.004 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cccc(CO)c1 ZINC000121812287 1102475304 /nfs/dbraw/zinc/47/53/04/1102475304.db2.gz AYEUNDSHXHNQHF-IBGZPJMESA-N 2 0 352.522 4.406 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000122689274 1102612811 /nfs/dbraw/zinc/61/28/11/1102612811.db2.gz BAHNYGQXTQYSMV-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP COc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001168251492 1102647708 /nfs/dbraw/zinc/64/77/08/1102647708.db2.gz KGCKBYAYEGITHZ-JOCHJYFZSA-N 2 0 356.554 4.044 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[C@@H]1C ZINC000550882054 1102653427 /nfs/dbraw/zinc/65/34/27/1102653427.db2.gz HPYKZMUOLWBWHY-SCPDWHHUSA-N 2 0 370.581 4.330 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168253282 1102655085 /nfs/dbraw/zinc/65/50/85/1102655085.db2.gz WVZZLIYPQJHKNO-YPAWHYETSA-N 2 0 356.554 4.315 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCCO2 ZINC000123001548 1102732497 /nfs/dbraw/zinc/73/24/97/1102732497.db2.gz FABZBCHBTANVFW-QFIPXVFZSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cnn(Cc2ccccc2)c1 ZINC000123056241 1102774410 /nfs/dbraw/zinc/77/44/10/1102774410.db2.gz VJGBDLPXXLNALC-HXUWFJFHSA-N 2 0 374.532 4.378 20 0 FIADRP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccc4c(c2)CCO4)CC3)cc1 ZINC000537659902 1102784720 /nfs/dbraw/zinc/78/47/20/1102784720.db2.gz RENBOSASZSJPLG-UHFFFAOYSA-N 2 0 362.517 4.110 20 0 FIADRP Brc1csc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167982093 1102790672 /nfs/dbraw/zinc/79/06/72/1102790672.db2.gz WSYGZPMLNHGXMI-MQVJKMGUSA-N 2 0 369.372 4.048 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(Cl)c(OC)c(OC)c2)CC1 ZINC000506858386 1102862959 /nfs/dbraw/zinc/86/29/59/1102862959.db2.gz BRDDYKCLNVGCBZ-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP Cc1ccc(-c2cccc(C[N@H+]3CCO[C@@H]4C[C@H]([NH+](C)C)CC[C@@H]43)c2)cc1 ZINC000537692742 1102872400 /nfs/dbraw/zinc/87/24/00/1102872400.db2.gz MGKFADMEAGMBQX-TZRRMPRUSA-N 2 0 364.533 4.346 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCCC23CCCC3)CC1 ZINC000551062934 1102879444 /nfs/dbraw/zinc/87/94/44/1102879444.db2.gz FZHINYINLHJCAF-JOCHJYFZSA-N 2 0 356.554 4.236 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC1CCN(c2cc[nH+]cc2)CC1 ZINC000459349120 1102881916 /nfs/dbraw/zinc/88/19/16/1102881916.db2.gz ABYPICQPJNJZCZ-UHFFFAOYSA-N 2 0 350.510 4.067 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)nn(Cc3ccccc3)c2C)CC1 ZINC000506931963 1102968615 /nfs/dbraw/zinc/96/86/15/1102968615.db2.gz ZFAPMUXWFVSQGU-UHFFFAOYSA-N 2 0 368.569 4.102 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000551211478 1102981145 /nfs/dbraw/zinc/98/11/45/1102981145.db2.gz IRAWTARNEDXRAZ-OZOXKJRCSA-N 2 0 356.485 4.363 20 0 FIADRP C[C@@H](CCC1CC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551263644 1103023314 /nfs/dbraw/zinc/02/33/14/1103023314.db2.gz DDUREAVJZFVRRR-UGKGYDQZSA-N 2 0 356.554 4.084 20 0 FIADRP CN(C)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000551267155 1103027656 /nfs/dbraw/zinc/02/76/56/1103027656.db2.gz MYBGZAHWBFOIIH-VHYCJAOWSA-N 2 0 365.565 4.322 20 0 FIADRP COc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c(F)c1 ZINC000551312999 1103068933 /nfs/dbraw/zinc/06/89/33/1103068933.db2.gz DZOPUAACOPBHTL-UHFFFAOYSA-N 2 0 356.485 4.367 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(C(F)(F)F)cn1 ZINC000551394635 1103176521 /nfs/dbraw/zinc/17/65/21/1103176521.db2.gz KHSLHNBYJBHNME-HNAYVOBHSA-N 2 0 363.427 4.101 20 0 FIADRP CC(C)[NH+]1CCC(N(C)Cc2cccc(C(=O)Nc3ccccc3)c2)CC1 ZINC000507370354 1103344158 /nfs/dbraw/zinc/34/41/58/1103344158.db2.gz LUKLVECEROFNFH-UHFFFAOYSA-N 2 0 365.521 4.244 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)ccc1OCc1cccs1 ZINC000666996695 1103356446 /nfs/dbraw/zinc/35/64/46/1103356446.db2.gz AGVGKGZGCBLNOK-QGZVFWFLSA-N 2 0 372.534 4.100 20 0 FIADRP c1c(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000666997086 1103362662 /nfs/dbraw/zinc/36/26/62/1103362662.db2.gz WJTAIEWDPZPSAR-NRFANRHFSA-N 2 0 372.516 4.304 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000507430745 1103382798 /nfs/dbraw/zinc/38/27/98/1103382798.db2.gz UKCYZHZXGOSJJN-FOIQADDNSA-N 2 0 362.439 4.147 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000507464023 1103410139 /nfs/dbraw/zinc/41/01/39/1103410139.db2.gz WAZISVKBHFEFDX-QRVBRYPASA-N 2 0 367.537 4.104 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000507484048 1103431178 /nfs/dbraw/zinc/43/11/78/1103431178.db2.gz IRXKAQYCTOCPCH-VJFDXUIRSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)[C@@H]1CCCOC1 ZINC000507489099 1103437725 /nfs/dbraw/zinc/43/77/25/1103437725.db2.gz WENFUIDYFDDMHJ-NFBKMPQASA-N 2 0 358.570 4.126 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000187997016 1103733030 /nfs/dbraw/zinc/73/30/30/1103733030.db2.gz QVUGGMKIAPWIIX-IIYDPXPESA-N 2 0 358.423 4.194 20 0 FIADRP C[C@@H](NC1(C[NH2+][C@@H](C)Cc2ccccc2F)CCOCC1)c1ccccc1 ZINC000188047356 1103807575 /nfs/dbraw/zinc/80/75/75/1103807575.db2.gz NMFZWHPXQDWGPK-RBUKOAKNSA-N 2 0 370.512 4.246 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@H](c3ccnn3C)C2)c1 ZINC000519863493 1103912460 /nfs/dbraw/zinc/91/24/60/1103912460.db2.gz TXSFJQKDAJRARH-SFTDATJTSA-N 2 0 354.542 4.076 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000538194646 1104030957 /nfs/dbraw/zinc/03/09/57/1104030957.db2.gz KKBADJCFQFGQNL-UHFFFAOYSA-N 3 0 357.586 4.143 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(CC)(CC)c2ccc(OC)c(OC)c2)[C@@H](C)C1 ZINC000461081808 1104082742 /nfs/dbraw/zinc/08/27/42/1104082742.db2.gz BOIFXYPHOITUCJ-HKUYNNGSSA-N 2 0 362.558 4.082 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC1(c3ccccc3)CC1)c1ccccc1O2 ZINC000538268394 1104089491 /nfs/dbraw/zinc/08/94/91/1104089491.db2.gz HHZVODAFPAIGKC-OAQYLSRUSA-N 2 0 362.517 4.296 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccccc2OCc2ccncc2)CC1 ZINC000520204712 1104171235 /nfs/dbraw/zinc/17/12/35/1104171235.db2.gz CMMWBJSOHWIJNN-UHFFFAOYSA-N 2 0 367.537 4.262 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1Br ZINC000216502535 1105144953 /nfs/dbraw/zinc/14/49/53/1105144953.db2.gz LLKYVBGRSSGASD-LBPRGKRZSA-N 2 0 369.347 4.418 20 0 FIADRP COc1ccc(OCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168009929 1105226364 /nfs/dbraw/zinc/22/63/64/1105226364.db2.gz IPWLDQXXUOPEBQ-CEQLMSFQSA-N 2 0 368.521 4.105 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2-c2ccnn2C)C1 ZINC000507834395 1105241060 /nfs/dbraw/zinc/24/10/60/1105241060.db2.gz UPTNRNGDGHWFCB-PMACEKPBSA-N 2 0 366.553 4.174 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530243464 1106923139 /nfs/dbraw/zinc/92/31/39/1106923139.db2.gz YKLJJASOYPUCEN-CJNGLKHVSA-N 2 0 357.325 4.145 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1CNc1ncnc2c1cnn2C(C)(C)C ZINC000301840708 1107178089 /nfs/dbraw/zinc/17/80/89/1107178089.db2.gz OYNXPQLOSJMPMH-UHFFFAOYSA-N 2 0 366.513 4.034 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OCc1cccs1 ZINC000530674608 1107246129 /nfs/dbraw/zinc/24/61/29/1107246129.db2.gz CFISXURXCNQSPW-ZWKOTPCHSA-N 2 0 374.550 4.298 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000530714519 1107262474 /nfs/dbraw/zinc/26/24/74/1107262474.db2.gz HOLBCCPUVQANLJ-FPOVZHCZSA-N 2 0 368.525 4.259 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152434353 1107455272 /nfs/dbraw/zinc/45/52/72/1107455272.db2.gz KZVGBAQAQQCUGX-JPYJTQIMSA-N 2 0 368.496 4.192 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@H]3CC[C@@H](c4cccc(F)c4)C3)sc2C1 ZINC000475555700 1107724359 /nfs/dbraw/zinc/72/43/59/1107724359.db2.gz NCYYTPABGNJFPX-AEFFLSMTSA-N 2 0 373.541 4.475 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@@H]3CC[C@H](c4cccc(F)c4)C3)sc2C1 ZINC000475555701 1107725067 /nfs/dbraw/zinc/72/50/67/1107725067.db2.gz NCYYTPABGNJFPX-FUHWJXTLSA-N 2 0 373.541 4.475 20 0 FIADRP COc1cc2c(c(C[NH2+]Cc3cccc(C[N@H+](C)C(C)C)c3)c1)O[C@H](C)C2 ZINC000237477547 1107745459 /nfs/dbraw/zinc/74/54/59/1107745459.db2.gz YXGWSHJKVQTBID-QGZVFWFLSA-N 2 0 368.521 4.149 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2CCN(Cc3ccccc3)CC2)cc1OC ZINC000237315353 1107792956 /nfs/dbraw/zinc/79/29/56/1107792956.db2.gz FAFQFGRDCIEXCF-KRWDZBQOSA-N 2 0 354.494 4.019 20 0 FIADRP CCc1nc(C)c(CN2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)o1 ZINC000428366707 1107900064 /nfs/dbraw/zinc/90/00/64/1107900064.db2.gz YWLBLOUMVNMRIY-WOJBJXKFSA-N 2 0 353.510 4.032 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CCC[NH+]2CCCC2)c2ccc(OC)cc2)cc1 ZINC000531688719 1108055569 /nfs/dbraw/zinc/05/55/69/1108055569.db2.gz BQGFTKYFGXYHFD-HSZRJFAPSA-N 2 0 368.521 4.063 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453089179 1108160169 /nfs/dbraw/zinc/16/01/69/1108160169.db2.gz JXFMKXREVNNYCT-HXUWFJFHSA-N 2 0 350.934 4.272 20 0 FIADRP CCn1ccnc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000453105153 1108172554 /nfs/dbraw/zinc/17/25/54/1108172554.db2.gz FFOJYIHYVIGBDY-MRXNPFEDSA-N 2 0 360.933 4.119 20 0 FIADRP c1csc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)n1 ZINC000453144445 1108195279 /nfs/dbraw/zinc/19/52/79/1108195279.db2.gz MNIXZEQBXUHGPH-SLFFLAALSA-N 2 0 355.551 4.109 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@H](C)c2ncc(-c3ccccc3)n2C)C1 ZINC000453178834 1108222821 /nfs/dbraw/zinc/22/28/21/1108222821.db2.gz TWKVYAPCONHUGX-RTBURBONSA-N 2 0 354.542 4.106 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CCOC4(CCC4)C3)[C@H]3CCC[C@H]32)cc1 ZINC000453155341 1108224309 /nfs/dbraw/zinc/22/43/09/1108224309.db2.gz BASAEAOBKMMIDY-YUMYIRISSA-N 2 0 354.538 4.121 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453194812 1108264156 /nfs/dbraw/zinc/26/41/56/1108264156.db2.gz IGLUSVHWENVHJE-TXTKFYIRSA-N 2 0 351.538 4.293 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CCOC4(CCC4)C3)[C@H]3CCC[C@@H]32)cc1 ZINC000453331659 1108388295 /nfs/dbraw/zinc/38/82/95/1108388295.db2.gz ZQCFLUHLEUHZHB-LUKWVAJMSA-N 2 0 368.565 4.369 20 0 FIADRP Cc1ncsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453310468 1108396898 /nfs/dbraw/zinc/39/68/98/1108396898.db2.gz QTUGEHDIVYSSFK-ZCNNSNEGSA-N 2 0 355.551 4.027 20 0 FIADRP FCC1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000453316458 1108405279 /nfs/dbraw/zinc/40/52/79/1108405279.db2.gz WVOFXCWRWJQXOW-YPAWHYETSA-N 2 0 374.544 4.033 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CCOC4(CCC4)C2)C3)cc1 ZINC000453326612 1108418697 /nfs/dbraw/zinc/41/86/97/1108418697.db2.gz VGOZFWJZPVQTLT-YSFYHYPLSA-N 2 0 354.538 4.121 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCc2c1c(Br)ccc2F)C1CC1 ZINC000453388620 1108474050 /nfs/dbraw/zinc/47/40/50/1108474050.db2.gz BTGCPFOIIDXYAI-MRXNPFEDSA-N 2 0 355.295 4.040 20 0 FIADRP CC(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CCOCC3)cc2)cc1 ZINC000532188191 1108698808 /nfs/dbraw/zinc/69/88/08/1108698808.db2.gz IPHZRKJPAWJIJT-LJQANCHMSA-N 2 0 352.522 4.493 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC000532226010 1108722115 /nfs/dbraw/zinc/72/21/15/1108722115.db2.gz LPKXKHDOEFPMQO-UHFFFAOYSA-N 3 0 371.613 4.184 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCc2ccccc21)C1CC[NH+](C)CC1 ZINC000532358580 1108769983 /nfs/dbraw/zinc/76/99/83/1108769983.db2.gz OICXDRWJHZQYKS-FQEVSTJZSA-N 2 0 363.549 4.037 20 0 FIADRP COc1ccc(CNCCC[N@H+](C)C2CCCCC2)c(OC(F)F)c1 ZINC000524457248 1109019918 /nfs/dbraw/zinc/01/99/18/1109019918.db2.gz WNASIZIQIRNTST-UHFFFAOYSA-N 2 0 356.457 4.041 20 0 FIADRP C[N@H+](CCCCOc1ccccc1C(F)(F)F)C[C@@H]1CCC[NH+](C)C1 ZINC000524991504 1109230791 /nfs/dbraw/zinc/23/07/91/1109230791.db2.gz ZTPOTNYOBHDISW-INIZCTEOSA-N 2 0 358.448 4.138 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CCCC[NH+]3CCN(C)CC3)cc2)c1 ZINC000525181039 1109292927 /nfs/dbraw/zinc/29/29/27/1109292927.db2.gz ATQAXQIRXIAVEV-UHFFFAOYSA-N 2 0 365.565 4.088 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CCCC1 ZINC000446837214 1109356683 /nfs/dbraw/zinc/35/66/83/1109356683.db2.gz VRILNJKMSYFMDV-JOCHJYFZSA-N 2 0 356.510 4.206 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCCc4occc43)CC2)cc1 ZINC000447533512 1109570445 /nfs/dbraw/zinc/57/04/45/1109570445.db2.gz XVXVJASNBQPMEG-NRFANRHFSA-N 2 0 354.494 4.167 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CC2)s1 ZINC000447570472 1109577573 /nfs/dbraw/zinc/57/75/73/1109577573.db2.gz TVIDTDOIIYHHSV-KRWDZBQOSA-N 2 0 369.372 4.426 20 0 FIADRP Fc1ccc(Br)c2c1CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447580738 1109594799 /nfs/dbraw/zinc/59/47/99/1109594799.db2.gz RFIOQIMQTMUSIP-KRWDZBQOSA-N 2 0 367.306 4.040 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000447727229 1109627545 /nfs/dbraw/zinc/62/75/45/1109627545.db2.gz AVNYITVSFVJHNG-UHFFFAOYSA-N 2 0 372.484 4.161 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000527222465 1109716359 /nfs/dbraw/zinc/71/63/59/1109716359.db2.gz XGXLRSTVNSSIFK-RPWUZVMVSA-N 2 0 365.565 4.005 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527640617 1109792280 /nfs/dbraw/zinc/79/22/80/1109792280.db2.gz NFRMZBWEYVBEBW-PKTZIBPZSA-N 2 0 357.586 4.110 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CCC[C@H](c4ccccc4)CC3)CC2)CC1 ZINC000527651178 1109796120 /nfs/dbraw/zinc/79/61/20/1109796120.db2.gz UBARSTHTNWSPSS-VXKWHMMOSA-N 2 0 369.597 4.251 20 0 FIADRP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000527852933 1109838765 /nfs/dbraw/zinc/83/87/65/1109838765.db2.gz PKYYSBQDQUYXCO-RTBURBONSA-N 2 0 366.553 4.198 20 0 FIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)c(Br)cc1F ZINC000527884550 1109849593 /nfs/dbraw/zinc/84/95/93/1109849593.db2.gz GJPGSRJWIBPRIO-NSHDSACASA-N 2 0 361.274 4.110 20 0 FIADRP Cc1cccc([C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)C(C)C)c1 ZINC000527898209 1109853970 /nfs/dbraw/zinc/85/39/70/1109853970.db2.gz HXVIAQMSSGMHAZ-JOCHJYFZSA-N 2 0 355.526 4.207 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)OC)c1 ZINC000527917379 1109861840 /nfs/dbraw/zinc/86/18/40/1109861840.db2.gz CXLSBWYPBOSTQA-WTNAPCKOSA-N 2 0 360.542 4.015 20 0 FIADRP Brc1ccc(/C=C/CC[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000527930449 1109869700 /nfs/dbraw/zinc/86/97/00/1109869700.db2.gz JUTSTDATLSYVIL-HNQUOIGGSA-N 2 0 363.343 4.316 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC/C=C\c1ccc(Br)cc1 ZINC000527932580 1109870099 /nfs/dbraw/zinc/87/00/99/1109870099.db2.gz NKZPDANFWUYYQR-FPSUTLCTSA-N 2 0 351.332 4.171 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCOC2)cc1C[NH+]1CCCCC1 ZINC000527933522 1109870205 /nfs/dbraw/zinc/87/02/05/1109870205.db2.gz VMAZYFUVVTWXTR-OALUTQOASA-N 2 0 360.542 4.148 20 0 FIADRP Fc1cccc(F)c1-c1ncc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)s1 ZINC000449046290 1109966704 /nfs/dbraw/zinc/96/67/04/1109966704.db2.gz KQLACBBNHWWVHQ-CQSZACIVSA-N 2 0 373.428 4.137 20 0 FIADRP c1c2cccnc2oc1CN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000449049221 1109967931 /nfs/dbraw/zinc/96/79/31/1109967931.db2.gz RGZIZRMOFDSENN-IRLDBZIGSA-N 2 0 361.489 4.314 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000449051030 1109968466 /nfs/dbraw/zinc/96/84/66/1109968466.db2.gz WLVIAJMRSKFMEG-YWZLYKJASA-N 2 0 371.525 4.398 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCc2cn3c(n2)CCCC3)CC1 ZINC000449077665 1109974553 /nfs/dbraw/zinc/97/45/53/1109974553.db2.gz SKNQKYDLSCHAOH-UHFFFAOYSA-N 2 0 360.590 4.031 20 0 FIADRP COc1cc(C[NH2+]Cc2ccccc2OCC[NH+](C)C)cc2ccccc21 ZINC000449103492 1109976440 /nfs/dbraw/zinc/97/64/40/1109976440.db2.gz BGSUFRWUNPGHFC-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP COc1cccc2c(C[NH2+]Cc3ccccc3OCC[NH+](C)C)cccc12 ZINC000449105224 1109976918 /nfs/dbraw/zinc/97/69/18/1109976918.db2.gz HTLUQPASLVMABS-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449127212 1109981443 /nfs/dbraw/zinc/98/14/43/1109981443.db2.gz OKDRYGSAMVMFSB-WOJBJXKFSA-N 2 0 366.549 4.399 20 0 FIADRP C[C@H](Cc1cccc(O)c1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449131751 1109982371 /nfs/dbraw/zinc/98/23/71/1109982371.db2.gz PHNHNRJLVFYEGJ-MOPGFXCFSA-N 2 0 352.522 4.008 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000449188274 1109991013 /nfs/dbraw/zinc/99/10/13/1109991013.db2.gz KAWBGHNNMACIHR-UGKGYDQZSA-N 2 0 356.554 4.163 20 0 FIADRP CC(C)[NH+]1CCC(O)(C[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449196618 1109992305 /nfs/dbraw/zinc/99/23/05/1109992305.db2.gz YMJCOVUUAWLDJB-HXUWFJFHSA-N 2 0 362.945 4.101 20 0 FIADRP COc1cc2ccccc2cc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000449245332 1110010701 /nfs/dbraw/zinc/01/07/01/1110010701.db2.gz ABFKKIFBPCUPOH-UHFFFAOYSA-N 2 0 361.489 4.250 20 0 FIADRP c1cc(N2CCC(C[NH2+]C3CCC(OC4CCCC4)CC3)CC2)cc[nH+]1 ZINC000449245398 1110010869 /nfs/dbraw/zinc/01/08/69/1110010869.db2.gz APPAGBFHHDVQTO-UHFFFAOYSA-N 2 0 357.542 4.158 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)CC1 ZINC000449247458 1110011274 /nfs/dbraw/zinc/01/12/74/1110011274.db2.gz GIZDJKLDOPSHNV-KNQAVFIVSA-N 2 0 350.591 4.460 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@]2(C)CCO[C@H]2C2CC2)CC1 ZINC000449247460 1110011301 /nfs/dbraw/zinc/01/13/01/1110011301.db2.gz GIZDJKLDOPSHNV-UGKGYDQZSA-N 2 0 350.591 4.460 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC23CCOCC3)CC1 ZINC000449308251 1110023431 /nfs/dbraw/zinc/02/34/31/1110023431.db2.gz VSYOKUFCYZIZHF-KNQAVFIVSA-N 2 0 356.554 4.021 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cccc4ccoc43)cc2)CC1 ZINC000449309954 1110029361 /nfs/dbraw/zinc/02/93/61/1110029361.db2.gz CZSBMLBYENXUNI-UHFFFAOYSA-N 2 0 350.462 4.196 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](C)c2ccc3n[nH]cc3c2)CC1 ZINC000449316963 1110031078 /nfs/dbraw/zinc/03/10/78/1110031078.db2.gz APKUFBXLNGLNQG-QZTJIDSGSA-N 2 0 362.521 4.309 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000449343239 1110034711 /nfs/dbraw/zinc/03/47/11/1110034711.db2.gz IXGLJMWFHLZNFB-XZOQPEGZSA-N 2 0 370.581 4.474 20 0 FIADRP CSC1(C[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH+](C)CC1 ZINC000449339733 1110041894 /nfs/dbraw/zinc/04/18/94/1110041894.db2.gz UZISPJASNCXWPP-FUHWJXTLSA-N 2 0 352.975 4.393 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449339260 1110042598 /nfs/dbraw/zinc/04/25/98/1110042598.db2.gz TXKHHGDXQVKMNU-HXUWFJFHSA-N 2 0 365.565 4.353 20 0 FIADRP CC[C@H](COCC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449377437 1110051075 /nfs/dbraw/zinc/05/10/75/1110051075.db2.gz AEDRFJZXTJOIKY-FUHWJXTLSA-N 2 0 372.475 4.029 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449440413 1110080208 /nfs/dbraw/zinc/08/02/08/1110080208.db2.gz ZHJBMHVCMPIKGA-YJBOKZPZSA-N 2 0 363.427 4.101 20 0 FIADRP CC(=O)c1cccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000450344603 1110285403 /nfs/dbraw/zinc/28/54/03/1110285403.db2.gz IGTFTCVBBQNLMN-UHFFFAOYSA-N 2 0 350.506 4.233 20 0 FIADRP CC[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000450633218 1110322798 /nfs/dbraw/zinc/32/27/98/1110322798.db2.gz XVMHAXOKNSQFMW-GOSISDBHSA-N 2 0 358.357 4.014 20 0 FIADRP Cc1ccccc1COc1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000538407619 1111129284 /nfs/dbraw/zinc/12/92/84/1111129284.db2.gz HTBIJJKAXYZBRU-IBGZPJMESA-N 2 0 350.506 4.487 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000461385687 1111192567 /nfs/dbraw/zinc/19/25/67/1111192567.db2.gz ICFMQBMQMVQKHP-IAGOWNOFSA-N 2 0 366.496 4.336 20 0 FIADRP FC(F)(F)Oc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168359503 1111205107 /nfs/dbraw/zinc/20/51/07/1111205107.db2.gz AVQBWVAYTCDBTF-KRWDZBQOSA-N 2 0 354.416 4.037 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc(Cl)s3)CC2)C[C@H](C)O1 ZINC000538721579 1111262088 /nfs/dbraw/zinc/26/20/88/1111262088.db2.gz RTMVHTDAPHJZAL-GASCZTMLSA-N 2 0 356.963 4.113 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539057030 1111403890 /nfs/dbraw/zinc/40/38/90/1111403890.db2.gz KXLUIIKCAMJVKA-CDNPAEQRSA-N 2 0 358.570 4.304 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000539218639 1111480306 /nfs/dbraw/zinc/48/03/06/1111480306.db2.gz XMPNSUFRAYNJDA-ZRBLBEILSA-N 2 0 374.544 4.415 20 0 FIADRP Clc1ccc2c(c1)OCCC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539311932 1111508178 /nfs/dbraw/zinc/50/81/78/1111508178.db2.gz GBIBBDDKMRTFPB-FQEVSTJZSA-N 2 0 371.912 4.455 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000643522339 1111543492 /nfs/dbraw/zinc/54/34/92/1111543492.db2.gz LUVPLDYMKTYSNW-PWSUYJOCSA-N 2 0 365.237 4.261 20 0 FIADRP CN(C)[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccsc1 ZINC000552040654 1111554012 /nfs/dbraw/zinc/55/40/12/1111554012.db2.gz IAERYXKTGBHCDK-LZBANZJXSA-N 2 0 371.594 4.384 20 0 FIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@@H]2CCCCC23CCCC3)c2ccccc2)CC1 ZINC000552072244 1111573315 /nfs/dbraw/zinc/57/33/15/1111573315.db2.gz PFJVCWKTSGVFPG-FGZHOGPDSA-N 2 0 355.570 4.068 20 0 FIADRP C[C@H](O)[C@@](C)(C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)Cc1ccccc1 ZINC000477858847 1111580012 /nfs/dbraw/zinc/58/00/12/1111580012.db2.gz MWUDVJKBELXPND-CDPNLFKUSA-N 2 0 372.597 4.249 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477915476 1111597878 /nfs/dbraw/zinc/59/78/78/1111597878.db2.gz CHAUONBHDCLTGD-HNNXBMFYSA-N 2 0 358.555 4.286 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)CC1 ZINC000477945672 1111617822 /nfs/dbraw/zinc/61/78/22/1111617822.db2.gz YLGWZTLKVIWUEB-VOFXCDAESA-N 2 0 356.554 4.397 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1 ZINC000552224171 1111623387 /nfs/dbraw/zinc/62/33/87/1111623387.db2.gz LVYRVQNTIGRCPE-CVDCTZTESA-N 2 0 367.537 4.086 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCC(=O)OC(C)(C)C)CC1 ZINC000552247403 1111627768 /nfs/dbraw/zinc/62/77/68/1111627768.db2.gz OCIXWNSNEXHTHN-UHFFFAOYSA-N 2 0 360.542 4.141 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H]2CCC[C@@H]21 ZINC000552258324 1111638808 /nfs/dbraw/zinc/63/88/08/1111638808.db2.gz DMMDQSWACMCYPH-GBBGEASQSA-N 2 0 352.444 4.414 20 0 FIADRP CC(C)(C)c1n[nH]cc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552272780 1111654316 /nfs/dbraw/zinc/65/43/16/1111654316.db2.gz AAJXXQDQIUOTOI-UHFFFAOYSA-N 2 0 366.553 4.195 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2nc3ccccc3n2C)CC1 ZINC000478051469 1111666073 /nfs/dbraw/zinc/66/60/73/1111666073.db2.gz CAHNXSJNXDOBBM-IBGZPJMESA-N 2 0 368.569 4.092 20 0 FIADRP c1sc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1-c1ccccc1 ZINC000552301405 1111666079 /nfs/dbraw/zinc/66/60/79/1111666079.db2.gz APVXKLNRJKDGAA-UHFFFAOYSA-N 2 0 370.562 4.492 20 0 FIADRP CN(c1ccnc2ccc(Br)cc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000553297292 1111943509 /nfs/dbraw/zinc/94/35/09/1111943509.db2.gz OVANSJFRZFGJHX-YIONKMFJSA-N 2 0 360.299 4.059 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479285165 1111981955 /nfs/dbraw/zinc/98/19/55/1111981955.db2.gz PMBPDKJFQFURFE-FQEVSTJZSA-N 2 0 373.338 4.470 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000479295992 1111988145 /nfs/dbraw/zinc/98/81/45/1111988145.db2.gz NFTMMFTZTWBBMS-MXWWQKGMSA-N 2 0 353.348 4.090 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(F)ccc1F ZINC000479353198 1111996697 /nfs/dbraw/zinc/99/66/97/1111996697.db2.gz XRRSYDIOTSCAQJ-NRFANRHFSA-N 2 0 362.464 4.392 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3nn(C)cc32)C1 ZINC000479344000 1112001427 /nfs/dbraw/zinc/00/14/27/1112001427.db2.gz KYHIBPPZMGFDMP-KGVIQGDOSA-N 2 0 366.553 4.065 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479392542 1112010854 /nfs/dbraw/zinc/01/08/54/1112010854.db2.gz OVNONGHGCDPHGR-GOSISDBHSA-N 2 0 351.332 4.289 20 0 FIADRP Cc1ccc2[nH+]ccc(NCc3ccc(OC4CC[NH+](C)CC4)cc3)c2c1 ZINC000553592615 1112014236 /nfs/dbraw/zinc/01/42/36/1112014236.db2.gz TZLZDIKORPXUEO-UHFFFAOYSA-N 2 0 361.489 4.050 20 0 FIADRP Cc1cc(NCc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc2[nH+]1 ZINC000553591517 1112019596 /nfs/dbraw/zinc/01/95/96/1112019596.db2.gz DYWXPGUAWLTXBQ-UHFFFAOYSA-N 2 0 361.489 4.050 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000479681620 1112112229 /nfs/dbraw/zinc/11/22/29/1112112229.db2.gz BOGMBBIAZYDAGZ-IBGZPJMESA-N 2 0 354.542 4.186 20 0 FIADRP Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480022875 1112235374 /nfs/dbraw/zinc/23/53/74/1112235374.db2.gz VZMOFSKHZKPDOL-ZCNNSNEGSA-N 2 0 352.522 4.455 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000480163584 1112310147 /nfs/dbraw/zinc/31/01/47/1112310147.db2.gz FMOJJDOAGMXLCO-QHCPKHFHSA-N 2 0 350.506 4.458 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCO[C@H](C(F)(F)F)C2)C1 ZINC000554349381 1112311550 /nfs/dbraw/zinc/31/15/50/1112311550.db2.gz KTWBMRTYDJJZOM-LZQZEXGQSA-N 2 0 370.459 4.118 20 0 FIADRP CC[N@@H+](Cc1cc(COC)cs1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000667684029 1112452965 /nfs/dbraw/zinc/45/29/65/1112452965.db2.gz ILENFQIWXIUZTJ-IBGZPJMESA-N 2 0 358.551 4.239 20 0 FIADRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cccc(C4CCCC4)c3)CC2)CC1 ZINC000667688456 1112460311 /nfs/dbraw/zinc/46/03/11/1112460311.db2.gz SQCGGSTWLBOUMW-UHFFFAOYSA-N 2 0 369.597 4.335 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000480535475 1112465398 /nfs/dbraw/zinc/46/53/98/1112465398.db2.gz JXYMRCXXTVYZCD-LJQANCHMSA-N 2 0 367.537 4.156 20 0 FIADRP CCC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480534357 1112465619 /nfs/dbraw/zinc/46/56/19/1112465619.db2.gz DGLJHAYNQWOQQU-IBGZPJMESA-N 2 0 372.384 4.450 20 0 FIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2ccncc2OCC[NH+](C)C)cc1 ZINC000554740715 1112466966 /nfs/dbraw/zinc/46/69/66/1112466966.db2.gz HIOPAIAPDLXLPB-GOSISDBHSA-N 2 0 355.526 4.071 20 0 FIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480552631 1112472630 /nfs/dbraw/zinc/47/26/30/1112472630.db2.gz JREOWLBGSGVITR-HXUWFJFHSA-N 2 0 369.553 4.266 20 0 FIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000480560541 1112478137 /nfs/dbraw/zinc/47/81/37/1112478137.db2.gz XACGXIQFARSWOG-IBGZPJMESA-N 2 0 351.538 4.030 20 0 FIADRP Cc1cc(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)c2ccccc2[nH+]1 ZINC000480555410 1112483027 /nfs/dbraw/zinc/48/30/27/1112483027.db2.gz OWUGIVAMKSBLDT-UHFFFAOYSA-N 2 0 363.427 4.182 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)nnn1-c1ccc(C)cc1 ZINC000480615898 1112502879 /nfs/dbraw/zinc/50/28/79/1112502879.db2.gz VTHIATNWBXTJCR-RBUKOAKNSA-N 2 0 369.557 4.047 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480630801 1112510388 /nfs/dbraw/zinc/51/03/88/1112510388.db2.gz LQSVCEMZENNSIJ-XLIONFOSSA-N 2 0 351.966 4.043 20 0 FIADRP Cc1ccncc1CCC[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000554861685 1112526918 /nfs/dbraw/zinc/52/69/18/1112526918.db2.gz PFPVMNALJDWZCQ-NPHXMPSESA-N 2 0 351.538 4.069 20 0 FIADRP Clc1sccc1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000480669626 1112536676 /nfs/dbraw/zinc/53/66/76/1112536676.db2.gz VFNNDHZHRBHKJS-UHFFFAOYSA-N 2 0 363.958 4.094 20 0 FIADRP c1cc(C[NH+]2CCCC2)ccc1C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000480664998 1112543105 /nfs/dbraw/zinc/54/31/05/1112543105.db2.gz FJMKOQWWPLBBNQ-UHFFFAOYSA-N 2 0 350.506 4.361 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](CC(C)C)c3ccccc3)cn2)CC1 ZINC000480740903 1112580043 /nfs/dbraw/zinc/58/00/43/1112580043.db2.gz QQRBRUYYJZWNER-QFIPXVFZSA-N 2 0 366.553 4.101 20 0 FIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480755252 1112588190 /nfs/dbraw/zinc/58/81/90/1112588190.db2.gz GNGLXXYPOSAXAS-BFHYXJOUSA-N 2 0 357.325 4.223 20 0 FIADRP CCC[C@H]([NH2+]CCCC[NH+]1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000480777964 1112593374 /nfs/dbraw/zinc/59/33/74/1112593374.db2.gz WLWQAEHOVQKFTI-FQEVSTJZSA-N 2 0 351.966 4.189 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000480782767 1112595364 /nfs/dbraw/zinc/59/53/64/1112595364.db2.gz XTIPIWJXZSJJMV-ICSRJNTNSA-N 2 0 357.567 4.086 20 0 FIADRP [NH2+]=C(NC1CC[NH+](CC2CC2)CC1)c1cc(C(F)(F)F)ccc1Cl ZINC001168364615 1112625974 /nfs/dbraw/zinc/62/59/74/1112625974.db2.gz FVWHRYGNLRLLSW-UHFFFAOYSA-N 2 0 359.823 4.148 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000480914691 1112668443 /nfs/dbraw/zinc/66/84/43/1112668443.db2.gz VFOMUZMYYHTFRX-DVECYGJZSA-N 2 0 363.549 4.162 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3cccc(Br)c3C2)C1 ZINC000555536837 1112913542 /nfs/dbraw/zinc/91/35/42/1112913542.db2.gz ABJGDEPZEZCZIM-WBVHZDCISA-N 2 0 365.359 4.016 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCC1 ZINC000481556793 1112980526 /nfs/dbraw/zinc/98/05/26/1112980526.db2.gz KJMHXPAYXRAOOF-MAUKXSAKSA-N 2 0 354.460 4.447 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732139 1113058788 /nfs/dbraw/zinc/05/87/88/1113058788.db2.gz DWZRYNCQVUZFRU-SJORKVTESA-N 2 0 355.295 4.113 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cs1 ZINC000481907038 1113134663 /nfs/dbraw/zinc/13/46/63/1113134663.db2.gz GTWJTLLOCXRRPQ-XLIONFOSSA-N 2 0 357.567 4.309 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3F)C2)[C@H](C)C1 ZINC000482074766 1113171919 /nfs/dbraw/zinc/17/19/19/1113171919.db2.gz KYNHVFUTXQYOBK-MOXWOTFGSA-N 2 0 362.533 4.188 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000482134092 1113178661 /nfs/dbraw/zinc/17/86/61/1113178661.db2.gz FLXFUKWLUVSYMY-UXHICEINSA-N 2 0 370.541 4.159 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC000482137658 1113179538 /nfs/dbraw/zinc/17/95/38/1113179538.db2.gz MZJZHNIEVFQSDI-RDPSFJRHSA-N 2 0 368.565 4.499 20 0 FIADRP FC(F)Oc1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000065234837 1113204343 /nfs/dbraw/zinc/20/43/43/1113204343.db2.gz PNOAXWJWJVDEIY-UHFFFAOYSA-N 2 0 352.469 4.376 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]CCCc3ccc4c(c3)CCO4)CC2)CC1 ZINC000482233992 1113206321 /nfs/dbraw/zinc/20/63/21/1113206321.db2.gz JDIVOXVMPWTOLK-UHFFFAOYSA-N 2 0 356.554 4.187 20 0 FIADRP COc1ccc(OC)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000162903555 1113206797 /nfs/dbraw/zinc/20/67/97/1113206797.db2.gz CXTUDVNJMGDYRS-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000482251077 1113210559 /nfs/dbraw/zinc/21/05/59/1113210559.db2.gz BAEWSNVHVMWSEV-YADARESESA-N 2 0 374.532 4.028 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(OC)c1 ZINC000482434946 1113254020 /nfs/dbraw/zinc/25/40/20/1113254020.db2.gz HGGDXCWGMARFSB-OFNKIYASSA-N 2 0 352.522 4.301 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000482438632 1113255168 /nfs/dbraw/zinc/25/51/68/1113255168.db2.gz MTPPNJBBWAZZIL-UYAOXDASSA-N 2 0 369.528 4.107 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000482441435 1113257176 /nfs/dbraw/zinc/25/71/76/1113257176.db2.gz VBGJVNANOBGTBG-IRLDBZIGSA-N 2 0 374.532 4.088 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cc1N(C)C ZINC000162932789 1113258681 /nfs/dbraw/zinc/25/86/81/1113258681.db2.gz FHHCQUAQUNPMTO-QGZVFWFLSA-N 2 0 355.501 4.338 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2c(s1)CCC2 ZINC000482460149 1113267609 /nfs/dbraw/zinc/26/76/09/1113267609.db2.gz PJKRDKOCMIGJLX-INIZCTEOSA-N 2 0 358.551 4.418 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)CC1 ZINC000482501686 1113278628 /nfs/dbraw/zinc/27/86/28/1113278628.db2.gz CAOKDLDLNOVVEN-OAHLLOKOSA-N 2 0 358.448 4.400 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cnn(-c3ccc(F)cc3)c2C)CC1 ZINC000482506389 1113279872 /nfs/dbraw/zinc/27/98/72/1113279872.db2.gz HWEVNSVJGSUHGY-MRXNPFEDSA-N 2 0 358.505 4.092 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482548652 1113291005 /nfs/dbraw/zinc/29/10/05/1113291005.db2.gz NCMLQXAHWQQHHW-VGOFRKELSA-N 2 0 367.512 4.306 20 0 FIADRP CC(C)CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482548245 1113291443 /nfs/dbraw/zinc/29/14/43/1113291443.db2.gz FDUFLAOHEQHQRV-XLIONFOSSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000482561485 1113296476 /nfs/dbraw/zinc/29/64/76/1113296476.db2.gz PECNVUPSXRCYIH-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482567433 1113299532 /nfs/dbraw/zinc/29/95/32/1113299532.db2.gz VLZVATGOFQEIGJ-HXUWFJFHSA-N 2 0 367.537 4.157 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1F ZINC000482652747 1113323574 /nfs/dbraw/zinc/32/35/74/1113323574.db2.gz ULDRTRJZDOPMLC-DYESRHJHSA-N 2 0 356.485 4.225 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2c3ccccc3sc21 ZINC000482866611 1113381514 /nfs/dbraw/zinc/38/15/14/1113381514.db2.gz MDSXKEQSFHUWHL-LPHOPBHVSA-N 2 0 358.551 4.105 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1cccc(OCCCc2ccccc2)c1 ZINC000482906910 1113396720 /nfs/dbraw/zinc/39/67/20/1113396720.db2.gz WPMKRSDLBDXZNQ-RDPSFJRHSA-N 2 0 366.549 4.171 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3c(s2)CCCC3)[C@@H](C)C1 ZINC000483137038 1113445996 /nfs/dbraw/zinc/44/59/96/1113445996.db2.gz SZXDMYGEAAPVQU-LNLFQRSKSA-N 2 0 364.599 4.415 20 0 FIADRP COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162372393 1113462232 /nfs/dbraw/zinc/46/22/32/1113462232.db2.gz VTTMOHHLRCDNDK-ZWKOTPCHSA-N 2 0 356.510 4.356 20 0 FIADRP Cc1ccc2ccccc2c1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000483218477 1113467074 /nfs/dbraw/zinc/46/70/74/1113467074.db2.gz ZSBCKZPFHVBXKH-UHFFFAOYSA-N 2 0 352.522 4.225 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000483219529 1113467234 /nfs/dbraw/zinc/46/72/34/1113467234.db2.gz UGCOASIGJKXVSF-OXQOHEQNSA-N 2 0 370.562 4.369 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cncc(OCc3ccccc3)c2)CC1 ZINC000486805812 1113654032 /nfs/dbraw/zinc/65/40/32/1113654032.db2.gz YONHPRDBOOXGIP-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP C[C@H]1CSCC[NH+](Cc2ccccc2C[N@H+]2CCSC[C@H](C)C2)C1 ZINC000488157974 1113864929 /nfs/dbraw/zinc/86/49/29/1113864929.db2.gz FVRNLBKSCUONJU-QZTJIDSGSA-N 2 0 364.624 4.056 20 0 FIADRP C[C@H]1CSCC[N@H+](Cc2cccc(C[NH+]3CCSC[C@@H](C)C3)c2)C1 ZINC000488198904 1113876368 /nfs/dbraw/zinc/87/63/68/1113876368.db2.gz KPOSVDUOONUWSL-HDICACEKSA-N 2 0 364.624 4.056 20 0 FIADRP N#CCCCOc1cccc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1 ZINC000080373623 1113894020 /nfs/dbraw/zinc/89/40/20/1113894020.db2.gz WHIDVMLHJAXDNF-UHFFFAOYSA-N 2 0 355.526 4.256 20 0 FIADRP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000488404293 1113923213 /nfs/dbraw/zinc/92/32/13/1113923213.db2.gz ZKLKPIHSUPANPW-IBGZPJMESA-N 2 0 369.336 4.025 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000490157421 1114219585 /nfs/dbraw/zinc/21/95/85/1114219585.db2.gz MEQPYUUCCCVRAL-IBGZPJMESA-N 2 0 361.327 4.470 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCCN2CCC[N@@H+](C)CC2)c2ccccc2)c1 ZINC000491010662 1114359653 /nfs/dbraw/zinc/35/96/53/1114359653.db2.gz UEHHGVTZTOMRLM-XMMPIXPASA-N 2 0 365.565 4.010 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000571006379 1114427715 /nfs/dbraw/zinc/42/77/15/1114427715.db2.gz ROBYWWQJAMIWCM-BWDFOLQRSA-N 2 0 356.460 4.323 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]CCC(=O)Nc2cccc(Cl)c2)cc1 ZINC000571385685 1114460632 /nfs/dbraw/zinc/46/06/32/1114460632.db2.gz QOCGHFIUIOPNMF-UHFFFAOYSA-N 2 0 373.928 4.300 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)cc1 ZINC000588179107 1114549574 /nfs/dbraw/zinc/54/95/74/1114549574.db2.gz CVKBIEGNFKAZAG-UHFFFAOYSA-N 2 0 356.485 4.325 20 0 FIADRP Fc1ccc(C2([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)CCC2)cc1 ZINC000588179239 1114549747 /nfs/dbraw/zinc/54/97/47/1114549747.db2.gz OSUFONLWGKSPSO-UHFFFAOYSA-N 2 0 368.496 4.469 20 0 FIADRP C[C@H](c1ccccc1Cl)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000588710758 1114601911 /nfs/dbraw/zinc/60/19/11/1114601911.db2.gz LARARRYYLMKYRW-BRWVUGGUSA-N 2 0 350.934 4.222 20 0 FIADRP CN1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C[C@H]1c1ccccc1 ZINC000572370809 1114638393 /nfs/dbraw/zinc/63/83/93/1114638393.db2.gz APHQHDBWHPSVPP-RPWUZVMVSA-N 2 0 363.549 4.208 20 0 FIADRP CSc1ccc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000572895395 1114805270 /nfs/dbraw/zinc/80/52/70/1114805270.db2.gz WLOITPPZQXYGJA-HOTGVXAUSA-N 2 0 368.612 4.181 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cccc(Br)c2)C1 ZINC000589837387 1114847401 /nfs/dbraw/zinc/84/74/01/1114847401.db2.gz SPVJRGCBGUEEFD-HOTGVXAUSA-N 2 0 353.348 4.297 20 0 FIADRP CC[N@H+](CCC(=O)Nc1cccc(Cl)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999393 1114872770 /nfs/dbraw/zinc/87/27/70/1114872770.db2.gz FIXAQOQJWGYBEB-UHFFFAOYSA-N 2 0 373.928 4.252 20 0 FIADRP COc1cccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cs2)c1 ZINC000590786950 1114974154 /nfs/dbraw/zinc/97/41/54/1114974154.db2.gz ZREUBHYNWWANBL-UHFFFAOYSA-N 2 0 373.566 4.371 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786160 1114974607 /nfs/dbraw/zinc/97/46/07/1114974607.db2.gz DMKCSAPNKDCLNN-SFHVURJKSA-N 2 0 373.585 4.191 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H](c2cccnc2)C2CCCCC2)cc1 ZINC000590798228 1114975847 /nfs/dbraw/zinc/97/58/47/1114975847.db2.gz KMIRMZMUJYAMOJ-HSZRJFAPSA-N 2 0 367.537 4.433 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H](c2cccnc2)C2CCCCC2)cc1 ZINC000590798229 1114976071 /nfs/dbraw/zinc/97/60/71/1114976071.db2.gz KMIRMZMUJYAMOJ-QHCPKHFHSA-N 2 0 367.537 4.433 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000573255774 1115086864 /nfs/dbraw/zinc/08/68/64/1115086864.db2.gz JLXKALVYLNKLAM-YSZBQJHXSA-N 2 0 368.521 4.198 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC1 ZINC000573315589 1115094369 /nfs/dbraw/zinc/09/43/69/1115094369.db2.gz GTIIXLHFIBMOST-FVKWTLKZSA-N 2 0 362.315 4.167 20 0 FIADRP CC[C@H]1CC[C@H](c2ccc(-c3noc(CC4([NH3+])CC[NH2+]CC4)n3)cc2)CC1 ZINC001212168883 1115128833 /nfs/dbraw/zinc/12/88/33/1115128833.db2.gz NMCSIMKVSPDJCD-QAQDUYKDSA-N 2 0 368.525 4.044 20 0 FIADRP CCOC(=O)C(C)(C)CCC[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000593608256 1115335342 /nfs/dbraw/zinc/33/53/42/1115335342.db2.gz KPHSEZSZLBULDB-QGZVFWFLSA-N 2 0 352.563 4.131 20 0 FIADRP Clc1ccc(/C=C/C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc1 ZINC001168402976 1115354912 /nfs/dbraw/zinc/35/49/12/1115354912.db2.gz MOWLDCVGKVQWMN-HNQUOIGGSA-N 2 0 362.945 4.178 20 0 FIADRP Cc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000574395584 1115359699 /nfs/dbraw/zinc/35/96/99/1115359699.db2.gz CGXZRMMUEPSFGC-UTKZUKDTSA-N 2 0 351.494 4.008 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000574561334 1115422446 /nfs/dbraw/zinc/42/24/46/1115422446.db2.gz CJRMCZYZPODJSA-XMMPIXPASA-N 2 0 364.533 4.443 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)cc1 ZINC000574572731 1115424385 /nfs/dbraw/zinc/42/43/85/1115424385.db2.gz FGCBYPZHRJPCLT-SFHVURJKSA-N 2 0 363.274 4.288 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000595626028 1115551436 /nfs/dbraw/zinc/55/14/36/1115551436.db2.gz BGQJOHHZEFDGDX-UHFFFAOYSA-N 2 0 362.949 4.390 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1sccc1Br ZINC000658354337 1115581987 /nfs/dbraw/zinc/58/19/87/1115581987.db2.gz CGYFMRUGUOLHLW-GFCCVEGCSA-N 2 0 357.361 4.283 20 0 FIADRP COC(=O)c1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000597042630 1115635811 /nfs/dbraw/zinc/63/58/11/1115635811.db2.gz DRJFLOMCDBZWQH-UHFFFAOYSA-N 2 0 372.896 4.012 20 0 FIADRP [NH3+]C1(c2cccc(Cl)c2)CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415322 1115813150 /nfs/dbraw/zinc/81/31/50/1115813150.db2.gz NQSRQAZEMYOILN-FQEVSTJZSA-N 2 0 358.888 4.286 20 0 FIADRP [NH3+]C1(c2cccc(Cl)c2)CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415323 1115813370 /nfs/dbraw/zinc/81/33/70/1115813370.db2.gz NQSRQAZEMYOILN-HXUWFJFHSA-N 2 0 358.888 4.286 20 0 FIADRP [NH3+]C1(Cc2ccc(Cl)cc2)CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415469 1115822214 /nfs/dbraw/zinc/82/22/14/1115822214.db2.gz BQOYBDAHNGKMSU-NRFANRHFSA-N 2 0 372.915 4.372 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc3ccc(Cl)cn23)c1 ZINC000606469580 1115947976 /nfs/dbraw/zinc/94/79/76/1115947976.db2.gz ILPNIWPCBWUBQG-UHFFFAOYSA-N 2 0 356.901 4.118 20 0 FIADRP COc1cc(OC)cc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000608061467 1116079829 /nfs/dbraw/zinc/07/98/29/1116079829.db2.gz DZYBTZVTNFSIIU-FUHWJXTLSA-N 2 0 370.493 4.068 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000608061238 1116079888 /nfs/dbraw/zinc/07/98/88/1116079888.db2.gz IEUXEKXMUUMRBI-KNQAVFIVSA-N 2 0 352.522 4.271 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000608061241 1116079949 /nfs/dbraw/zinc/07/99/49/1116079949.db2.gz JBWNQVXVKUBLBM-DENIHFKCSA-N 2 0 374.532 4.420 20 0 FIADRP Cc1cccc(O[C@H](C)C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000608064522 1116080341 /nfs/dbraw/zinc/08/03/41/1116080341.db2.gz CLBLASVPDXFEBZ-HXUWFJFHSA-N 2 0 368.521 4.027 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000534059660 1116153677 /nfs/dbraw/zinc/15/36/77/1116153677.db2.gz SGSHKRDZOPZMKL-INIZCTEOSA-N 2 0 357.723 4.021 20 0 FIADRP CCOc1c(Cl)cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1OC ZINC000534346973 1116187102 /nfs/dbraw/zinc/18/71/02/1116187102.db2.gz JHMICJFRYFYCNQ-UHFFFAOYSA-N 2 0 368.949 4.300 20 0 FIADRP CCC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000534494175 1116207227 /nfs/dbraw/zinc/20/72/27/1116207227.db2.gz AMHYPZRVEASWJZ-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2ccccc2o1 ZINC000539559772 1116343987 /nfs/dbraw/zinc/34/39/87/1116343987.db2.gz BZYWQXRUURTQBS-JOCHJYFZSA-N 2 0 367.493 4.255 20 0 FIADRP Cc1ccc(CC[C@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000539690842 1116366310 /nfs/dbraw/zinc/36/63/10/1116366310.db2.gz WVZYRALKKJOCCL-IBGZPJMESA-N 2 0 366.553 4.354 20 0 FIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000504900426 1116371488 /nfs/dbraw/zinc/37/14/88/1116371488.db2.gz XUJYDDZBNVXPAC-PZJWPPBQSA-N 2 0 355.570 4.083 20 0 FIADRP COc1ccc2cc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000539895358 1117739042 /nfs/dbraw/zinc/73/90/42/1117739042.db2.gz CSQNUOJRLZVMPQ-NFBKMPQASA-N 2 0 350.506 4.297 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CCCC[N@@H+]3CCC[C@H]3CO)cc2)c1 ZINC000462746522 1117749904 /nfs/dbraw/zinc/74/99/04/1117749904.db2.gz URTCMVVQEBYLHK-DEOSSOPVSA-N 2 0 366.549 4.297 20 0 FIADRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(C3CCCC3)cc2)CC1 ZINC000462783467 1117765773 /nfs/dbraw/zinc/76/57/73/1117765773.db2.gz PDUHEJFDBSNCTO-PKTZIBPZSA-N 2 0 356.554 4.202 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1csc(-c2ccccc2F)n1 ZINC000462802292 1117785671 /nfs/dbraw/zinc/78/56/71/1117785671.db2.gz KRCXEQLPBVYBLZ-AWEZNQCLSA-N 2 0 359.514 4.474 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@H]2CC[C@H](O)CC2)c2ccc(F)cc2)CC1 ZINC000462818832 1117795461 /nfs/dbraw/zinc/79/54/61/1117795461.db2.gz QNKIFMVDQYZXEH-YPAWHYETSA-N 2 0 362.533 4.272 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H]2CCC[C@@H]21 ZINC000462820290 1117796026 /nfs/dbraw/zinc/79/60/26/1117796026.db2.gz VCATYQCAXUEJJG-GBBGEASQSA-N 2 0 363.343 4.158 20 0 FIADRP Cc1cc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462845945 1117816757 /nfs/dbraw/zinc/81/67/57/1117816757.db2.gz RWQIDACNXIRXTG-KRWDZBQOSA-N 2 0 373.928 4.054 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc(C2CCCC2)cc1 ZINC000462903355 1117850438 /nfs/dbraw/zinc/85/04/38/1117850438.db2.gz PNZRWCKMVOXEJY-UHFFFAOYSA-N 2 0 367.537 4.360 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000463090662 1117962382 /nfs/dbraw/zinc/96/23/82/1117962382.db2.gz SSDMLFZBIBJDQL-NRFANRHFSA-N 2 0 368.569 4.465 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000540262174 1117962652 /nfs/dbraw/zinc/96/26/52/1117962652.db2.gz GMXYUXYROXNBLD-KDOFPFPSSA-N 2 0 351.332 4.222 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000540262422 1117963042 /nfs/dbraw/zinc/96/30/42/1117963042.db2.gz IHNTUPOZUGSQCH-LJQANCHMSA-N 2 0 372.384 4.308 20 0 FIADRP Cc1csc(CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1 ZINC000463106576 1117967427 /nfs/dbraw/zinc/96/74/27/1117967427.db2.gz AOTININTOOQWIE-UYAOXDASSA-N 2 0 357.567 4.417 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000463109393 1117967798 /nfs/dbraw/zinc/96/77/98/1117967798.db2.gz QWNKVUACQVMJGM-NRFANRHFSA-N 2 0 368.569 4.323 20 0 FIADRP COc1cccc([C@@H](C)[NH2+][C@@H](C)CC[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000540327443 1117994252 /nfs/dbraw/zinc/99/42/52/1117994252.db2.gz CXUYHYLSAQDUQQ-OKZBNKHCSA-N 2 0 356.510 4.484 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CCCC4CCOCC4)[C@@H]3C2)cc1 ZINC000463238335 1118046569 /nfs/dbraw/zinc/04/65/69/1118046569.db2.gz UJWRSKTVNQJGSC-YTFSRNRJSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H](CC[NH2+]C1CCN(Cc2ccccc2Cl)CC1)[NH+]1CCCCC1 ZINC000463264424 1118058753 /nfs/dbraw/zinc/05/87/53/1118058753.db2.gz GDJABVTZEZQUDE-GOSISDBHSA-N 2 0 363.977 4.159 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)c1ccccc1O2 ZINC000540491580 1118091007 /nfs/dbraw/zinc/09/10/07/1118091007.db2.gz FBPASDMLHHWQHO-NNWRFLSQSA-N 2 0 362.517 4.195 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@@H]1C ZINC000463744325 1118311657 /nfs/dbraw/zinc/31/16/57/1118311657.db2.gz KJHDHKQYVPUFSI-SVFBPWRDSA-N 2 0 374.569 4.091 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000541378714 1118494944 /nfs/dbraw/zinc/49/49/44/1118494944.db2.gz WSQYQGAZBBCAHA-OAQYLSRUSA-N 2 0 362.452 4.441 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccn(C)n1 ZINC000541740815 1118628986 /nfs/dbraw/zinc/62/89/86/1118628986.db2.gz DWWPVEJTKJTXJC-LJQANCHMSA-N 2 0 360.933 4.026 20 0 FIADRP C[N@H+](CCCCOc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845143 1118718985 /nfs/dbraw/zinc/71/89/85/1118718985.db2.gz DCSAGGCVRVFABG-JOCHJYFZSA-N 2 0 352.522 4.300 20 0 FIADRP CCC1(C[NH2+]C2CC[NH+](C(C)C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542146262 1118802865 /nfs/dbraw/zinc/80/28/65/1118802865.db2.gz NXUAAHRNRFNXJF-UHFFFAOYSA-N 3 0 357.586 4.141 20 0 FIADRP CCCC[N@H+](C)CC1CCN(CN2c3cccc4cccc(c34)C2=O)CC1 ZINC000151796250 1118979100 /nfs/dbraw/zinc/97/91/00/1118979100.db2.gz ADDTVCRLZUGAEZ-UHFFFAOYSA-N 2 0 365.521 4.201 20 0 FIADRP Fc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1C(F)(F)F ZINC000311803562 1119389684 /nfs/dbraw/zinc/38/96/84/1119389684.db2.gz NXBDADUTKBHUEY-KRWDZBQOSA-N 2 0 366.402 4.456 20 0 FIADRP CC1(C)C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000178794981 1119409202 /nfs/dbraw/zinc/40/92/02/1119409202.db2.gz BKDCDRLQFGXIFS-HSZRJFAPSA-N 2 0 364.533 4.156 20 0 FIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)Cc1ccc(OC)cc1 ZINC000542466869 1119458672 /nfs/dbraw/zinc/45/86/72/1119458672.db2.gz LXPXKIPNJKWBHI-KRWDZBQOSA-N 2 0 364.493 4.037 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493923712 1119509640 /nfs/dbraw/zinc/50/96/40/1119509640.db2.gz DKJNDPWZBOCARB-STCOUPBVSA-N 2 0 351.332 4.158 20 0 FIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)c1 ZINC000493944394 1119513521 /nfs/dbraw/zinc/51/35/21/1119513521.db2.gz ILBQSSFGQOFPKJ-BHIFYINESA-N 2 0 354.538 4.110 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000186130738 1119707812 /nfs/dbraw/zinc/70/78/12/1119707812.db2.gz DNUIPVCOYMQCGZ-BBWFWOEESA-N 2 0 374.550 4.217 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000186564823 1119736503 /nfs/dbraw/zinc/73/65/03/1119736503.db2.gz VDFJUUSZLOPUNV-MSOLQXFVSA-N 2 0 357.567 4.092 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000186593043 1119738364 /nfs/dbraw/zinc/73/83/64/1119738364.db2.gz PBXOSGNHDFVXHG-MSOLQXFVSA-N 2 0 365.521 4.263 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)C3CCSCC3)CC2)cc1 ZINC000187113685 1119767816 /nfs/dbraw/zinc/76/78/16/1119767816.db2.gz NWFFMAYYBGUATF-QGZVFWFLSA-N 2 0 362.583 4.029 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(Cl)c1 ZINC000187602248 1119791447 /nfs/dbraw/zinc/79/14/47/1119791447.db2.gz RXUYAMAOCHVSKR-KRWDZBQOSA-N 2 0 372.940 4.190 20 0 FIADRP C[C@H](O)[C@](C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1 ZINC000188917031 1119805874 /nfs/dbraw/zinc/80/58/74/1119805874.db2.gz BKGZANILNHFYET-CVDCTZTESA-N 2 0 358.570 4.003 20 0 FIADRP Cn1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c(-c2ccccc2Cl)n1 ZINC000494563455 1119905754 /nfs/dbraw/zinc/90/57/54/1119905754.db2.gz IBYDWBIKCWTBMQ-UHFFFAOYSA-N 2 0 360.933 4.139 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000192935433 1120091639 /nfs/dbraw/zinc/09/16/39/1120091639.db2.gz JHHSCCURISSMBP-JCTONOIOSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cc(Cl)cs3)cc2)C[C@H](C)O1 ZINC000192994948 1120094058 /nfs/dbraw/zinc/09/40/58/1120094058.db2.gz FTMZYIMTJUXDLE-GASCZTMLSA-N 2 0 364.942 4.301 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494774774 1120184692 /nfs/dbraw/zinc/18/46/92/1120184692.db2.gz LCSBGDPSHBXSFA-ZZTDLJEGSA-N 2 0 352.522 4.263 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(Br)cc32)c1 ZINC000193972064 1120222733 /nfs/dbraw/zinc/22/27/33/1120222733.db2.gz UWJZBIIUMIMHKY-IBGZPJMESA-N 2 0 359.311 4.288 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000494879723 1120354854 /nfs/dbraw/zinc/35/48/54/1120354854.db2.gz QPWUYJIFMSYSNO-SIKLNZKXSA-N 2 0 356.485 4.145 20 0 FIADRP C[N@H+](CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1)Cc1ccccc1 ZINC000494882552 1120356450 /nfs/dbraw/zinc/35/64/50/1120356450.db2.gz ZVHNQTKTABTBJB-NFBKMPQASA-N 2 0 370.512 4.405 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2ccc(Cl)cc2)CC1 ZINC001168473912 1120379182 /nfs/dbraw/zinc/37/91/82/1120379182.db2.gz POJNUPDMECSJDE-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494926304 1120382025 /nfs/dbraw/zinc/38/20/25/1120382025.db2.gz XEMCPGJZTQZQHF-MOXWOTFGSA-N 2 0 362.533 4.251 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cc(Cl)cs3)CC2)C[C@@H](C)O1 ZINC000494985350 1120411065 /nfs/dbraw/zinc/41/10/65/1120411065.db2.gz JJEUPVFNFKHPAU-HUUCEWRRSA-N 2 0 356.963 4.113 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc(OC(F)(F)F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542533270 1120432332 /nfs/dbraw/zinc/43/23/32/1120432332.db2.gz KXLAJIIEBCQYKG-WBVHZDCISA-N 2 0 370.459 4.370 20 0 FIADRP C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495186296 1120532030 /nfs/dbraw/zinc/53/20/30/1120532030.db2.gz WORFMZLOALWTKN-FPOVZHCZSA-N 2 0 356.554 4.226 20 0 FIADRP C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495186295 1120532165 /nfs/dbraw/zinc/53/21/65/1120532165.db2.gz WORFMZLOALWTKN-CTNGQTDRSA-N 2 0 356.554 4.226 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)COC2 ZINC000495434212 1120809061 /nfs/dbraw/zinc/80/90/61/1120809061.db2.gz QSBIOIUUFVFPHA-WFXMLNOXSA-N 2 0 350.506 4.278 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495434211 1120809318 /nfs/dbraw/zinc/80/93/18/1120809318.db2.gz QSBIOIUUFVFPHA-WAOWUJCRSA-N 2 0 350.506 4.278 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1 ZINC000237621717 1120980444 /nfs/dbraw/zinc/98/04/44/1120980444.db2.gz HCKLJQABAZGTPX-BGYRXZFFSA-N 2 0 352.522 4.202 20 0 FIADRP O[C@H](C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccc2ccccc2c1 ZINC000915714998 1121037932 /nfs/dbraw/zinc/03/79/32/1121037932.db2.gz SZUQOSDPZYTFKB-XMMPIXPASA-N 2 0 366.549 4.461 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397484658 1121185465 /nfs/dbraw/zinc/18/54/65/1121185465.db2.gz AKAXMQKRJGHJGR-JOCHJYFZSA-N 2 0 352.522 4.000 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000153809996 1121384717 /nfs/dbraw/zinc/38/47/17/1121384717.db2.gz TXXYCYDYDHPHGC-NRFANRHFSA-N 2 0 356.485 4.453 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+][C@@H](CC[NH+](C)C)c3ccccc3)CCO2)cc1 ZINC001168585270 1121518320 /nfs/dbraw/zinc/51/83/20/1121518320.db2.gz GYWROEFWBTWCPT-PMVMPFDFSA-N 2 0 368.521 4.198 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1OC(F)(F)F ZINC000123604851 1121618329 /nfs/dbraw/zinc/61/83/29/1121618329.db2.gz SROMJUQOKIUYPF-CQSZACIVSA-N 2 0 352.400 4.498 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000671744587 1121648836 /nfs/dbraw/zinc/64/88/36/1121648836.db2.gz NMBVCNQCXCYIOX-SJLPKXTDSA-N 2 0 365.477 4.096 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000124643118 1121710548 /nfs/dbraw/zinc/71/05/48/1121710548.db2.gz KKBKRAMKAHPFGL-QRVBRYPASA-N 2 0 368.521 4.155 20 0 FIADRP COCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)o1 ZINC000125553791 1121791520 /nfs/dbraw/zinc/79/15/20/1121791520.db2.gz ARWHRRDEHLYNEB-HDICACEKSA-N 2 0 356.510 4.194 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000126281222 1121941045 /nfs/dbraw/zinc/94/10/45/1121941045.db2.gz NTFQATIGRLCDJQ-QGZVFWFLSA-N 2 0 359.514 4.258 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccs1 ZINC000126697625 1121977358 /nfs/dbraw/zinc/97/73/58/1121977358.db2.gz NNCITXPPZHQSSR-MAUKXSAKSA-N 2 0 361.530 4.441 20 0 FIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765780622 1121991524 /nfs/dbraw/zinc/99/15/24/1121991524.db2.gz RKKBPHPQUGNVBP-VGSWGCGISA-N 2 0 367.512 4.224 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3cc(F)ccc3F)cc2)CC1 ZINC000917000097 1121996470 /nfs/dbraw/zinc/99/64/70/1121996470.db2.gz PVVOQUWTACNXGX-QFIPXVFZSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([N@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168616159 1122104185 /nfs/dbraw/zinc/10/41/85/1122104185.db2.gz LOCDVNJJSBKPGN-WCCBULMPSA-N 2 0 358.526 4.040 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000066960808 1122116083 /nfs/dbraw/zinc/11/60/83/1122116083.db2.gz KYMRJYXIFATXKO-LJQANCHMSA-N 2 0 359.558 4.074 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@H+](C3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168623446 1122178579 /nfs/dbraw/zinc/17/85/79/1122178579.db2.gz IUXGZRCWBYXNPQ-ROQCDXFCSA-N 2 0 372.553 4.430 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000497409951 1122220573 /nfs/dbraw/zinc/22/05/73/1122220573.db2.gz BWUPZKQLKROGHO-DLTYFMDKSA-N 2 0 364.533 4.264 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497518966 1122269169 /nfs/dbraw/zinc/26/91/69/1122269169.db2.gz AEJDLARQJVIUKY-OAQYLSRUSA-N 2 0 357.542 4.137 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000128631056 1122363309 /nfs/dbraw/zinc/36/33/09/1122363309.db2.gz PJMISPRYXQDLRZ-FQEVSTJZSA-N 2 0 369.553 4.184 20 0 FIADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556232855 1122749829 /nfs/dbraw/zinc/74/98/29/1122749829.db2.gz LGNIDBIDOUUSCD-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP CC1(C)CCCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230586 1122756937 /nfs/dbraw/zinc/75/69/37/1122756937.db2.gz OUFMFCHCHOHKOT-FGZHOGPDSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]C2c3ccccc3-c3ccccc32)C[C@@H](C)O1 ZINC000498451299 1122801080 /nfs/dbraw/zinc/80/10/80/1122801080.db2.gz GDUCQBWXPIENCH-QZTJIDSGSA-N 2 0 350.506 4.235 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]CCSCc3ccccc3)cc2)CC1 ZINC000556617874 1123002446 /nfs/dbraw/zinc/00/24/46/1123002446.db2.gz DGQZPTLGRMWUGE-UHFFFAOYSA-N 2 0 370.562 4.183 20 0 FIADRP CCc1noc(C2CCC([NH2+][C@H]3CCCC[C@H]3C[NH+](CC)CC)CC2)n1 ZINC000498920938 1123078346 /nfs/dbraw/zinc/07/83/46/1123078346.db2.gz WYPAMCAGUKCEAZ-JEVOJNTISA-N 2 0 362.562 4.148 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000556813906 1123111253 /nfs/dbraw/zinc/11/12/53/1123111253.db2.gz XUAJEMXRMHNSEH-UHFFFAOYSA-N 2 0 360.876 4.494 20 0 FIADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556868727 1123149796 /nfs/dbraw/zinc/14/97/96/1123149796.db2.gz BMLHNFLWICWXPQ-XUVXKRRUSA-N 2 0 355.551 4.232 20 0 FIADRP Cn1cnc2cc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)ccc21 ZINC000556885016 1123162190 /nfs/dbraw/zinc/16/21/90/1123162190.db2.gz STLVEFYSYHHZHD-UHFFFAOYSA-N 2 0 374.532 4.061 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)nc1-c1ccccc1 ZINC000556887164 1123164912 /nfs/dbraw/zinc/16/49/12/1123164912.db2.gz RXDDFFCFEUTNPK-GUDVDZBRSA-N 2 0 355.551 4.123 20 0 FIADRP COc1cccc(C2([NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000556912145 1123204101 /nfs/dbraw/zinc/20/41/01/1123204101.db2.gz QVZYXTVQDPAKMQ-ICSRJNTNSA-N 2 0 350.506 4.185 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000556909900 1123209580 /nfs/dbraw/zinc/20/95/80/1123209580.db2.gz QAUBRHSBUSBPMJ-KRWDZBQOSA-N 2 0 352.869 4.219 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1ccc(C)cc1F ZINC000073737094 1123242354 /nfs/dbraw/zinc/24/23/54/1123242354.db2.gz GPOBPWVSAULWOR-QGZVFWFLSA-N 2 0 371.500 4.093 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499138846 1123281019 /nfs/dbraw/zinc/28/10/19/1123281019.db2.gz JOWDFWCAYNVKNS-XGAJZPNHSA-N 3 0 369.597 4.426 20 0 FIADRP COc1cc(C)cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499196956 1123316558 /nfs/dbraw/zinc/31/65/58/1123316558.db2.gz SUZWYTNSYUEREU-DKUWSORSSA-N 2 0 350.506 4.289 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000132682854 1123332381 /nfs/dbraw/zinc/33/23/81/1123332381.db2.gz PCAZYNPVGCLCRA-IBGZPJMESA-N 2 0 366.549 4.447 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000132752001 1123356060 /nfs/dbraw/zinc/35/60/60/1123356060.db2.gz RYHSKKOQXRFNAY-UUOWRZLLSA-N 2 0 364.533 4.372 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c(C)c1 ZINC000133091130 1123416489 /nfs/dbraw/zinc/41/64/89/1123416489.db2.gz WPANCDOJZXONFM-UHFFFAOYSA-N 2 0 351.538 4.124 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCCSc2ccccc2Br)CC[N@@H+]1C ZINC000133419951 1123486073 /nfs/dbraw/zinc/48/60/73/1123486073.db2.gz VQMSTUMUBOUYCH-CABCVRRESA-N 2 0 371.388 4.394 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000133465891 1123489819 /nfs/dbraw/zinc/48/98/19/1123489819.db2.gz USXJYDMYFNPYRR-UWJYYQICSA-N 2 0 354.494 4.192 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)CC1 ZINC000921230821 1123593597 /nfs/dbraw/zinc/59/35/97/1123593597.db2.gz BMQGPQBAXCUTDI-GOSISDBHSA-N 2 0 373.585 4.365 20 0 FIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(C(C)C)cc3C(C)C)C2)CC1 ZINC000609338380 1123674717 /nfs/dbraw/zinc/67/47/17/1123674717.db2.gz ARRUUXORIRORMF-JOCHJYFZSA-N 2 0 357.586 4.145 20 0 FIADRP C[C@H](c1nc2ccccc2o1)[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000245565019 1124122134 /nfs/dbraw/zinc/12/21/34/1124122134.db2.gz ZKDBSLCCIPEGMP-FGTMMUONSA-N 2 0 371.525 4.100 20 0 FIADRP c1cn(-c2ccccc2C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000245660193 1124176474 /nfs/dbraw/zinc/17/64/74/1124176474.db2.gz FNGHYUBVYGYYLZ-NUNAXRQHSA-N 2 0 372.516 4.158 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2c(c1)OCO2 ZINC000245676164 1124186776 /nfs/dbraw/zinc/18/67/76/1124186776.db2.gz ICOQGBIDZGCHQU-OTNPHJDUSA-N 2 0 364.489 4.262 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245682672 1124194060 /nfs/dbraw/zinc/19/40/60/1124194060.db2.gz JBTFSLNIQNLGRY-DKUWSORSSA-N 2 0 350.506 4.023 20 0 FIADRP CN(CCC#N)c1ccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000068367719 1124204716 /nfs/dbraw/zinc/20/47/16/1124204716.db2.gz SNQKELDDDSLDKQ-UHFFFAOYSA-N 2 0 368.569 4.171 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1COc2ccccc21 ZINC000245738544 1124231988 /nfs/dbraw/zinc/23/19/88/1124231988.db2.gz RCPYBGDKNOFTEY-RCDUEUHRSA-N 2 0 362.517 4.336 20 0 FIADRP COCc1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245775682 1124247603 /nfs/dbraw/zinc/24/76/03/1124247603.db2.gz XZSWVHSXONDNTA-NUNAXRQHSA-N 2 0 350.506 4.118 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCc2nc4ccccc4[nH]2)C3)cc1 ZINC000245776914 1124247879 /nfs/dbraw/zinc/24/78/79/1124247879.db2.gz YFALWBOBFUUFKC-MZADTFQBSA-N 2 0 374.532 4.281 20 0 FIADRP FC(F)SCc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)o1 ZINC000180274838 1124279468 /nfs/dbraw/zinc/27/94/68/1124279468.db2.gz NRGCJMSYPRPUKC-UHFFFAOYSA-N 2 0 367.465 4.137 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1 ZINC000245925771 1124286225 /nfs/dbraw/zinc/28/62/25/1124286225.db2.gz SLAXXOGLLONPIA-LWILDLIXSA-N 2 0 351.494 4.179 20 0 FIADRP C[C@H](C[C@H]1CCOC1)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000765895162 1124339167 /nfs/dbraw/zinc/33/91/67/1124339167.db2.gz DEPHBIIWYIRHJG-NFBKMPQASA-N 2 0 358.570 4.126 20 0 FIADRP COc1ccc([C@@H](OC)[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000542840773 1124437384 /nfs/dbraw/zinc/43/73/84/1124437384.db2.gz PIWJPHKMLLIZHU-VGSWGCGISA-N 2 0 360.542 4.158 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1OC(F)F ZINC000246313881 1124442296 /nfs/dbraw/zinc/44/22/96/1124442296.db2.gz DVJCTGBNIQSERQ-CVEARBPZSA-N 2 0 370.484 4.315 20 0 FIADRP CSC[C@@H]([NH2+]C1CCN(C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000542848863 1124450371 /nfs/dbraw/zinc/45/03/71/1124450371.db2.gz HWWRBNAFAIEQAQ-QGZVFWFLSA-N 2 0 358.473 4.326 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000246403044 1124486104 /nfs/dbraw/zinc/48/61/04/1124486104.db2.gz LWPUATIJGWBROO-OXQOHEQNSA-N 2 0 373.928 4.134 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)C1 ZINC000246984762 1124578260 /nfs/dbraw/zinc/57/82/60/1124578260.db2.gz JXIKQMGEMJEYMW-GDBMZVCRSA-N 2 0 359.539 4.120 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000247015793 1124582053 /nfs/dbraw/zinc/58/20/53/1124582053.db2.gz KOSIWDIGSRAVOA-BOMAWHNGSA-N 2 0 369.475 4.250 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc(OC)c1OC ZINC000247109986 1124591131 /nfs/dbraw/zinc/59/11/31/1124591131.db2.gz QLCPMLXACPDFMO-DLBZAZTESA-N 2 0 364.530 4.018 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3c(cc2OC)C[C@H](C)O3)cc1 ZINC000061743935 1124747941 /nfs/dbraw/zinc/74/79/41/1124747941.db2.gz VKOVIBGARGQTNH-KRWDZBQOSA-N 2 0 368.521 4.150 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCO2 ZINC000248393210 1124760635 /nfs/dbraw/zinc/76/06/35/1124760635.db2.gz DOUOGQBRRUXTQT-QRFRQXIXSA-N 2 0 358.526 4.152 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)c1c(C)noc1C ZINC000248412786 1124764704 /nfs/dbraw/zinc/76/47/04/1124764704.db2.gz KBAJRHXHKSEEHJ-MXEMCNAFSA-N 2 0 353.510 4.243 20 0 FIADRP CCN1CC[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248444836 1124769438 /nfs/dbraw/zinc/76/94/38/1124769438.db2.gz WHJGPTHPVNENEH-VQTJNVASSA-N 2 0 367.940 4.077 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc2ccccc2o1 ZINC000248445931 1124769488 /nfs/dbraw/zinc/76/94/88/1124769488.db2.gz MSGKAGJRRVNJDQ-UTKZUKDTSA-N 2 0 364.489 4.240 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000248457625 1124773282 /nfs/dbraw/zinc/77/32/82/1124773282.db2.gz TVMGNQQGTZXBND-RBBKRZOGSA-N 2 0 370.924 4.074 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168686004 1124823805 /nfs/dbraw/zinc/82/38/05/1124823805.db2.gz VLHCVJMGQBIHAN-AZUAARDMSA-N 2 0 354.925 4.309 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1SC ZINC000089214846 1124891634 /nfs/dbraw/zinc/89/16/34/1124891634.db2.gz BUPFJEOKELKWMC-MRXNPFEDSA-N 2 0 371.550 4.379 20 0 FIADRP CC[C@@H](Cc1ccccc1Br)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000542937150 1124924734 /nfs/dbraw/zinc/92/47/34/1124924734.db2.gz WUTQPJRRURNICJ-INIZCTEOSA-N 2 0 353.348 4.233 20 0 FIADRP CCCOc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000063551471 1124928243 /nfs/dbraw/zinc/92/82/43/1124928243.db2.gz UNLRDHYSADZIJG-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP CC(C)[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091283722 1125060587 /nfs/dbraw/zinc/06/05/87/1125060587.db2.gz GCEPLOFFEUXGAZ-IBGZPJMESA-N 2 0 371.491 4.018 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C)c1 ZINC000091287807 1125062893 /nfs/dbraw/zinc/06/28/93/1125062893.db2.gz NZHUJLYYELLDSG-KRWDZBQOSA-N 2 0 350.510 4.266 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cccnc2)cc1C[NH+]1CCCCC1 ZINC000182226663 1125300816 /nfs/dbraw/zinc/30/08/16/1125300816.db2.gz OCXQHBNVVZDCEW-ZWKOTPCHSA-N 2 0 353.510 4.488 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCCCC1CCOCC1 ZINC000499625400 1125383398 /nfs/dbraw/zinc/38/33/98/1125383398.db2.gz LRZDVKRFYSSHHA-PMACEKPBSA-N 2 0 358.570 4.330 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc(Cl)c2)CC1 ZINC000521430105 568030233 /nfs/dbraw/zinc/03/02/33/568030233.db2.gz OBCRNRFUCZFYCW-MRXNPFEDSA-N 2 0 365.949 4.111 20 0 FIADRP COCc1cccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)c1 ZINC000563120759 568221986 /nfs/dbraw/zinc/22/19/86/568221986.db2.gz HVGVJRHIMCTLJZ-QFIPXVFZSA-N 2 0 350.506 4.120 20 0 FIADRP CCCO[C@@H]1CCC[NH+]([C@H](C)CC[N@H+]2CCC[C@@H](OCCC)CC2)CC1 ZINC000431594913 568333914 /nfs/dbraw/zinc/33/39/14/568333914.db2.gz HGBMYOQDTOZKBJ-YPAWHYETSA-N 2 0 368.606 4.327 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccc3c2OCO3)ccc1OC ZINC000182539267 1125556223 /nfs/dbraw/zinc/55/62/23/1125556223.db2.gz GKAYVEKAHAUGNO-MRXNPFEDSA-N 2 0 370.493 4.117 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)ccc1OC ZINC000182574629 1125573077 /nfs/dbraw/zinc/57/30/77/1125573077.db2.gz KSYDHQWNRWIWNX-ZWKOTPCHSA-N 2 0 370.537 4.441 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2F)ccc1OC ZINC000182857255 1125652708 /nfs/dbraw/zinc/65/27/08/1125652708.db2.gz SBBBHFPVSQWATF-MRXNPFEDSA-N 2 0 369.484 4.399 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCc2ccc(C)nc2)cc1C[NH+]1CCCCC1 ZINC000182947355 1125697546 /nfs/dbraw/zinc/69/75/46/1125697546.db2.gz FQUPJKGDHPWVHG-IBGZPJMESA-N 2 0 367.537 4.278 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)C1 ZINC000619772531 1125700855 /nfs/dbraw/zinc/70/08/55/1125700855.db2.gz MIKHQTPSFSRMMZ-FQEVSTJZSA-N 2 0 356.485 4.226 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000544827691 1079554277 /nfs/dbraw/zinc/55/42/77/1079554277.db2.gz IJWKWLVUTXJVKL-QRWLVFNGSA-N 2 0 350.934 4.413 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180712199 1080541434 /nfs/dbraw/zinc/54/14/34/1080541434.db2.gz HXHKVLPGGPXWKA-JOCHJYFZSA-N 2 0 371.956 4.045 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc3c[nH]nc32)C1 ZINC001648808358 1081111542 /nfs/dbraw/zinc/11/15/42/1081111542.db2.gz MEOWCRHFKBSXRW-HDICACEKSA-N 2 0 362.521 4.331 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2CCCn3ccnc32)cc1 ZINC000655687753 1081115338 /nfs/dbraw/zinc/11/53/38/1081115338.db2.gz YXOQFIKLHWVZAV-JOCHJYFZSA-N 2 0 360.505 4.236 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c3ccccc3sc2C(=O)OC)CC1 ZINC000608862970 1081119223 /nfs/dbraw/zinc/11/92/23/1081119223.db2.gz RJUOYHDHEAINMW-UHFFFAOYSA-N 2 0 374.550 4.242 20 0 FIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]C2CCN(C[C@@H]3CCCO3)CC2)cc1 ZINC000655696358 1081122823 /nfs/dbraw/zinc/12/28/23/1081122823.db2.gz GCBSVWHTDPHOGB-XXBNENTESA-N 2 0 374.569 4.028 20 0 FIADRP Cc1nn(-c2ccccc2Cl)cc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000655708279 1081132894 /nfs/dbraw/zinc/13/28/94/1081132894.db2.gz MKUKECUHBUJTAG-UHFFFAOYSA-N 2 0 368.912 4.186 20 0 FIADRP Fc1ccc([C@H](CC(F)(F)F)NC2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000655735341 1081156352 /nfs/dbraw/zinc/15/63/52/1081156352.db2.gz HLRVLQJYXZCWGZ-MSOLQXFVSA-N 2 0 374.422 4.052 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000655805058 1081211319 /nfs/dbraw/zinc/21/13/19/1081211319.db2.gz AQWYISNNYDLYMM-JKIFEVAISA-N 2 0 359.514 4.256 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cc2cc(Br)ccc2o1 ZINC000655805191 1081211559 /nfs/dbraw/zinc/21/15/59/1081211559.db2.gz KKPMGDHKBCYOFX-JMSVASOKSA-N 2 0 351.288 4.186 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000655805591 1081213853 /nfs/dbraw/zinc/21/38/53/1081213853.db2.gz JEVOAWOBGIUQNO-DJPFJPOOSA-N 2 0 356.485 4.396 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000655826962 1081232125 /nfs/dbraw/zinc/23/21/25/1081232125.db2.gz JSRRANLUNPJYJP-WOVMCDHWSA-N 2 0 374.960 4.388 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)C1 ZINC001648828684 1081265784 /nfs/dbraw/zinc/26/57/84/1081265784.db2.gz PTEQMVHCNYRYRS-AZYNXAEESA-N 2 0 350.506 4.210 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000579982264 1081361240 /nfs/dbraw/zinc/36/12/40/1081361240.db2.gz VFYKTFRDTNDJFM-WMZOPIPTSA-N 2 0 368.949 4.015 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cnc5ccccc5c4)C[C@H]3C2)cc1 ZINC000312639997 1081500506 /nfs/dbraw/zinc/50/05/06/1081500506.db2.gz IHBTXHZSRPHQLS-DHIUTWEWSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1ccc2cnccc2c1 ZINC000683771614 1081533250 /nfs/dbraw/zinc/53/32/50/1081533250.db2.gz XGLGZNQMGMOABG-RTBURBONSA-N 2 0 359.517 4.481 20 0 FIADRP c1coc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)s2)c1 ZINC000683825746 1081719216 /nfs/dbraw/zinc/71/92/16/1081719216.db2.gz TXXUIQUPBQYGPE-UHFFFAOYSA-N 2 0 359.539 4.491 20 0 FIADRP Cc1cc(Cl)cc(C[NH2+]Cc2cccc(CN3CCO[C@@H](C)C3)c2)c1 ZINC000580456177 1081954255 /nfs/dbraw/zinc/95/42/55/1081954255.db2.gz QDZYIELCYYVUGN-KRWDZBQOSA-N 2 0 358.913 4.159 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000471611345 1082093401 /nfs/dbraw/zinc/09/34/01/1082093401.db2.gz PPQLEUZMJRRHCA-FKBYEOEOSA-N 2 0 356.554 4.038 20 0 FIADRP Cc1cccc2c1OC[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC000581101573 1082314999 /nfs/dbraw/zinc/31/49/99/1082314999.db2.gz MIZVAHPDPPJFQF-GPJHCHHRSA-N 2 0 362.517 4.084 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCC[N@@H+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000430581511 1082519499 /nfs/dbraw/zinc/51/94/99/1082519499.db2.gz OQWCGICURZOUTO-ZWOKBUDYSA-N 2 0 351.494 4.059 20 0 FIADRP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000430602578 1082572381 /nfs/dbraw/zinc/57/23/81/1082572381.db2.gz WLSQMHQMFAXAAO-DYESRHJHSA-N 2 0 353.510 4.305 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc2ccccc2c1 ZINC000656676183 1082709962 /nfs/dbraw/zinc/70/99/62/1082709962.db2.gz FZVKUKWXJDOUCD-SFHVURJKSA-N 2 0 352.522 4.381 20 0 FIADRP Cc1ccccc1-n1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cn1 ZINC000647168645 1082719809 /nfs/dbraw/zinc/71/98/09/1082719809.db2.gz FLUIVFWNLNFEGS-UHFFFAOYSA-N 2 0 360.505 4.066 20 0 FIADRP CC[N@H+](Cc1cc(-n2ccnc2)cs1)Cc1ccc(C[NH+](C)C)cc1 ZINC000581634969 1082733730 /nfs/dbraw/zinc/73/37/30/1082733730.db2.gz NJCRVNWWHCWXIK-UHFFFAOYSA-N 2 0 354.523 4.018 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccc(CC[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000167707989 1082765386 /nfs/dbraw/zinc/76/53/86/1082765386.db2.gz IMDMQBUZAJZXOS-UHFFFAOYSA-N 2 0 373.541 4.040 20 0 FIADRP CC(C)Cn1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000647171844 1082778705 /nfs/dbraw/zinc/77/87/05/1082778705.db2.gz YKWQBADBUKKEOB-LJQANCHMSA-N 2 0 354.542 4.203 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000684394902 1082828027 /nfs/dbraw/zinc/82/80/27/1082828027.db2.gz OAHLTNVATQNGQA-RBZQAINGSA-N 2 0 363.549 4.213 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)cc1O ZINC000581755927 1082872298 /nfs/dbraw/zinc/87/22/98/1082872298.db2.gz LTCVXJIRLMCNSQ-GOSISDBHSA-N 2 0 368.521 4.484 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2c1ccc(OC)c2F ZINC000581876803 1082948632 /nfs/dbraw/zinc/94/86/32/1082948632.db2.gz VSWDNABGDSPHJG-FQEVSTJZSA-N 2 0 356.485 4.453 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccccc1F ZINC000090971318 1083096359 /nfs/dbraw/zinc/09/63/59/1083096359.db2.gz LYTFMNRTAHMUTC-GOSISDBHSA-N 2 0 367.512 4.209 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]3CCCF)CC2)cc1 ZINC000510662904 1083229137 /nfs/dbraw/zinc/22/91/37/1083229137.db2.gz ILCZTTLQFFNEFY-IFMALSPDSA-N 2 0 362.533 4.415 20 0 FIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1Cl ZINC000510739272 1083288753 /nfs/dbraw/zinc/28/87/53/1083288753.db2.gz XBLLKBYCOVIBGQ-BZSNNMDCSA-N 2 0 350.934 4.412 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)cc1 ZINC000090523981 1083301170 /nfs/dbraw/zinc/30/11/70/1083301170.db2.gz DEHAHHOCHRNDHX-ZCNNSNEGSA-N 2 0 350.934 4.149 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431041217 1083310755 /nfs/dbraw/zinc/31/07/55/1083310755.db2.gz RTCZBJBKFDKGAB-SFHVURJKSA-N 2 0 363.505 4.075 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)[C@@H]2CCCO[C@@H]21 ZINC000658320204 1083406598 /nfs/dbraw/zinc/40/65/98/1083406598.db2.gz RDLCAJRDBZVETR-MBDNFAEBSA-N 2 0 368.565 4.082 20 0 FIADRP CC(C)(C)[NH+]1CCC(NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000658319427 1083406726 /nfs/dbraw/zinc/40/67/26/1083406726.db2.gz ATZSCQZUONYBDU-NRFANRHFSA-N 2 0 369.597 4.141 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC2CC[NH+](CC3CC3)CC2)CC1 ZINC000658352118 1083424021 /nfs/dbraw/zinc/42/40/21/1083424021.db2.gz DBAGRILWUKIAAI-UHFFFAOYSA-N 3 0 369.597 4.141 20 0 FIADRP C[C@@H](O)[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000658358938 1083429995 /nfs/dbraw/zinc/42/99/95/1083429995.db2.gz BBEDRGGYTHCJFC-BKAOJLMESA-N 2 0 352.522 4.141 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]CCCCC[NH+]2CCCCC2)CC1 ZINC000092565546 1083435042 /nfs/dbraw/zinc/43/50/42/1083435042.db2.gz VJDVBBZOKWTVGS-UHFFFAOYSA-N 2 0 352.563 4.133 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OCc2ccccn2)CC1 ZINC000535811360 1083681275 /nfs/dbraw/zinc/68/12/75/1083681275.db2.gz LCUAKKWPITUXFI-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000535813276 1083685405 /nfs/dbraw/zinc/68/54/05/1083685405.db2.gz YWFLJNJWOJFOBZ-UHFFFAOYSA-N 2 0 355.501 4.440 20 0 FIADRP CC[C@H]1C[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC[C@H]1[NH3+] ZINC000647497522 1084252596 /nfs/dbraw/zinc/25/25/96/1084252596.db2.gz JSXVBCSMQGYPKY-OXJNMPFZSA-N 2 0 371.912 4.152 20 0 FIADRP Cc1c(Br)cncc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000657300413 1084324977 /nfs/dbraw/zinc/32/49/77/1084324977.db2.gz NKQRHSVTMXBRGU-UHFFFAOYSA-N 2 0 374.326 4.038 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCC(c3ccccc3)CC2)cc1 ZINC000613259777 1084513986 /nfs/dbraw/zinc/51/39/86/1084513986.db2.gz CIBMAYRXNRKIIA-UHFFFAOYSA-N 2 0 352.522 4.443 20 0 FIADRP Clc1cccc([C@H]2CC[C@H]([NH2+]CC3(N4CCCC4)CCOCC3)C2)c1 ZINC000414124192 1084628301 /nfs/dbraw/zinc/62/83/01/1084628301.db2.gz PFJNXIAUQOBHIJ-ICSRJNTNSA-N 2 0 362.945 4.211 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)sc1Br ZINC000414163503 1084721297 /nfs/dbraw/zinc/72/12/97/1084721297.db2.gz GCBHIFOTYZYRMB-NSHDSACASA-N 2 0 350.285 4.318 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)CC[NH+](C)CC1 ZINC000582271111 1084823427 /nfs/dbraw/zinc/82/34/27/1084823427.db2.gz JQDCTXJUMIOKRS-OAHLLOKOSA-N 2 0 356.988 4.294 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+]C2CCC(C3CCC3)CC2)CC1 ZINC000657390511 1084866238 /nfs/dbraw/zinc/86/62/38/1084866238.db2.gz XDYDMPNKCXGROP-UHFFFAOYSA-N 2 0 356.554 4.092 20 0 FIADRP CCC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000414295677 1084987502 /nfs/dbraw/zinc/98/75/02/1084987502.db2.gz DLXGSGCGXCTKIR-FQEVSTJZSA-N 2 0 358.551 4.206 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@H]1CN(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167573362 1084992426 /nfs/dbraw/zinc/99/24/26/1084992426.db2.gz VKNLBHHDVKEEFE-PUHATCMVSA-N 2 0 357.586 4.234 20 0 FIADRP c1cn(-c2ccc(C[NH2+]Cc3ccccc3OCc3cccnc3)cc2)cn1 ZINC000066876447 1085496825 /nfs/dbraw/zinc/49/68/25/1085496825.db2.gz QVKITZBVKDJEBC-UHFFFAOYSA-N 2 0 370.456 4.136 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000075007839 1085510618 /nfs/dbraw/zinc/51/06/18/1085510618.db2.gz RJXPFDBTWWXDLQ-MRXNPFEDSA-N 2 0 370.484 4.172 20 0 FIADRP C[C@H](CC[N@@H+]1CC[C@@H](CC(F)(F)F)C1)[NH+]1CC[C@H](CC(F)(F)F)C1 ZINC000444707418 1085549029 /nfs/dbraw/zinc/54/90/29/1085549029.db2.gz PPINBRFXOFPQKG-HZSPNIEDSA-N 2 0 360.386 4.314 20 0 FIADRP C[C@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)C1CC[NH2+]CC1 ZINC000237534826 1085717312 /nfs/dbraw/zinc/71/73/12/1085717312.db2.gz XNASFUIUEROBTJ-GOSISDBHSA-N 2 0 371.569 4.415 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](c2cccnc2)C2CCCCC2)C[C@@H](C)O1 ZINC000652166534 1085734036 /nfs/dbraw/zinc/73/40/36/1085734036.db2.gz VHTBRZOWHUVUGX-WOIUINJBSA-N 2 0 359.558 4.182 20 0 FIADRP COc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc(C(F)(F)F)c1 ZINC001143519019 1085903316 /nfs/dbraw/zinc/90/33/16/1085903316.db2.gz FQJNGJGWBSBIHN-UHFFFAOYSA-N 2 0 356.432 4.022 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347990 1085919152 /nfs/dbraw/zinc/91/91/52/1085919152.db2.gz QTEIBWOQEBOWEA-PXMRGAAZSA-N 2 0 357.325 4.273 20 0 FIADRP Clc1ccc(-c2cnc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)o2)cc1 ZINC000662290337 1086397659 /nfs/dbraw/zinc/39/76/59/1086397659.db2.gz CIWDADMSQMKLOE-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP Clc1cccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)co2)c1 ZINC000662294057 1086400074 /nfs/dbraw/zinc/40/00/74/1086400074.db2.gz AMSFPTGBOGBQFN-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)c1cccc2c1C[NH2+]C2)C1CCCCC1 ZINC000662661339 1086518730 /nfs/dbraw/zinc/51/87/30/1086518730.db2.gz PQFOLDIGYLNBIN-UHFFFAOYSA-N 2 0 363.505 4.307 20 0 FIADRP CN1CCC([NH2+][C@H]2CCCSc3ccc(Br)cc32)CC1 ZINC000663437354 1086541601 /nfs/dbraw/zinc/54/16/01/1086541601.db2.gz MSFAUBCQHYEWCM-HNNXBMFYSA-N 2 0 355.345 4.060 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)ccc1OC(F)F ZINC000663466994 1086568003 /nfs/dbraw/zinc/56/80/03/1086568003.db2.gz CIXFMAVQVREVOC-GDBMZVCRSA-N 2 0 368.468 4.069 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC000511993390 1086599819 /nfs/dbraw/zinc/59/98/19/1086599819.db2.gz XIMQYFAOZPKLHL-PPTUWVGOSA-N 2 0 356.460 4.478 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001167824290 1086606700 /nfs/dbraw/zinc/60/67/00/1086606700.db2.gz GLKXKWYJKCBEOF-HXUWFJFHSA-N 3 0 361.574 4.078 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167833376 1086665225 /nfs/dbraw/zinc/66/52/25/1086665225.db2.gz AMOSSNKZFOOGFR-RBUKOAKNSA-N 2 0 369.594 4.218 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-n3cccn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000080338792 1086675530 /nfs/dbraw/zinc/67/55/30/1086675530.db2.gz UCPFJBOKVJZOSK-UGKGYDQZSA-N 2 0 360.505 4.015 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@@H](C5CC5)C4)[C@H]3C2)cc1 ZINC000583456814 1086700580 /nfs/dbraw/zinc/70/05/80/1086700580.db2.gz ZWMQYRXFGQDGHF-VHJOFQCFSA-N 2 0 368.565 4.224 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@](C)(CNC(=O)OC(C)(C)C)C1 ZINC001167835217 1086700950 /nfs/dbraw/zinc/70/09/50/1086700950.db2.gz OWFSGGDLDGBVCV-WIYYLYMNSA-N 2 0 369.594 4.124 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCc2c(Br)cccc2C1 ZINC001167836789 1086709824 /nfs/dbraw/zinc/70/98/24/1086709824.db2.gz HGPWOUREBQWXIQ-OAHLLOKOSA-N 2 0 353.348 4.318 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(COc2ccc(F)cc2)CC1 ZINC001167837511 1086711311 /nfs/dbraw/zinc/71/13/11/1086711311.db2.gz LWTHXXVIDWMBJS-GOSISDBHSA-N 2 0 350.522 4.427 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167837219 1086711505 /nfs/dbraw/zinc/71/15/05/1086711505.db2.gz JOROIKBTWYHZSS-MOPGFXCFSA-N 2 0 369.594 4.076 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C ZINC001167840008 1086719703 /nfs/dbraw/zinc/71/97/03/1086719703.db2.gz DGITWYTUBMDYIA-IPMKNSEASA-N 2 0 369.594 4.265 20 0 FIADRP CCOc1cc2c(cc1OCC)C[N@@H+]([C@H](C)CCC[NH+](CC)CC)CC2 ZINC001167842005 1086742633 /nfs/dbraw/zinc/74/26/33/1086742633.db2.gz VPGDQFSBRUDXKY-GOSISDBHSA-N 2 0 362.558 4.353 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)CCCO2 ZINC000432426091 1086753786 /nfs/dbraw/zinc/75/37/86/1086753786.db2.gz YACSNAJLEVTGSM-WIYYLYMNSA-N 2 0 360.542 4.114 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N(C)Cc2ccc(F)cc2)CC1 ZINC001167842773 1086756668 /nfs/dbraw/zinc/75/66/68/1086756668.db2.gz YNKPRZXWUCLHLT-LJQANCHMSA-N 2 0 363.565 4.232 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000650722534 1086818688 /nfs/dbraw/zinc/81/86/88/1086818688.db2.gz WBTIGQRMYLKIHT-UXPWSPDFSA-N 2 0 374.525 4.415 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000650723007 1086822477 /nfs/dbraw/zinc/82/24/77/1086822477.db2.gz GFEKJMSDILSTOL-HOJAQTOUSA-N 2 0 374.525 4.415 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000236826936 1086870247 /nfs/dbraw/zinc/87/02/47/1086870247.db2.gz YAIFOUYMDDKSED-QGZVFWFLSA-N 2 0 371.912 4.024 20 0 FIADRP CCOCc1cc(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)ccc1OC ZINC000512180279 1086903486 /nfs/dbraw/zinc/90/34/86/1086903486.db2.gz NSIMXWFLZBMYSZ-OAQYLSRUSA-N 2 0 374.569 4.176 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCc2cc(Br)ccc21 ZINC000650756958 1086969767 /nfs/dbraw/zinc/96/97/67/1086969767.db2.gz KXLBBKVNEONPLG-LJQANCHMSA-N 2 0 359.311 4.336 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C ZINC000650757983 1086971456 /nfs/dbraw/zinc/97/14/56/1086971456.db2.gz GBLIOJZXIIJULW-AWEZNQCLSA-N 2 0 352.507 4.084 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](Cc1cccc(OC)c1)c1ccccc1 ZINC000650758554 1086973937 /nfs/dbraw/zinc/97/39/37/1086973937.db2.gz SDGKGFNWGUXKHE-DEOSSOPVSA-N 2 0 360.501 4.488 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cn2)cc1 ZINC000657816619 1087093809 /nfs/dbraw/zinc/09/38/09/1087093809.db2.gz YFDJVXNGWNAXDV-UHFFFAOYSA-N 2 0 369.484 4.225 20 0 FIADRP CCCCOc1cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000584105798 1087176085 /nfs/dbraw/zinc/17/60/85/1087176085.db2.gz QCYXLLOAZICNGT-HXUWFJFHSA-N 2 0 360.542 4.038 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000584173225 1087201782 /nfs/dbraw/zinc/20/17/82/1087201782.db2.gz ZVXKTDOBRPKQHA-WZONZLPQSA-N 2 0 363.505 4.075 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)c(Cl)c1 ZINC000657839873 1087277098 /nfs/dbraw/zinc/27/70/98/1087277098.db2.gz IITACHDVHPVTLK-YUTCNCBUSA-N 2 0 357.723 4.380 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657842139 1087285271 /nfs/dbraw/zinc/28/52/71/1087285271.db2.gz UNBBVCLJCMFCDL-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000584425949 1087381012 /nfs/dbraw/zinc/38/10/12/1087381012.db2.gz VDEQYIQUAVRLNO-NRFANRHFSA-N 2 0 352.522 4.271 20 0 FIADRP c1cnc2c(c1)cccc2OCCC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000089627841 1087388211 /nfs/dbraw/zinc/38/82/11/1087388211.db2.gz ISHJJIRWDFUNKV-UHFFFAOYSA-N 2 0 353.510 4.000 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCc2nc3c(s2)CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000089667542 1087389904 /nfs/dbraw/zinc/38/99/04/1087389904.db2.gz LQDSVNSLCSISAY-MJGOQNOKSA-N 2 0 369.578 4.207 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(CN3CCOCC3)cc2)C2CC2)cc1 ZINC000091265918 1087426402 /nfs/dbraw/zinc/42/64/02/1087426402.db2.gz SLTUYXOVZGJCIC-HSZRJFAPSA-N 2 0 350.506 4.068 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)cc2cc1OC ZINC000657970967 1087682391 /nfs/dbraw/zinc/68/23/91/1087682391.db2.gz GRLAMVFDQMQVEB-MRXNPFEDSA-N 2 0 356.510 4.240 20 0 FIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066507 1087709846 /nfs/dbraw/zinc/70/98/46/1087709846.db2.gz BEDFWCMKNIJOQO-OAHLLOKOSA-N 2 0 370.990 4.203 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc2ccccc2s1 ZINC000658071833 1087711293 /nfs/dbraw/zinc/71/12/93/1087711293.db2.gz ZPXNQEKIUHLMQZ-INIZCTEOSA-N 2 0 358.551 4.443 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c2ccccc21 ZINC000658136608 1087730886 /nfs/dbraw/zinc/73/08/86/1087730886.db2.gz HNVLBGJQJZODEZ-NKKJXINNSA-N 2 0 364.533 4.227 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)C2CCC2)cc1 ZINC000658141946 1087733432 /nfs/dbraw/zinc/73/34/32/1087733432.db2.gz YCMFBMKFLKGGMI-BJKOFHAPSA-N 2 0 364.533 4.193 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1C ZINC000658141191 1087734277 /nfs/dbraw/zinc/73/42/77/1087734277.db2.gz ROLLWGBEKJQUPB-DENIHFKCSA-N 2 0 352.522 4.029 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)C2CCCC2)o1 ZINC000658142421 1087734902 /nfs/dbraw/zinc/73/49/02/1087734902.db2.gz YGRHUUSMBIZBQK-JTHBVZDNSA-N 2 0 368.521 4.176 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658143216 1087735258 /nfs/dbraw/zinc/73/52/58/1087735258.db2.gz XSORSJHFQDGXHX-PXNSSMCTSA-N 2 0 370.562 4.216 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc2c(s1)CCCC2 ZINC000658142530 1087735770 /nfs/dbraw/zinc/73/57/70/1087735770.db2.gz YMMKNYMCNWKEOG-OXQOHEQNSA-N 2 0 370.562 4.044 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000658163985 1087758044 /nfs/dbraw/zinc/75/80/44/1087758044.db2.gz MFCCEEAAXOJNRZ-LSTHTHJFSA-N 2 0 355.551 4.137 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCC(F)(F)CC1 ZINC000658163896 1087758232 /nfs/dbraw/zinc/75/82/32/1087758232.db2.gz BXTAEBIXAIOGKW-INIZCTEOSA-N 2 0 351.485 4.097 20 0 FIADRP C[C@@H](CCc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166255 1087761931 /nfs/dbraw/zinc/76/19/31/1087761931.db2.gz NHZGJVTXDIMBEV-SFHVURJKSA-N 2 0 355.501 4.044 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cnc2ccsc2c1 ZINC000658167922 1087762348 /nfs/dbraw/zinc/76/23/48/1087762348.db2.gz USTMVAKOIZMEDO-INIZCTEOSA-N 2 0 366.534 4.254 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc2ccccc2n1 ZINC000658168336 1087764365 /nfs/dbraw/zinc/76/43/65/1087764365.db2.gz VYTFPOHXHVRGGH-SFHVURJKSA-N 2 0 360.505 4.193 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[N@@H+]3CCC[C@H](C)C3)C[C@H]2C1 ZINC000424269631 1087891181 /nfs/dbraw/zinc/89/11/81/1087891181.db2.gz PLAIFVIPFKORQO-AZCFJWIISA-N 2 0 356.554 4.212 20 0 FIADRP CC[N@H+](CCC1CCN(C(=O)Nc2cc(C)cc(C[NH3+])c2)CC1)CC(C)C ZINC000424427311 1087993601 /nfs/dbraw/zinc/99/36/01/1087993601.db2.gz OQJXMZQTRLMPID-UHFFFAOYSA-N 2 0 374.573 4.066 20 0 FIADRP c1ccc2c(c1)C1C[C@H](C[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)C2c2ccccc21 ZINC000647550762 1088063577 /nfs/dbraw/zinc/06/35/77/1088063577.db2.gz GMLZHJQUZPFNOB-CIVVPNNBSA-N 2 0 358.529 4.261 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Cl)cc2Br)cc1 ZINC000414806206 1088151812 /nfs/dbraw/zinc/15/18/12/1088151812.db2.gz HKPKFZDDPRJCJN-LLVKDONJSA-N 2 0 353.691 4.412 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000414812122 1088220416 /nfs/dbraw/zinc/22/04/16/1088220416.db2.gz KKYYGEQFYKONGH-CYBMUJFWSA-N 2 0 374.410 4.405 20 0 FIADRP COc1cc(-c2ccccc2)ccc1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000472615376 1088269565 /nfs/dbraw/zinc/26/95/65/1088269565.db2.gz YHMFYPOMUPQQJI-UHFFFAOYSA-N 2 0 350.506 4.422 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000311427429 1088375410 /nfs/dbraw/zinc/37/54/10/1088375410.db2.gz GFMNDPZIAUVGNT-IEBWSBKVSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)C[C@@H]3[NH2+]Cc4ccccc43)cc2)C1 ZINC000659284817 1088420704 /nfs/dbraw/zinc/42/07/04/1088420704.db2.gz HQIDJRNTLLIJSR-JTSKRJEESA-N 2 0 363.505 4.092 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311514025 1088707049 /nfs/dbraw/zinc/70/70/49/1088707049.db2.gz OEUDNMIWEYKUFT-AZUAARDMSA-N 2 0 350.506 4.184 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000514126580 1088772988 /nfs/dbraw/zinc/77/29/88/1088772988.db2.gz JVAVIRSGGLAWAJ-GOSISDBHSA-N 2 0 351.485 4.445 20 0 FIADRP CO[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000514248771 1088944846 /nfs/dbraw/zinc/94/48/46/1088944846.db2.gz VOJSUKMCJHGUSZ-XAUMDUMWSA-N 2 0 350.934 4.270 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000415011004 1089039914 /nfs/dbraw/zinc/03/99/14/1089039914.db2.gz VPYQTTFREJAAHH-IINYFYTJSA-N 2 0 354.338 4.331 20 0 FIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415015341 1089042847 /nfs/dbraw/zinc/04/28/47/1089042847.db2.gz YIVOSDNVMZIROZ-DOTOQJQBSA-N 2 0 353.491 4.034 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000415023384 1089061566 /nfs/dbraw/zinc/06/15/66/1089061566.db2.gz KWIQXJHWUZAOFO-MGCOHNPYSA-N 2 0 351.741 4.019 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415044166 1089080754 /nfs/dbraw/zinc/08/07/54/1089080754.db2.gz AKLMUWTZMMMUSC-OAQYLSRUSA-N 2 0 368.912 4.404 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000415049432 1089086570 /nfs/dbraw/zinc/08/65/70/1089086570.db2.gz HFKNCEJIQSLSJR-SFHVURJKSA-N 2 0 362.901 4.317 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(Cl)c1 ZINC000415045798 1089092230 /nfs/dbraw/zinc/09/22/30/1089092230.db2.gz BUDGEFZZBNYKGD-LPHOPBHVSA-N 2 0 373.928 4.435 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(F)cc1Br)c1ccccc1 ZINC000415053919 1089097915 /nfs/dbraw/zinc/09/79/15/1089097915.db2.gz NBKYSZSTBPUIEN-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@H](C[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000415116473 1089176602 /nfs/dbraw/zinc/17/66/02/1089176602.db2.gz BJSLARBBAWLQMZ-CCKFTAQKSA-N 2 0 370.459 4.027 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](CCCc3c(Cl)cccc3Cl)CC2)C1 ZINC000415120812 1089184707 /nfs/dbraw/zinc/18/47/07/1089184707.db2.gz HBBCEVQHWLLUHT-HNAYVOBHSA-N 2 0 371.352 4.144 20 0 FIADRP CC(C)[C@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000415134194 1089189820 /nfs/dbraw/zinc/18/98/20/1089189820.db2.gz OBWLETCZLGWFOF-QHCPKHFHSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H](Cn1cccn1)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549225483 1089283414 /nfs/dbraw/zinc/28/34/14/1089283414.db2.gz NDRWILFPEZIUJX-XZBHBCHMSA-N 2 0 372.944 4.129 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549236669 1089309667 /nfs/dbraw/zinc/30/96/67/1089309667.db2.gz DBGXKGOQMMKLIC-SESVOUGMSA-N 2 0 362.945 4.269 20 0 FIADRP C[C@@H](CC[NH2+]Cc1ccccc1-c1ccnn1C)[N@H+](C)Cc1ccccc1 ZINC000511523970 1089397849 /nfs/dbraw/zinc/39/78/49/1089397849.db2.gz PYTGEKUEAIKOFV-IBGZPJMESA-N 2 0 362.521 4.087 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(-c2ccnn2C)c1 ZINC000549250699 1089417329 /nfs/dbraw/zinc/41/73/29/1089417329.db2.gz HKSBWHPAMPILAZ-IBGZPJMESA-N 2 0 354.542 4.140 20 0 FIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(C)c1 ZINC000514827880 1089505472 /nfs/dbraw/zinc/50/54/72/1089505472.db2.gz DUGAWLIYUNPBHT-PKTZIBPZSA-N 2 0 351.538 4.024 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000435394164 1089601642 /nfs/dbraw/zinc/60/16/42/1089601642.db2.gz MOUPSSRKKZWKNW-OAHLLOKOSA-N 2 0 371.912 4.152 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc(C)cc(C)c2)CC1 ZINC000518774564 1089645822 /nfs/dbraw/zinc/64/58/22/1089645822.db2.gz RCECQZMBFVTYRU-IBGZPJMESA-N 2 0 369.528 4.435 20 0 FIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cnc1F ZINC000893018533 1089675227 /nfs/dbraw/zinc/67/52/27/1089675227.db2.gz JAFKKBJYWCTQFN-UHFFFAOYSA-N 2 0 353.441 4.044 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000584545820 1089979775 /nfs/dbraw/zinc/97/97/75/1089979775.db2.gz VYCVFCSMQPGDOC-UHFFFAOYSA-N 2 0 373.928 4.101 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000312148362 1090319898 /nfs/dbraw/zinc/31/98/98/1090319898.db2.gz DCBKYDQGTJQECS-NSHGMRRFSA-N 2 0 371.525 4.237 20 0 FIADRP Cc1noc(C2CCC([NH2+]C3CC[NH+](CC4CCCCC4)CC3)CC2)n1 ZINC000378407600 1090348159 /nfs/dbraw/zinc/34/81/59/1090348159.db2.gz YEJROXVHZZCEGQ-UHFFFAOYSA-N 2 0 360.546 4.039 20 0 FIADRP C[C@H]([NH3+])c1ccc(-c2nc(-c3cccc(C[NH+]4CCCCC4)c3)no2)cc1 ZINC000416399910 1090372145 /nfs/dbraw/zinc/37/21/45/1090372145.db2.gz ITBARNTWODROEP-INIZCTEOSA-N 2 0 362.477 4.409 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2ccc(C)nc2)ccc1OC ZINC000182946967 1090381965 /nfs/dbraw/zinc/38/19/65/1090381965.db2.gz SIQQZAASTYOBQA-GOSISDBHSA-N 2 0 355.526 4.134 20 0 FIADRP C[NH+](C)[C@@H](CC(=O)Nc1cccc(C[NH+]2CCCCC2)c1)c1ccccc1 ZINC000431922949 1090676829 /nfs/dbraw/zinc/67/68/29/1090676829.db2.gz LRNOZLQIVQUVGQ-QFIPXVFZSA-N 2 0 365.521 4.304 20 0 FIADRP CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cn1 ZINC000584688005 1090721036 /nfs/dbraw/zinc/72/10/36/1090721036.db2.gz XZZPZBOCYQUEOY-OAQYLSRUSA-N 2 0 364.537 4.013 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CCCO1 ZINC000584759982 1090844573 /nfs/dbraw/zinc/84/45/73/1090844573.db2.gz BOMNJVSWNMSBOW-AUSIDOKSSA-N 2 0 370.512 4.200 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(OC(F)F)CC1 ZINC000651469313 1091051743 /nfs/dbraw/zinc/05/17/43/1091051743.db2.gz JWTIQTHWIHXUHE-JYPHPWERSA-N 2 0 352.469 4.037 20 0 FIADRP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398201906 1091347863 /nfs/dbraw/zinc/34/78/63/1091347863.db2.gz PXNDEWGKKDHYMU-CVDCTZTESA-N 2 0 352.522 4.476 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000388464737 1091370478 /nfs/dbraw/zinc/37/04/78/1091370478.db2.gz CYJZDMFTAFOJMX-WMZOPIPTSA-N 2 0 360.448 4.461 20 0 FIADRP [NH3+]C1CC[NH+](Cc2ccccc2-c2ccc(OC(F)(F)F)cc2)CC1 ZINC001204646005 1091409895 /nfs/dbraw/zinc/40/98/95/1091409895.db2.gz GDLKMPPQJWMROF-UHFFFAOYSA-N 2 0 350.384 4.175 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccc(Cl)cc2)CC1 ZINC000512250034 1091965298 /nfs/dbraw/zinc/96/52/98/1091965298.db2.gz RLZNIAJQDLNUJG-UHFFFAOYSA-N 2 0 365.949 4.113 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000512286057 1092009902 /nfs/dbraw/zinc/00/99/02/1092009902.db2.gz ADOCEWMLFDBZRI-ODTAKUCXSA-N 2 0 370.581 4.470 20 0 FIADRP COc1ccc(C)cc1C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432673874 1092060654 /nfs/dbraw/zinc/06/06/54/1092060654.db2.gz YCHMJMQTOPPZDK-FQEVSTJZSA-N 2 0 356.535 4.209 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccccn1 ZINC000500613565 1092281271 /nfs/dbraw/zinc/28/12/71/1092281271.db2.gz BTHUZGQUEISGSL-HXUWFJFHSA-N 2 0 351.538 4.467 20 0 FIADRP CCCc1nc(C)c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428236209 1092306324 /nfs/dbraw/zinc/30/63/24/1092306324.db2.gz GOZYFIWTOFWOEB-YLJYHZDGSA-N 2 0 355.526 4.420 20 0 FIADRP C[C@H]1CC([NH2+][C@H](CCO)c2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168013010 1092406646 /nfs/dbraw/zinc/40/66/46/1092406646.db2.gz HAKOLKNKABZTPB-SFYKDHMMSA-N 2 0 352.522 4.141 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000521043698 1092442963 /nfs/dbraw/zinc/44/29/63/1092442963.db2.gz HSCYQSIVNPZOHM-SIKLNZKXSA-N 2 0 374.532 4.076 20 0 FIADRP CC[NH+](CC)C[C@@H](C)NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000521372649 1092665878 /nfs/dbraw/zinc/66/58/78/1092665878.db2.gz DESUAZOAIRXVBC-GOSISDBHSA-N 2 0 374.573 4.303 20 0 FIADRP c1ccc2c(c1)[nH]c1c2C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000442640857 1092700962 /nfs/dbraw/zinc/70/09/62/1092700962.db2.gz CFMJLVADMRDIDV-FQEVSTJZSA-N 2 0 359.517 4.411 20 0 FIADRP c1ccc2c(c1)[nH]c1c2C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000442640858 1092701607 /nfs/dbraw/zinc/70/16/07/1092701607.db2.gz CFMJLVADMRDIDV-HXUWFJFHSA-N 2 0 359.517 4.411 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)C2)cc1 ZINC000442709036 1092734653 /nfs/dbraw/zinc/73/46/53/1092734653.db2.gz MZVAONBPDSRHFM-YXJHDRRASA-N 2 0 352.444 4.415 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442788579 1092767699 /nfs/dbraw/zinc/76/76/99/1092767699.db2.gz CMMPWZSMFOKCOZ-YTQUADARSA-N 2 0 372.475 4.288 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]C2CCC(C(F)F)CC2)C[C@H](C)O1 ZINC000442789616 1092768380 /nfs/dbraw/zinc/76/83/80/1092768380.db2.gz YKLCNJZLBOSMCQ-ZRDSACAASA-N 2 0 366.496 4.209 20 0 FIADRP CC[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000442871016 1092816483 /nfs/dbraw/zinc/81/64/83/1092816483.db2.gz FCTBYWMKVLCBRI-KRWDZBQOSA-N 2 0 358.357 4.060 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000549818001 1092843968 /nfs/dbraw/zinc/84/39/68/1092843968.db2.gz KTUNHNHTOCXRII-KSEOMHKRSA-N 2 0 372.553 4.000 20 0 FIADRP COc1ccccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001203439687 1092901933 /nfs/dbraw/zinc/90/19/33/1092901933.db2.gz UPBJJTIKDQYSTD-NHCUHLMSSA-N 2 0 350.506 4.039 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000521817454 1092936357 /nfs/dbraw/zinc/93/63/57/1092936357.db2.gz BVINXIUYOIMVBE-HDICACEKSA-N 2 0 362.521 4.331 20 0 FIADRP C/C(=C\c1ccccc1)C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000521823148 1092940280 /nfs/dbraw/zinc/94/02/80/1092940280.db2.gz LTNHCNOKHPKGHV-LSDHQDQOSA-N 2 0 363.549 4.282 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCCC2)cc1C ZINC000246242246 1092942547 /nfs/dbraw/zinc/94/25/47/1092942547.db2.gz GICPCLIEOXADKA-FPOVZHCZSA-N 2 0 369.553 4.019 20 0 FIADRP O[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000245687111 1092948275 /nfs/dbraw/zinc/94/82/75/1092948275.db2.gz JSNSZOWWXUAFAC-CIAFKFPVSA-N 2 0 370.924 4.159 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@H](C(C)(C)O)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168015140 1092950784 /nfs/dbraw/zinc/95/07/84/1092950784.db2.gz PCMHVAUQTFYKGM-MUWAIZJESA-N 2 0 358.570 4.347 20 0 FIADRP C[C@H]1CC([NH2+][C@H]2CC[C@H](C(C)(C)O)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168015143 1092954470 /nfs/dbraw/zinc/95/44/70/1092954470.db2.gz PCMHVAUQTFYKGM-QIJZPMMNSA-N 2 0 358.570 4.347 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)cn2)nc1 ZINC000644920460 1092978498 /nfs/dbraw/zinc/97/84/98/1092978498.db2.gz OYBOFLYNZHNSAY-UHFFFAOYSA-N 2 0 364.537 4.232 20 0 FIADRP Cc1cc(C(F)(F)F)cc(N2CCC[C@H](c3ncc4n3CCCC4)C2)n1 ZINC000663876315 1092985590 /nfs/dbraw/zinc/98/55/90/1092985590.db2.gz NTVAPTKMSVTZSP-AWEZNQCLSA-N 2 0 364.415 4.326 20 0 FIADRP C[C@@H]1CC([NH2+]CC[C@H](O)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015830 1093038611 /nfs/dbraw/zinc/03/86/11/1093038611.db2.gz SMWQPCYCNSNXRW-PWHSHALESA-N 2 0 352.522 4.141 20 0 FIADRP CSc1cc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)ccn1 ZINC000512646706 1093068162 /nfs/dbraw/zinc/06/81/62/1093068162.db2.gz CMDHHHLYKSADDA-PCCBWWKXSA-N 2 0 367.562 4.194 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](C[C@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000759142327 1093074634 /nfs/dbraw/zinc/07/46/34/1093074634.db2.gz ARCKSNDGTJETIX-SFHVURJKSA-N 2 0 359.341 4.079 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](C[C@@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000759142326 1093075361 /nfs/dbraw/zinc/07/53/61/1093075361.db2.gz ARCKSNDGTJETIX-GOSISDBHSA-N 2 0 359.341 4.079 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653318 1093079805 /nfs/dbraw/zinc/07/98/05/1093079805.db2.gz DOQNHDSYJJHESN-OYTPZHDJSA-N 2 0 370.581 4.208 20 0 FIADRP C[C@@H]1C[C@@H](n2nc(CC[NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168019822 1093191201 /nfs/dbraw/zinc/19/12/01/1093191201.db2.gz KFNLJQPSDLHWDM-OPVJXMOQSA-N 2 0 362.521 4.152 20 0 FIADRP C[C@@H]1CC(NC2CC[NH+](C3CCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020363 1093214300 /nfs/dbraw/zinc/21/43/00/1093214300.db2.gz MRBJFYRHVJPWEJ-RTBURBONSA-N 2 0 355.570 4.035 20 0 FIADRP CCCc1nc(C)c(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)o1 ZINC000428283618 1093267233 /nfs/dbraw/zinc/26/72/33/1093267233.db2.gz BBEOLVBUMUHAQK-UHFFFAOYSA-N 2 0 356.514 4.069 20 0 FIADRP C[C@@H](c1nc(-c2ccccc2)no1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443601334 1093317644 /nfs/dbraw/zinc/31/76/44/1093317644.db2.gz NORTVOUXXCVSSI-SFHVURJKSA-N 2 0 368.525 4.386 20 0 FIADRP CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000443646753 1093386732 /nfs/dbraw/zinc/38/67/32/1093386732.db2.gz WSEBJRDWUGSVEN-NFBKMPQASA-N 2 0 361.618 4.107 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Br)cc2)[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919297 1093435359 /nfs/dbraw/zinc/43/53/59/1093435359.db2.gz XQNUZABDZXOKSL-SMTGMISWSA-N 2 0 363.343 4.320 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)ccc1OC1CCCC1 ZINC000647790072 1093540903 /nfs/dbraw/zinc/54/09/03/1093540903.db2.gz QVUGJNASXYJVLC-GDAAHCPNSA-N 2 0 358.526 4.055 20 0 FIADRP C[C@@H]1CC(NCc2ccc3oc(=O)[nH]c3c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033141 1093703651 /nfs/dbraw/zinc/70/36/51/1093703651.db2.gz JWWSWNRCRLNMSX-HZPDHXFCSA-N 2 0 365.477 4.065 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3cc(F)ccc23)CC1 ZINC000513063541 1093715682 /nfs/dbraw/zinc/71/56/82/1093715682.db2.gz IFECVDPZXUNKPP-AOMKIAJQSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C(=O)OC(C)(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168034192 1093743719 /nfs/dbraw/zinc/74/37/19/1093743719.db2.gz OMMNQCSQNOHQOV-OPVJXMOQSA-N 2 0 374.569 4.386 20 0 FIADRP COc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1OCc1ccccc1 ZINC000513070477 1093774677 /nfs/dbraw/zinc/77/46/77/1093774677.db2.gz QCCYHKWICZTQSU-LJQANCHMSA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+](CC)CC1CCN(C(=O)c2ccc(C[N@H+](CC)C(C)C)cc2)CC1 ZINC000509915605 1094025821 /nfs/dbraw/zinc/02/58/21/1094025821.db2.gz IPVUDAWACULHGC-UHFFFAOYSA-N 2 0 373.585 4.111 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000513350412 1094073462 /nfs/dbraw/zinc/07/34/62/1094073462.db2.gz HSWGNYLHCNHDKB-IRMYBRCSSA-N 2 0 369.597 4.282 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)[NH+]2CCCC2)o1 ZINC000513495134 1094162085 /nfs/dbraw/zinc/16/20/85/1094162085.db2.gz ZXCQFUQPMAQSGS-BWAGFHJFSA-N 2 0 373.585 4.358 20 0 FIADRP Cc1ccn2c(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cnc2c1 ZINC000513494348 1094162263 /nfs/dbraw/zinc/16/22/63/1094162263.db2.gz HONRAUYGRIUZEU-TZIWHRDSSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513487303 1094166148 /nfs/dbraw/zinc/16/61/48/1094166148.db2.gz BAHDJNXHDOFFOR-NQIIRXRSSA-N 2 0 362.521 4.033 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513500012 1094172746 /nfs/dbraw/zinc/17/27/46/1094172746.db2.gz KKGFZXOORXKSNV-AVRDEDQJSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H](Cc2ccccn2)c2cccnc2)C1 ZINC000513524797 1094197910 /nfs/dbraw/zinc/19/79/10/1094197910.db2.gz ICGRAOSTCBLBHQ-TXTKFYIRSA-N 2 0 366.553 4.108 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)C3CCCCC3)c2)[C@H]2CCC[C@@H]21 ZINC000513667015 1094263725 /nfs/dbraw/zinc/26/37/25/1094263725.db2.gz PFTMIWSXYNXPLW-FSSWDIPSSA-N 2 0 369.553 4.168 20 0 FIADRP Fc1cc2cccnc2c(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC001648965874 1094343307 /nfs/dbraw/zinc/34/33/07/1094343307.db2.gz VPJPQDXIYMFIJV-IBGZPJMESA-N 2 0 363.480 4.376 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2cccc(F)c2)C2CCCC2)CC1 ZINC000500989284 1094405817 /nfs/dbraw/zinc/40/58/17/1094405817.db2.gz GAFYBEQELXMISF-JOCHJYFZSA-N 2 0 361.549 4.063 20 0 FIADRP C[NH+]1CCN(CCC[NH2+][C@@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000501051805 1094457606 /nfs/dbraw/zinc/45/76/06/1094457606.db2.gz GOKIRTSLGPLJAR-IBGZPJMESA-N 2 0 351.966 4.044 20 0 FIADRP CC[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1ccc2ccccc2c1 ZINC000501092175 1094501048 /nfs/dbraw/zinc/50/10/48/1094501048.db2.gz XREYIOKJILJYEW-UHFFFAOYSA-N 2 0 353.554 4.078 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501135534 1094523959 /nfs/dbraw/zinc/52/39/59/1094523959.db2.gz PKCQDAPGMWBBOE-QGZVFWFLSA-N 2 0 371.491 4.114 20 0 FIADRP CN(c1ccccc1C[NH2+]C1CCC(C(F)F)CC1)C1CC[NH+](C)CC1 ZINC000419782752 1094588419 /nfs/dbraw/zinc/58/84/19/1094588419.db2.gz NLEHZIVDRUONKB-UHFFFAOYSA-N 2 0 365.512 4.131 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cn1 ZINC000474823487 1094681421 /nfs/dbraw/zinc/68/14/21/1094681421.db2.gz UUNLSXZYEVHTTH-UHFFFAOYSA-N 2 0 363.505 4.337 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCOc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000389222013 1094700611 /nfs/dbraw/zinc/70/06/11/1094700611.db2.gz WSEUTXIJKFPMOL-CEWLAPEOSA-N 2 0 350.506 4.053 20 0 FIADRP [NH3+]CC[C@H]1CCC[N@@H+]([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000420315027 1094877166 /nfs/dbraw/zinc/87/71/66/1094877166.db2.gz RKSPEYBYAUNEJJ-VGSWGCGISA-N 2 0 361.489 4.153 20 0 FIADRP Clc1ccc(COC2CC[NH+](CC[C@@H]3CCC[NH2+]C3)CC2)cc1Cl ZINC000420313582 1094877439 /nfs/dbraw/zinc/87/74/39/1094877439.db2.gz YCUQAMXPSGEXEE-HNNXBMFYSA-N 2 0 371.352 4.364 20 0 FIADRP Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)nn1 ZINC000414452266 1094897587 /nfs/dbraw/zinc/89/75/87/1094897587.db2.gz PEKHNDOIFIVHRX-QNKZKCNHSA-N 2 0 370.928 4.142 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)CC1 ZINC000501982842 1095034998 /nfs/dbraw/zinc/03/49/98/1095034998.db2.gz VYRUBZVJKBXKCM-RBZQAINGSA-N 2 0 369.597 4.061 20 0 FIADRP CCCc1nc(C)c(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)o1 ZINC000428307262 1095040380 /nfs/dbraw/zinc/04/03/80/1095040380.db2.gz UAJVBMCLQNBFLS-UHFFFAOYSA-N 2 0 367.537 4.424 20 0 FIADRP COC[C@@]12CCC[C@@H]1C[N@@H+]([C@@H]1C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001168046220 1095090864 /nfs/dbraw/zinc/09/08/64/1095090864.db2.gz MSVARUMGOWVZHR-GTWWNFFPSA-N 2 0 356.554 4.177 20 0 FIADRP CC(C)([NH2+]Cc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000420932847 1095172495 /nfs/dbraw/zinc/17/24/95/1095172495.db2.gz HQEXJGPVBYBZCL-UHFFFAOYSA-N 2 0 358.913 4.197 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1OCC ZINC000513733770 1095216765 /nfs/dbraw/zinc/21/67/65/1095216765.db2.gz WALWINKJDMNMSA-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000502269721 1095286517 /nfs/dbraw/zinc/28/65/17/1095286517.db2.gz PMYMNMGSUUNNFZ-GOSISDBHSA-N 2 0 374.569 4.187 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000502281370 1095303460 /nfs/dbraw/zinc/30/34/60/1095303460.db2.gz AEAKEYRLHBIELQ-RBUKOAKNSA-N 2 0 362.558 4.187 20 0 FIADRP CCC1(C[NH2+][C@H]2CCC[C@H]2CCOC)CC[NH+](Cc2ccccc2)CC1 ZINC000502428571 1095447461 /nfs/dbraw/zinc/44/74/61/1095447461.db2.gz LZNPTONPSJXKQE-VXKWHMMOSA-N 2 0 358.570 4.474 20 0 FIADRP Clc1cccc(Cl)c1CCC[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000192630018 1095673922 /nfs/dbraw/zinc/67/39/22/1095673922.db2.gz PQKQULTXXSSIMU-OAHLLOKOSA-N 2 0 371.352 4.017 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cnn(C2CCCC2)c1 ZINC000502685266 1095713539 /nfs/dbraw/zinc/71/35/39/1095713539.db2.gz PHXRHIUPVXXGQK-GOSISDBHSA-N 2 0 352.526 4.445 20 0 FIADRP COc1ccc(Cl)cc1C[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000502880586 1095917466 /nfs/dbraw/zinc/91/74/66/1095917466.db2.gz QGNXQXUKYHZHSL-QFBILLFUSA-N 2 0 350.934 4.087 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)c2ccc(OC)cc2)cc1 ZINC000503076958 1096054490 /nfs/dbraw/zinc/05/44/90/1096054490.db2.gz WOVQFOICAPMELG-OFNKIYASSA-N 2 0 368.521 4.062 20 0 FIADRP COc1ccc(Oc2ccc(C[N@H+](C)C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cc1 ZINC000414651680 1096342995 /nfs/dbraw/zinc/34/29/95/1096342995.db2.gz FTNGCYXPZJFTCC-DFNIBXOVSA-N 2 0 352.478 4.202 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C(C)(C)c1ccccc1 ZINC000422703574 1096458401 /nfs/dbraw/zinc/45/84/01/1096458401.db2.gz IDIWDYDPHABNNX-XTQVGHSUSA-N 2 0 350.506 4.198 20 0 FIADRP c1ccc(CCCOc2cccc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)c2)cc1 ZINC000422710051 1096459457 /nfs/dbraw/zinc/45/94/57/1096459457.db2.gz KTLDBAYWHXUEOY-AIZNXBIQSA-N 2 0 364.533 4.113 20 0 FIADRP Brc1ccccc1SCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422761022 1096474792 /nfs/dbraw/zinc/47/47/92/1096474792.db2.gz QTUBUXKSNZWCQO-YIONKMFJSA-N 2 0 369.372 4.194 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OCC ZINC000422760528 1096476397 /nfs/dbraw/zinc/47/63/97/1096476397.db2.gz QFWJWPYTLKBJCI-GJZGRUSLSA-N 2 0 357.498 4.058 20 0 FIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000422753819 1096484287 /nfs/dbraw/zinc/48/42/87/1096484287.db2.gz GNTUHJLBBAIIOE-ROUUACIJSA-N 2 0 370.459 4.003 20 0 FIADRP Clc1ccc(SCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422774447 1096487667 /nfs/dbraw/zinc/48/76/67/1096487667.db2.gz XAJDDXUBYBFJCP-UYAOXDASSA-N 2 0 374.937 4.278 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2C)[NH2+][C@@H](C)CCC[NH3+])cc1OC ZINC000422795108 1096492531 /nfs/dbraw/zinc/49/25/31/1096492531.db2.gz ZLRZLYYRPZFSCI-FXAWDEMLSA-N 2 0 356.510 4.013 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422807140 1096495801 /nfs/dbraw/zinc/49/58/01/1096495801.db2.gz OMACGXJWFKTIBW-XQAUZQBESA-N 2 0 374.431 4.195 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422857050 1096505648 /nfs/dbraw/zinc/50/56/48/1096505648.db2.gz GNKPNHGWLPPVTQ-FDFHNCONSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000422875522 1096517844 /nfs/dbraw/zinc/51/78/44/1096517844.db2.gz PAIUDNNLWYYYOG-FZKQIMNGSA-N 2 0 365.290 4.395 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)ccc1Oc1cccnc1 ZINC000422901952 1096519573 /nfs/dbraw/zinc/51/95/73/1096519573.db2.gz LXPJFAKVELWGAV-HMXCVIKNSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422901575 1096519596 /nfs/dbraw/zinc/51/95/96/1096519596.db2.gz SEMHKQSDNXMMPU-PWRODBHTSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cn2)cc1 ZINC000422900919 1096519700 /nfs/dbraw/zinc/51/97/00/1096519700.db2.gz RBWLXIXHMFHPNG-SLFFLAALSA-N 2 0 355.457 4.023 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000422912667 1096522495 /nfs/dbraw/zinc/52/24/95/1096522495.db2.gz WQHUKBUPGIGKBI-QGPMSJSTSA-N 2 0 371.550 4.174 20 0 FIADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 ZINC000422938196 1096530615 /nfs/dbraw/zinc/53/06/15/1096530615.db2.gz GVSDTUOVZVXIBR-VQTJNVASSA-N 2 0 356.897 4.123 20 0 FIADRP Cc1ccc(COc2ccc(C[C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cc1 ZINC000422939500 1096530760 /nfs/dbraw/zinc/53/07/60/1096530760.db2.gz FWXDNNBKCUTWTE-QUFMSWDXSA-N 2 0 364.533 4.378 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000422939102 1096530815 /nfs/dbraw/zinc/53/08/15/1096530815.db2.gz QTBNDHFNPRCTEP-QGZVFWFLSA-N 2 0 361.489 4.245 20 0 FIADRP Clc1cccc(CCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422945633 1096535647 /nfs/dbraw/zinc/53/56/47/1096535647.db2.gz NMINLQWPDDLVFN-CTNGQTDRSA-N 2 0 356.897 4.118 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422977042 1096543273 /nfs/dbraw/zinc/54/32/73/1096543273.db2.gz WAHXXKHKWNDWOZ-YCRNBWNJSA-N 2 0 366.505 4.447 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422977048 1096543332 /nfs/dbraw/zinc/54/33/32/1096543332.db2.gz WAHXXKHKWNDWOZ-YYDVJCTNSA-N 2 0 366.505 4.447 20 0 FIADRP Cc1ccccc1O[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422996184 1096552848 /nfs/dbraw/zinc/55/28/48/1096552848.db2.gz LFCSECNWNIJUSM-NQSCKRDGSA-N 2 0 353.510 4.198 20 0 FIADRP Cc1oc2ccccc2c1CC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423051603 1096565323 /nfs/dbraw/zinc/56/53/23/1096565323.db2.gz OTIMMDCLHKXZLA-NZQKXSOJSA-N 2 0 362.473 4.129 20 0 FIADRP Fc1cc(C2CC2)ccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423123500 1096578849 /nfs/dbraw/zinc/57/88/49/1096578849.db2.gz DZWCBMMHAPJHEK-UNMCSNQZSA-N 2 0 352.453 4.049 20 0 FIADRP CCc1ccc([C@H](C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)N(CC)CC)cc1 ZINC000423121684 1096578922 /nfs/dbraw/zinc/57/89/22/1096578922.db2.gz BAPXNGWXRBXUCD-SBUREZEXSA-N 2 0 368.569 4.145 20 0 FIADRP CCc1ccc([C@@H](C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)N(CC)CC)cc1 ZINC000423121682 1096579370 /nfs/dbraw/zinc/57/93/70/1096579370.db2.gz BAPXNGWXRBXUCD-GAJHUEQPSA-N 2 0 368.569 4.145 20 0 FIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)C2)c1 ZINC000423105672 1096583420 /nfs/dbraw/zinc/58/34/20/1096583420.db2.gz ZGGWNSBYTGZQCW-GPFWEFOESA-N 2 0 352.444 4.462 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000423107017 1096583493 /nfs/dbraw/zinc/58/34/93/1096583493.db2.gz PDHJPNQYIRSOTI-FSPWUOQZSA-N 2 0 366.347 4.196 20 0 FIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)C2)c1 ZINC000423105674 1096583911 /nfs/dbraw/zinc/58/39/11/1096583911.db2.gz ZGGWNSBYTGZQCW-WSIUPNEHSA-N 2 0 352.444 4.462 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000423113103 1096585763 /nfs/dbraw/zinc/58/57/63/1096585763.db2.gz YKDBMISFICVWQC-BVOGOJNSSA-N 2 0 364.961 4.361 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(Br)c1 ZINC000423194578 1096613307 /nfs/dbraw/zinc/61/33/07/1096613307.db2.gz WWPZGDPJTJRNMU-SNVBAGLBSA-N 2 0 368.706 4.115 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CC1 ZINC000423230809 1096624335 /nfs/dbraw/zinc/62/43/35/1096624335.db2.gz KFBZSAHXLNZXSA-MQBCKMQZSA-N 2 0 367.262 4.130 20 0 FIADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423244557 1096628062 /nfs/dbraw/zinc/62/80/62/1096628062.db2.gz HSCCHTXCTGUPGC-GHMZBOCLSA-N 2 0 354.338 4.374 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]CC[C@H]2CC[NH2+]C2)nc1 ZINC000423248302 1096628872 /nfs/dbraw/zinc/62/88/72/1096628872.db2.gz MYHQEIKEZPPHDP-DENIHFKCSA-N 2 0 371.956 4.040 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](Cc2ccccc2Cl)[C@H]2CCCO2)cc1 ZINC000423291727 1096635988 /nfs/dbraw/zinc/63/59/88/1096635988.db2.gz JPZJSSNSPQEEAR-IWMITWMQSA-N 2 0 358.913 4.240 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](Cc2ccccc2Cl)[C@@H]2CCCO2)cc1 ZINC000423291728 1096636115 /nfs/dbraw/zinc/63/61/15/1096636115.db2.gz JPZJSSNSPQEEAR-JHVJFLLYSA-N 2 0 358.913 4.240 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)CCC3)cc1 ZINC000423344803 1096646715 /nfs/dbraw/zinc/64/67/15/1096646715.db2.gz YEAULUVWWBUYPG-UTKZUKDTSA-N 2 0 371.550 4.175 20 0 FIADRP Brc1ccccc1[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1 ZINC000423328136 1096648781 /nfs/dbraw/zinc/64/87/81/1096648781.db2.gz AFMRNIMXOWMLIV-LJQANCHMSA-N 2 0 357.295 4.048 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423328577 1096648977 /nfs/dbraw/zinc/64/89/77/1096648977.db2.gz KWNREIWEJFFVSC-LLVKDONJSA-N 2 0 368.344 4.271 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc(F)c(F)c2)c1 ZINC000423350392 1096653141 /nfs/dbraw/zinc/65/31/41/1096653141.db2.gz ZGDDPSRNZJQOFZ-FQEVSTJZSA-N 2 0 360.473 4.285 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCc3cc(N)ccc32)CC1 ZINC000423354096 1096653909 /nfs/dbraw/zinc/65/39/09/1096653909.db2.gz CMYVVCQSTDWWMF-KOSHJBKYSA-N 2 0 363.549 4.331 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cccc(Br)c21 ZINC000423369510 1096658204 /nfs/dbraw/zinc/65/82/04/1096658204.db2.gz DYSFCENHFBQTID-SGTLLEGYSA-N 2 0 357.295 4.390 20 0 FIADRP CC1CC[NH+](CCC[C@H](N[C@H]2CC[NH2+][C@H](C)C2)c2ccc(F)cc2)CC1 ZINC000423392993 1096664871 /nfs/dbraw/zinc/66/48/71/1096664871.db2.gz XZGCYOQZVXGOTK-COPCDDAFSA-N 2 0 361.549 4.109 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1Cl)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414739239 1096668392 /nfs/dbraw/zinc/66/83/92/1096668392.db2.gz PXUZRDQLVRJUMJ-UONOGXRCSA-N 2 0 372.340 4.032 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423399899 1096668641 /nfs/dbraw/zinc/66/86/41/1096668641.db2.gz VFVSHEBUABIXQD-MRXNPFEDSA-N 2 0 366.509 4.014 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000423416591 1096675646 /nfs/dbraw/zinc/67/56/46/1096675646.db2.gz CZXNLRASTXQJRJ-CBGDNZLLSA-N 2 0 357.929 4.374 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000423429779 1096683393 /nfs/dbraw/zinc/68/33/93/1096683393.db2.gz KOUVXEAOOWBLRV-YVEFUNNKSA-N 2 0 369.278 4.378 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423438272 1096687079 /nfs/dbraw/zinc/68/70/79/1096687079.db2.gz MZPRHCIJIUREHH-ULFGMLNVSA-N 2 0 359.514 4.296 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000423457358 1096687912 /nfs/dbraw/zinc/68/79/12/1096687912.db2.gz OWBRHMQTFWOJKF-UWVGGRQHSA-N 2 0 353.226 4.246 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000423459988 1096689475 /nfs/dbraw/zinc/68/94/75/1096689475.db2.gz APWLIRUCJPTCCI-JDSLSITLSA-N 2 0 355.295 4.146 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000423475045 1096695310 /nfs/dbraw/zinc/69/53/10/1096695310.db2.gz PSCKDMLQYJBKRQ-FDQGKXFDSA-N 2 0 363.299 4.239 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000423480903 1096697986 /nfs/dbraw/zinc/69/79/86/1096697986.db2.gz WGCBTYMCNYDSCM-CPUCHLNUSA-N 2 0 359.514 4.434 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c2ccc(OC)cc2)cc1 ZINC000423479176 1096698248 /nfs/dbraw/zinc/69/82/48/1096698248.db2.gz UMMLOAPFFAHKQL-XQFWAAQXSA-N 2 0 368.521 4.095 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)nc1 ZINC000423498129 1096699782 /nfs/dbraw/zinc/69/97/82/1096699782.db2.gz GMQLZBVSCQZKDV-QIJUGHKUSA-N 2 0 371.956 4.168 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423503728 1096700737 /nfs/dbraw/zinc/70/07/37/1096700737.db2.gz FYTKVJDSYJZDKT-HLIPFELVSA-N 2 0 356.510 4.266 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423503732 1096700924 /nfs/dbraw/zinc/70/09/24/1096700924.db2.gz FYTKVJDSYJZDKT-UWVAXJGDSA-N 2 0 356.510 4.266 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2ccccc2Cl)cc1OC ZINC000423506808 1096702535 /nfs/dbraw/zinc/70/25/35/1096702535.db2.gz MILDHHBXNBGRDZ-ZJTDPSCFSA-N 2 0 374.912 4.164 20 0 FIADRP C[C@H](NC[C@H]1C[NH2+]CCCO1)c1ccc(-c2ccccc2Cl)s1 ZINC000423512609 1096710135 /nfs/dbraw/zinc/71/01/35/1096710135.db2.gz KUZSEGKCARKLLC-UONOGXRCSA-N 2 0 350.915 4.098 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCNCC3)CC2)cc1 ZINC000423519474 1096711872 /nfs/dbraw/zinc/71/18/72/1096711872.db2.gz PUXRYJYHWWBYTA-KKXNLOMOSA-N 2 0 361.599 4.054 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423524512 1096712903 /nfs/dbraw/zinc/71/29/03/1096712903.db2.gz XHLPQCNRVMYRKU-XLIONFOSSA-N 2 0 356.510 4.013 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000423525188 1096713138 /nfs/dbraw/zinc/71/31/38/1096713138.db2.gz KCPGPCLOIPKQNX-PXNSSMCTSA-N 2 0 369.578 4.270 20 0 FIADRP CSC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000423538954 1096715663 /nfs/dbraw/zinc/71/56/63/1096715663.db2.gz HIPIVZHZWYOPBW-DIECFANBSA-N 2 0 358.473 4.087 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(OCc2ccccc2)cc1 ZINC000423544483 1096717515 /nfs/dbraw/zinc/71/75/15/1096717515.db2.gz OGFUKCIABAELIB-KVJIRVJXSA-N 2 0 350.506 4.304 20 0 FIADRP C[C@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1csc(Cl)c1 ZINC000423580736 1096725067 /nfs/dbraw/zinc/72/50/67/1096725067.db2.gz YHRXKMGYONSUNO-HNNXBMFYSA-N 2 0 363.958 4.046 20 0 FIADRP CCN(C(=O)[C@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1)C1CCCCC1 ZINC000515526873 1098665651 /nfs/dbraw/zinc/66/56/51/1098665651.db2.gz PQZLKKGYUNLWDB-IBGZPJMESA-N 2 0 373.585 4.188 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436301833 1098915806 /nfs/dbraw/zinc/91/58/06/1098915806.db2.gz OTIHAPJGTIOWBH-IIBYNOLFSA-N 2 0 351.469 4.307 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC1 ZINC000436305672 1098918235 /nfs/dbraw/zinc/91/82/35/1098918235.db2.gz IYJKHWCDSNGXNL-QFIPXVFZSA-N 2 0 357.586 4.098 20 0 FIADRP Cc1csc([C@@H](C)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000248744166 1099409498 /nfs/dbraw/zinc/40/94/98/1099409498.db2.gz ANYYVFYLBKDTOO-MVJPYGJCSA-N 2 0 355.551 4.340 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)[C@@H](C)C1 ZINC000437090290 1099594989 /nfs/dbraw/zinc/59/49/89/1099594989.db2.gz AGSNXTKBMJPFAI-SNJCGAMXSA-N 2 0 358.570 4.124 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261638623 1099629095 /nfs/dbraw/zinc/62/90/95/1099629095.db2.gz DHKNSHNXTHPJBN-QHCPKHFHSA-N 2 0 360.505 4.018 20 0 FIADRP [NH3+]C[C@@H]1C[N@H+](Cc2cnc(-c3ccsc3)s2)C[C@H]1c1ccccc1 ZINC000261820731 1099662849 /nfs/dbraw/zinc/66/28/49/1099662849.db2.gz NJZJYMHRKXGSOK-AEFFLSMTSA-N 2 0 355.532 4.046 20 0 FIADRP Cc1cc(Br)cc(C)c1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459389865 1099685829 /nfs/dbraw/zinc/68/58/29/1099685829.db2.gz ODTRPGBPDWHRTD-UHFFFAOYSA-N 2 0 374.326 4.220 20 0 FIADRP CC(C)C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000162499665 1099810403 /nfs/dbraw/zinc/81/04/03/1099810403.db2.gz KYRZGDWCQXOCIJ-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP CCC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000162484089 1099812428 /nfs/dbraw/zinc/81/24/28/1099812428.db2.gz QAOAVHXQGNHJRQ-SFHVURJKSA-N 2 0 358.357 4.062 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC000508693237 1099827116 /nfs/dbraw/zinc/82/71/16/1099827116.db2.gz CPNJAKCBBLYOLJ-HKUYNNGSSA-N 2 0 357.567 4.309 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714326 1099882312 /nfs/dbraw/zinc/88/23/12/1099882312.db2.gz GZLDRXFFPUILJB-GGPKGHCWSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@@H]([NH2+]CCCCN(C)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715619 1099885055 /nfs/dbraw/zinc/88/50/55/1099885055.db2.gz DRVUWMFURVRBBB-FYYLOGMGSA-N 2 0 365.565 4.403 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000508709809 1099900548 /nfs/dbraw/zinc/90/05/48/1099900548.db2.gz JOMTZMFQRRLSSA-HYBUGGRVSA-N 3 0 365.565 4.139 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)COCc1ccccc1 ZINC000508712289 1099904194 /nfs/dbraw/zinc/90/41/94/1099904194.db2.gz QLRNQJPADKUIMM-PQNGQFLHSA-N 2 0 366.549 4.340 20 0 FIADRP C[C@H]([NH2+]CCCCOc1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721375 1099937450 /nfs/dbraw/zinc/93/74/50/1099937450.db2.gz PGLIQDTZLOHXOY-PZJWPPBQSA-N 2 0 370.512 4.485 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000516999377 1099986350 /nfs/dbraw/zinc/98/63/50/1099986350.db2.gz PSDXNSRXQTURFU-DEOSSOPVSA-N 2 0 364.533 4.443 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CC(C(C)(C)C)C2)c1)C1CCOCC1 ZINC000459400466 1100107432 /nfs/dbraw/zinc/10/74/32/1100107432.db2.gz HTVLPTLZIUGZLQ-UHFFFAOYSA-N 2 0 374.569 4.091 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)ccc1O ZINC000459413045 1100138866 /nfs/dbraw/zinc/13/88/66/1100138866.db2.gz NVWKRNKKDDHJSC-UHFFFAOYSA-N 2 0 368.521 4.457 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000536675586 1100164594 /nfs/dbraw/zinc/16/45/94/1100164594.db2.gz YMJNFDJIBOMHSC-UHFFFAOYSA-N 2 0 362.901 4.143 20 0 FIADRP CCOCc1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)ccc1OC ZINC000536697852 1100202970 /nfs/dbraw/zinc/20/29/70/1100202970.db2.gz XKJWRIGXCYFYPA-UHFFFAOYSA-N 2 0 374.569 4.320 20 0 FIADRP CCOc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc(Cl)c1O ZINC000459462304 1100207426 /nfs/dbraw/zinc/20/74/26/1100207426.db2.gz KUFXOCMCFVMZIA-GDBMZVCRSA-N 2 0 366.933 4.187 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccco2)cc1 ZINC000459567909 1100315683 /nfs/dbraw/zinc/31/56/83/1100315683.db2.gz YMTMXOFRJADFDS-JOCHJYFZSA-N 2 0 363.461 4.031 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(OC)c1 ZINC000536828198 1100326905 /nfs/dbraw/zinc/32/69/05/1100326905.db2.gz RDVJRZSITUROTI-VIQWUECVSA-N 2 0 360.542 4.398 20 0 FIADRP COc1ccc(OC)c([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000536826338 1100341497 /nfs/dbraw/zinc/34/14/97/1100341497.db2.gz KHYLLFUWEIUHCW-LMDPOFIKSA-N 2 0 360.542 4.398 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000536824973 1100341786 /nfs/dbraw/zinc/34/17/86/1100341786.db2.gz DZUYQYPSVRWLJS-IEBWSBKVSA-N 2 0 354.494 4.102 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)C1 ZINC000536831711 1100370469 /nfs/dbraw/zinc/37/04/69/1100370469.db2.gz IWQUORBOCHSAPT-OALUTQOASA-N 2 0 374.573 4.235 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000536855078 1100371757 /nfs/dbraw/zinc/37/17/57/1100371757.db2.gz YHXLYEYVGOAFDR-DQLDELGASA-N 2 0 362.583 4.217 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](c2cccs2)C2CCCC2)C[C@@H](C)O1 ZINC000536857270 1100373939 /nfs/dbraw/zinc/37/39/39/1100373939.db2.gz KRFVCJUJJSJAEA-MBOZVWFJSA-N 2 0 350.572 4.458 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536864401 1100381469 /nfs/dbraw/zinc/38/14/69/1100381469.db2.gz SPUDSRPOTZXEIU-QGZVFWFLSA-N 2 0 360.546 4.084 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]CC[C@H]2CCOC2)c1 ZINC000438062335 1100404144 /nfs/dbraw/zinc/40/41/44/1100404144.db2.gz DCUXEXYGEJYTET-NRFANRHFSA-N 2 0 364.533 4.466 20 0 FIADRP CCCCOc1ccc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OCC ZINC000459663945 1100411862 /nfs/dbraw/zinc/41/18/62/1100411862.db2.gz ZMOHFLXVQQIHOT-UHFFFAOYSA-N 2 0 353.466 4.202 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000414921847 1100416985 /nfs/dbraw/zinc/41/69/85/1100416985.db2.gz FAJSFYGOSPRUCQ-GMHONNGPSA-N 2 0 361.533 4.146 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000425951564 1100446285 /nfs/dbraw/zinc/44/62/85/1100446285.db2.gz QCXJNKYFOYGXPS-HBMCJLEFSA-N 2 0 355.913 4.235 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(Br)cc2)C1 ZINC000517536622 1100459039 /nfs/dbraw/zinc/45/90/39/1100459039.db2.gz UVDLWSNEMFZPGZ-IYBDPMFKSA-N 2 0 353.348 4.297 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C12CCC(C(F)(F)F)(CC1)CC2 ZINC000426000511 1100644069 /nfs/dbraw/zinc/64/40/69/1100644069.db2.gz SMWQNCBQYDOAKW-UHFFFAOYSA-N 2 0 364.415 4.321 20 0 FIADRP Cc1noc(C2CCC([NH2+]C[C@]3(C)CCCN3Cc3ccccc3)CC2)n1 ZINC000518045341 1100885130 /nfs/dbraw/zinc/88/51/30/1100885130.db2.gz ADQPMUPEZSPBEX-AOMIVXANSA-N 2 0 368.525 4.049 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC[NH2+]1 ZINC000414946502 1100902516 /nfs/dbraw/zinc/90/25/16/1100902516.db2.gz JSJLFUFZGSNCSF-ZBFHGGJFSA-N 2 0 360.933 4.189 20 0 FIADRP COc1ccc(CN(C)C2CC[NH+](C(C)C)CC2)cc1OCCC(C)C ZINC000506355034 1100904625 /nfs/dbraw/zinc/90/46/25/1100904625.db2.gz GXGOXLLHIFYMAV-UHFFFAOYSA-N 2 0 362.558 4.425 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOCCc2ccccc2)C1 ZINC000506474790 1101111092 /nfs/dbraw/zinc/11/10/92/1101111092.db2.gz PPFKYGICIASALG-JTHBVZDNSA-N 2 0 358.570 4.222 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422733120 1101316292 /nfs/dbraw/zinc/31/62/92/1101316292.db2.gz ATNQLPFCGUUVJE-URHDLPFOSA-N 2 0 367.356 4.105 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1OCc1ccccc1 ZINC000459736657 1101365443 /nfs/dbraw/zinc/36/54/43/1101365443.db2.gz QGSDUIMIZSMAIZ-LJQANCHMSA-N 2 0 368.521 4.096 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)C1 ZINC000537014667 1101396008 /nfs/dbraw/zinc/39/60/08/1101396008.db2.gz WJARBFWHJIKNLO-OXJNMPFZSA-N 2 0 359.514 4.188 20 0 FIADRP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCc2cccnc2)cc1 ZINC000537024563 1101402937 /nfs/dbraw/zinc/40/29/37/1101402937.db2.gz PVUUPHVVHNLJAW-NQIIRXRSSA-N 2 0 353.510 4.186 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000414999984 1101513825 /nfs/dbraw/zinc/51/38/25/1101513825.db2.gz JSUFNCAXPKMUJG-DNVCBOLYSA-N 2 0 371.912 4.199 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(Br)ccc2F)C1 ZINC000518763532 1101519289 /nfs/dbraw/zinc/51/92/89/1101519289.db2.gz UCCIDDZCUXABLI-AWEZNQCLSA-N 2 0 357.311 4.190 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190273 1101523824 /nfs/dbraw/zinc/52/38/24/1101523824.db2.gz YVYNWLTWZUIEAF-ODOSVJCGSA-N 2 0 362.517 4.498 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH2+]C[C@H](C)CN1CC[NH+](CC)CC1 ZINC000518777540 1101540531 /nfs/dbraw/zinc/54/05/31/1101540531.db2.gz JDLXZGQIPSVMJP-IBGZPJMESA-N 2 0 371.569 4.139 20 0 FIADRP CC(C)[NH+](CCCN[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)C ZINC000537189937 1101542173 /nfs/dbraw/zinc/54/21/73/1101542173.db2.gz LOKDJLFPGMCKGT-NRFANRHFSA-N 2 0 373.585 4.073 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(-n3ccnc3C)c(F)c2)cc1 ZINC000181997289 1101601792 /nfs/dbraw/zinc/60/17/92/1101601792.db2.gz LSWVGUGDKOPWPO-AWEZNQCLSA-N 2 0 366.440 4.129 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)ccn1 ZINC000537308121 1101632645 /nfs/dbraw/zinc/63/26/45/1101632645.db2.gz QWFSBAXIAZHSQY-NRFANRHFSA-N 2 0 353.510 4.043 20 0 FIADRP CN(c1ccccc1C[N@H+](C)[C@H]1CCc2ccccc21)C1CC[NH+](C)CC1 ZINC000506652514 1101684887 /nfs/dbraw/zinc/68/48/87/1101684887.db2.gz GIPUHDGKMZIBDU-DEOSSOPVSA-N 2 0 363.549 4.336 20 0 FIADRP C[NH+]1CCC(N2CC[C@@H]([NH2+][C@H]3CC=C(c4ccc(Cl)cc4)CC3)C2)CC1 ZINC000648450466 1101719643 /nfs/dbraw/zinc/71/96/43/1101719643.db2.gz NJXYQCCGHPEASS-LEWJYISDSA-N 2 0 373.972 4.034 20 0 FIADRP CC[NH+]1CCC(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000325409826 1101796182 /nfs/dbraw/zinc/79/61/82/1101796182.db2.gz STJGRTWPNJYXSU-UHFFFAOYSA-N 2 0 354.338 4.298 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168169951 1101876617 /nfs/dbraw/zinc/87/66/17/1101876617.db2.gz YWZAQVARRRCMAQ-MAODMQOUSA-N 2 0 357.929 4.438 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(C)c1 ZINC000519168602 1101983504 /nfs/dbraw/zinc/98/35/04/1101983504.db2.gz KTKIIAJAILBIIQ-PKTZIBPZSA-N 2 0 352.522 4.193 20 0 FIADRP Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1 ZINC001168284805 1102158950 /nfs/dbraw/zinc/15/89/50/1102158950.db2.gz NUGWBBOJSAKTFP-WTIAFYNJSA-N 2 0 352.522 4.140 20 0 FIADRP Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)c1 ZINC001168284801 1102159372 /nfs/dbraw/zinc/15/93/72/1102159372.db2.gz NUGWBBOJSAKTFP-AJSBUHFISA-N 2 0 352.522 4.140 20 0 FIADRP Cc1ccccc1CCC[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000440326828 1102199131 /nfs/dbraw/zinc/19/91/31/1102199131.db2.gz NORUTCCCHCRTEL-UHFFFAOYSA-N 2 0 371.613 4.056 20 0 FIADRP c1nc(-c2ccncc2)sc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000440349383 1102211400 /nfs/dbraw/zinc/21/14/00/1102211400.db2.gz ZLDPZLVUTNXTFI-UHFFFAOYSA-N 2 0 364.518 4.091 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000415012837 1102248136 /nfs/dbraw/zinc/24/81/36/1102248136.db2.gz XRYDZVWRFGZCPO-LMSBXDPUSA-N 2 0 358.423 4.230 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000061070934 1102259018 /nfs/dbraw/zinc/25/90/18/1102259018.db2.gz KPNABEYDAWNKIT-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Br)cc1F)c1ccccc1 ZINC000415050592 1102262790 /nfs/dbraw/zinc/26/27/90/1102262790.db2.gz ISIPIXXZYQVUHL-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000415020367 1102264256 /nfs/dbraw/zinc/26/42/56/1102264256.db2.gz XIUJSLYJTXACJW-LBPRGKRZSA-N 2 0 368.344 4.180 20 0 FIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCc3noc4ccccc43)C2)s1 ZINC000653665019 1102272071 /nfs/dbraw/zinc/27/20/71/1102272071.db2.gz KQFNHXJUPGSINR-QGZVFWFLSA-N 2 0 369.534 4.194 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000187582689 1102284443 /nfs/dbraw/zinc/28/44/43/1102284443.db2.gz NWNDUGKVFJZFFW-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000121023025 1102308857 /nfs/dbraw/zinc/30/88/57/1102308857.db2.gz UGKGLEBFOBAOKQ-APWZRJJASA-N 2 0 371.491 4.020 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cccc(CO)c1 ZINC000121229853 1102348485 /nfs/dbraw/zinc/34/84/85/1102348485.db2.gz OGMAVMJMVSIKEC-OALUTQOASA-N 2 0 352.522 4.404 20 0 FIADRP c1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CCOCC2)cc1 ZINC001167969250 1102364902 /nfs/dbraw/zinc/36/49/02/1102364902.db2.gz AVFGZPBVHHZWGC-GLCCWIKHSA-N 2 0 354.538 4.149 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000532462202 1102369172 /nfs/dbraw/zinc/36/91/72/1102369172.db2.gz FYCKHHZGGCHRLC-KRWDZBQOSA-N 2 0 357.542 4.134 20 0 FIADRP c1nc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)oc1-c1ccccc1 ZINC000121671852 1102433129 /nfs/dbraw/zinc/43/31/29/1102433129.db2.gz BLULNALXXMVJHP-UHFFFAOYSA-N 2 0 353.510 4.430 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(CO)c1 ZINC000121698305 1102439366 /nfs/dbraw/zinc/43/93/66/1102439366.db2.gz KGAMSQXMLXWOJN-IBGZPJMESA-N 2 0 352.522 4.262 20 0 FIADRP c1ccc2cc(OCCC[NH+]3CCC(C[NH+]4CCCC4)CC3)ccc2c1 ZINC000303176555 1102458216 /nfs/dbraw/zinc/45/82/16/1102458216.db2.gz KBPCHEHDEVURMV-UHFFFAOYSA-N 2 0 352.522 4.417 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000519555511 1102507304 /nfs/dbraw/zinc/50/73/04/1102507304.db2.gz GAXXNNLWEIVMST-FQEVSTJZSA-N 2 0 361.917 4.162 20 0 FIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]CCCC[NH+]1CCOCC1 ZINC000519554812 1102508798 /nfs/dbraw/zinc/50/87/98/1102508798.db2.gz NUEBTJUGAORSJC-UHFFFAOYSA-N 2 0 352.931 4.065 20 0 FIADRP COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccccc12 ZINC001167973426 1102545172 /nfs/dbraw/zinc/54/51/72/1102545172.db2.gz KLXFZSWUTGRURT-IHWFROFDSA-N 2 0 350.506 4.343 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cccc(C(F)(F)F)n2)CC1 ZINC000550857310 1102577678 /nfs/dbraw/zinc/57/76/78/1102577678.db2.gz REGLPBHHCNWWOC-YJBOKZPZSA-N 2 0 369.475 4.276 20 0 FIADRP COCC1(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000550861100 1102644529 /nfs/dbraw/zinc/64/45/29/1102644529.db2.gz WETNHCIGGUAJLC-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP C[NH+](C)C1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000192629842 1102742933 /nfs/dbraw/zinc/74/29/33/1102742933.db2.gz RDUGSDOHGWITTI-UHFFFAOYSA-N 2 0 372.557 4.009 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000551004568 1102772472 /nfs/dbraw/zinc/77/24/72/1102772472.db2.gz BZGGFRQNIAGNPE-BJKOFHAPSA-N 2 0 365.565 4.454 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000551013471 1102789531 /nfs/dbraw/zinc/78/95/31/1102789531.db2.gz BYUFYGOVVRKVIV-ZEQRLZLVSA-N 2 0 365.565 4.452 20 0 FIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCOC(c3ccccc3)c3ccccc3)C2)C1 ZINC000550238343 1102803031 /nfs/dbraw/zinc/80/30/31/1102803031.db2.gz BIZWHSQATQLKRP-DEOSSOPVSA-N 2 0 364.533 4.210 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000551051577 1102864364 /nfs/dbraw/zinc/86/43/64/1102864364.db2.gz RFQSEFCPURWJIC-RBZQAINGSA-N 2 0 363.549 4.076 20 0 FIADRP CC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CC1 ZINC000550271477 1102905900 /nfs/dbraw/zinc/90/59/00/1102905900.db2.gz SYAKOCGNLJJOOD-IRQNMHNUSA-N 2 0 356.554 4.084 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000506911086 1102949518 /nfs/dbraw/zinc/94/95/18/1102949518.db2.gz PQXUQZGRXFEZGE-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OC)c(Br)c2)CC1 ZINC000506930113 1102967113 /nfs/dbraw/zinc/96/71/13/1102967113.db2.gz SHIYOZBUMBQQLL-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccncc1F ZINC000551286839 1103045994 /nfs/dbraw/zinc/04/59/94/1103045994.db2.gz MXGZFHFJDWYGBS-INIZCTEOSA-N 2 0 353.441 4.297 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccncc1F ZINC000551286840 1103046130 /nfs/dbraw/zinc/04/61/30/1103046130.db2.gz MXGZFHFJDWYGBS-MRXNPFEDSA-N 2 0 353.441 4.297 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)C1 ZINC000551308031 1103081772 /nfs/dbraw/zinc/08/17/72/1103081772.db2.gz IXAYOYLBMIRMCB-ZKMFCFPVSA-N 3 0 371.613 4.387 20 0 FIADRP CC[NH+](CC)[C@H](c1nc(-c2cccc(-n3ccnc3)c2)no1)c1ccccc1 ZINC000514692393 1103246995 /nfs/dbraw/zinc/24/69/95/1103246995.db2.gz XZXACASXMVRMPS-FQEVSTJZSA-N 2 0 373.460 4.354 20 0 FIADRP Cc1noc(C)c1C[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652433 1103310700 /nfs/dbraw/zinc/31/07/00/1103310700.db2.gz CSYDHKLPYCEYCN-HUJKARHJSA-N 2 0 353.510 4.008 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000551534843 1103336123 /nfs/dbraw/zinc/33/61/23/1103336123.db2.gz RJBBYEMJELHWRP-INIZCTEOSA-N 2 0 368.949 4.279 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CS[C@H](C(C)(C)C)C3)cc2)CC1 ZINC000551567393 1103368801 /nfs/dbraw/zinc/36/88/01/1103368801.db2.gz SLRNMADZZDIFEG-PXNSSMCTSA-N 2 0 362.583 4.169 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000507418741 1103369558 /nfs/dbraw/zinc/36/95/58/1103369558.db2.gz BNRDCLVOBKLODS-GOSISDBHSA-N 2 0 354.542 4.180 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc2)c1 ZINC000507425342 1103379285 /nfs/dbraw/zinc/37/92/85/1103379285.db2.gz VSCVUWBIAYQRIL-JOCHJYFZSA-N 2 0 352.522 4.301 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000507470840 1103417682 /nfs/dbraw/zinc/41/76/82/1103417682.db2.gz NXJLELMOVWEUMG-OTWHNJEPSA-N 2 0 367.537 4.104 20 0 FIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000507470838 1103417981 /nfs/dbraw/zinc/41/79/81/1103417981.db2.gz NXJLELMOVWEUMG-CEXWTWQISA-N 2 0 367.537 4.104 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000507484028 1103431599 /nfs/dbraw/zinc/43/15/99/1103431599.db2.gz IRXKAQYCTOCPCH-BVAFDOMYSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)[C@@H]1CCCOC1 ZINC000507489102 1103437603 /nfs/dbraw/zinc/43/76/03/1103437603.db2.gz WENFUIDYFDDMHJ-NZQKXSOJSA-N 2 0 358.570 4.126 20 0 FIADRP CCc1cccnc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000507536995 1103462357 /nfs/dbraw/zinc/46/23/57/1103462357.db2.gz XPBMKPDWFPCIJO-GOSISDBHSA-N 2 0 367.537 4.215 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000551779175 1103627135 /nfs/dbraw/zinc/62/71/35/1103627135.db2.gz RJQALZFIFKYGJI-FOZDKVSISA-N 2 0 364.533 4.299 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000551798473 1103674904 /nfs/dbraw/zinc/67/49/04/1103674904.db2.gz YQSKJDGGFQLJPH-CCKFTAQKSA-N 2 0 352.444 4.415 20 0 FIADRP C[C@@H]1[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@H]1c1ccccc1 ZINC000551817232 1103677747 /nfs/dbraw/zinc/67/77/47/1103677747.db2.gz OQXDBXUPQXKHRJ-NTUVXCKYSA-N 2 0 364.533 4.441 20 0 FIADRP CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551813500 1103696147 /nfs/dbraw/zinc/69/61/47/1103696147.db2.gz UUZIZPRDZIKQJF-SFHVURJKSA-N 2 0 368.521 4.409 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000519816570 1103881711 /nfs/dbraw/zinc/88/17/11/1103881711.db2.gz OSNZGBJQDLKMQI-TZIWHRDSSA-N 2 0 351.538 4.168 20 0 FIADRP FC(F)(F)c1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)[nH]n1 ZINC000440816001 1103963457 /nfs/dbraw/zinc/96/34/57/1103963457.db2.gz WXFHWYRYAZOKIH-UHFFFAOYSA-N 2 0 366.431 4.094 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OCc1ccncc1 ZINC000520204782 1104171042 /nfs/dbraw/zinc/17/10/42/1104171042.db2.gz HJJYIFROYASYFP-FQEVSTJZSA-N 2 0 367.537 4.405 20 0 FIADRP C[NH+](C)CCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC001648957072 1104460504 /nfs/dbraw/zinc/46/05/04/1104460504.db2.gz WTKCTXQTDPXDLF-YQQQUEKLSA-N 2 0 367.578 4.019 20 0 FIADRP C(OC1CC2(C1)CC[NH+](C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CC2)C1CC1 ZINC001167993756 1104462290 /nfs/dbraw/zinc/46/22/90/1104462290.db2.gz RFZADYIPHYOBRX-WCRBZPEASA-N 2 0 358.570 4.063 20 0 FIADRP CC[NH2+]Cc1cccc(NC(=O)c2ccc(C[N@H+](CC)C(C)C)cc2)c1 ZINC000123405527 1104471857 /nfs/dbraw/zinc/47/18/57/1104471857.db2.gz QRNYEPZPZSZQEL-UHFFFAOYSA-N 2 0 353.510 4.279 20 0 FIADRP Fc1ccc(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995127 1104486488 /nfs/dbraw/zinc/48/64/88/1104486488.db2.gz XDHKHRWCWVAYTK-AIZNXBIQSA-N 2 0 356.529 4.486 20 0 FIADRP c1ccc(CO[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167994249 1104491721 /nfs/dbraw/zinc/49/17/21/1104491721.db2.gz AGJCTDIGVFLTJB-HNTVYWHESA-N 2 0 354.538 4.073 20 0 FIADRP Cc1ccc(O[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995841 1104568435 /nfs/dbraw/zinc/56/84/35/1104568435.db2.gz RTHQXSZUVDRKLF-MXHMCPQYSA-N 2 0 354.538 4.244 20 0 FIADRP COc1cccc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001168001390 1104927201 /nfs/dbraw/zinc/92/72/01/1104927201.db2.gz BHVKLGXXOBDPPE-CBQGHPETSA-N 2 0 354.538 4.280 20 0 FIADRP CN(C)c1ccccc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000441516025 1104965718 /nfs/dbraw/zinc/96/57/18/1104965718.db2.gz XLCZHWCZVHSWJF-UHFFFAOYSA-N 2 0 351.538 4.097 20 0 FIADRP Fc1ccc(S[C@H]2CC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001168004174 1105023821 /nfs/dbraw/zinc/02/38/21/1105023821.db2.gz RLQRPERUWALOGF-VHRCFOOQSA-N 2 0 360.542 4.398 20 0 FIADRP COc1ccc(C[C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001168004224 1105028335 /nfs/dbraw/zinc/02/83/35/1105028335.db2.gz RRGSYKYVSLLVTF-SSWODZADSA-N 2 0 368.565 4.355 20 0 FIADRP C[N@H+](CCSc1ccc(F)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000441614499 1105030881 /nfs/dbraw/zinc/03/08/81/1105030881.db2.gz PWLNABHBXQSASE-LJQANCHMSA-N 2 0 358.526 4.372 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(CNCc2nc3c(s2)C[C@@H](C)CC3)c1 ZINC000152378762 1105059685 /nfs/dbraw/zinc/05/96/85/1105059685.db2.gz VAUUBJJVCUWLNK-INIZCTEOSA-N 2 0 357.567 4.398 20 0 FIADRP COc1ccc(OC)c(CNC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168005045 1105063519 /nfs/dbraw/zinc/06/35/19/1105063519.db2.gz FEVKKSJKBWYGBI-QZTJIDSGSA-N 2 0 368.521 4.235 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000152403706 1105086979 /nfs/dbraw/zinc/08/69/79/1105086979.db2.gz ASSJRXROJLXILO-XXBNENTESA-N 2 0 350.506 4.053 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000152403605 1105087047 /nfs/dbraw/zinc/08/70/47/1105087047.db2.gz ASSJRXROJLXILO-WMZHIEFXSA-N 2 0 350.506 4.053 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152415469 1105105332 /nfs/dbraw/zinc/10/53/32/1105105332.db2.gz UUNSJICMJIERPT-LRDDRELGSA-N 2 0 355.309 4.281 20 0 FIADRP CCC[N@@H+]1CC[C@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000665193196 1105196904 /nfs/dbraw/zinc/19/69/04/1105196904.db2.gz QDELRDZDTJPSNZ-IBGZPJMESA-N 2 0 372.557 4.057 20 0 FIADRP COc1ccccc1OCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168009071 1105207455 /nfs/dbraw/zinc/20/74/55/1105207455.db2.gz GOSXZIYDQGZSJC-OALUTQOASA-N 2 0 368.521 4.105 20 0 FIADRP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(C)C ZINC000427699415 1105251032 /nfs/dbraw/zinc/25/10/32/1105251032.db2.gz XIUDQQZZXOJRMO-IAGOWNOFSA-N 2 0 357.464 4.434 20 0 FIADRP Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CC2 ZINC000655710695 1106744437 /nfs/dbraw/zinc/74/44/37/1106744437.db2.gz CPESPFYPNYMDLM-HSZRJFAPSA-N 2 0 364.533 4.037 20 0 FIADRP c1cn2c(n1)[C@@H]([NH2+]CCCC[NH+]1CCC(Cc3ccccc3)CC1)CCC2 ZINC000655711430 1106823644 /nfs/dbraw/zinc/82/36/44/1106823644.db2.gz JDCUQDPRZFMZAW-QFIPXVFZSA-N 2 0 366.553 4.043 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@H]([NH+]3CC=CC3)C2)c1C ZINC000301467722 1107039488 /nfs/dbraw/zinc/03/94/88/1107039488.db2.gz QWWDEIMHRLLRBA-INIZCTEOSA-N 2 0 372.310 4.065 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC1CC([NH+]2CCCCC2)C1 ZINC000475568670 1107763293 /nfs/dbraw/zinc/76/32/93/1107763293.db2.gz OOFSKVAJIUTYEW-UHFFFAOYSA-N 2 0 372.944 4.249 20 0 FIADRP CC[N@H+](CCNC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)C1CC1 ZINC000102068467 1107940236 /nfs/dbraw/zinc/94/02/36/1107940236.db2.gz AFRAOTIIQQRLNI-UHFFFAOYSA-N 2 0 372.557 4.057 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccs2)cc1 ZINC000444667169 1108070709 /nfs/dbraw/zinc/07/07/09/1108070709.db2.gz SDTXGGDYACXNQV-AQNXPRMDSA-N 2 0 356.535 4.099 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccc(-c3cccs3)cc2)CCN1C1CC[NH+](C)CC1 ZINC000444680502 1108083995 /nfs/dbraw/zinc/08/39/95/1108083995.db2.gz FVYRNIVYDUWCQI-SFHVURJKSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ncc(-c2ccccc2)n1C ZINC000453054943 1108131748 /nfs/dbraw/zinc/13/17/48/1108131748.db2.gz CYFVFIVZJYFFJE-MOPGFXCFSA-N 2 0 354.542 4.250 20 0 FIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccsc1 ZINC000453102382 1108170691 /nfs/dbraw/zinc/17/06/91/1108170691.db2.gz PLDHVGYOULKSPE-BEFAXECRSA-N 2 0 361.530 4.441 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cs1 ZINC000453112907 1108181262 /nfs/dbraw/zinc/18/12/62/1108181262.db2.gz UASKXSPRAPCOIM-CVEARBPZSA-N 2 0 361.530 4.359 20 0 FIADRP CC[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccncc1 ZINC000453122019 1108190360 /nfs/dbraw/zinc/19/03/60/1108190360.db2.gz DWWVKFZDUXNPTM-QHCPKHFHSA-N 2 0 367.537 4.194 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CCO1 ZINC000453138504 1108213183 /nfs/dbraw/zinc/21/31/83/1108213183.db2.gz AFVIVGRUHJIDJM-JLMDMGSGSA-N 2 0 356.554 4.223 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000453213538 1108284569 /nfs/dbraw/zinc/28/45/69/1108284569.db2.gz APFMPANFOGJRHN-DHIUTWEWSA-N 2 0 370.581 4.474 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H](NC3CC([NH+]4CCCCC4)C3)[C@H]3CCC[C@H]32)cc1 ZINC000453220879 1108292174 /nfs/dbraw/zinc/29/21/74/1108292174.db2.gz PKMMWUFFTDZDES-LBAGWKCMSA-N 2 0 367.581 4.036 20 0 FIADRP C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncn1 ZINC000453231307 1108303114 /nfs/dbraw/zinc/30/31/14/1108303114.db2.gz XTVHCCYALQEPPH-FQCOAQKJSA-N 2 0 370.928 4.395 20 0 FIADRP CC[C@@H](COCC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453265155 1108338085 /nfs/dbraw/zinc/33/80/85/1108338085.db2.gz XHKSGOWZOVSTHT-OKYOBFRVSA-N 2 0 370.459 4.129 20 0 FIADRP CO[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000453289294 1108364578 /nfs/dbraw/zinc/36/45/78/1108364578.db2.gz LXRNINSGGLVCAE-XQUALCHDSA-N 2 0 364.533 4.029 20 0 FIADRP CO[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1ccccc1 ZINC000453289291 1108365106 /nfs/dbraw/zinc/36/51/06/1108365106.db2.gz LXRNINSGGLVCAE-UEQSERJNSA-N 2 0 364.533 4.029 20 0 FIADRP C[N@H+](Cc1ccccc1)C1(CN[C@H]2CC[NH+]3CCC[C@@H]3C2)CCCCC1 ZINC000714226699 1108400993 /nfs/dbraw/zinc/40/09/93/1108400993.db2.gz OAWUAYHBLAJUKD-FCHUYYIVSA-N 2 0 355.570 4.038 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531957888 1108446995 /nfs/dbraw/zinc/44/69/95/1108446995.db2.gz JMSKWYJDCNFTFG-XMSQKQJNSA-N 2 0 369.578 4.048 20 0 FIADRP COc1ccc([C@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)cc1C[NH+]1CCCCC1 ZINC000453365427 1108480773 /nfs/dbraw/zinc/48/07/73/1108480773.db2.gz LYRGSEZIVOUPIU-WMZHIEFXSA-N 2 0 372.553 4.245 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+]C3CC[NH+](C(C)C)CC3)CCCC2)cc1C ZINC000531994469 1108524288 /nfs/dbraw/zinc/52/42/88/1108524288.db2.gz HAZQEOGHYLDNQI-UHFFFAOYSA-N 2 0 371.569 4.265 20 0 FIADRP C[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC000532105357 1108662039 /nfs/dbraw/zinc/66/20/39/1108662039.db2.gz UYPSJOZFYWXFOA-GOSISDBHSA-N 2 0 369.528 4.249 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532225248 1108723453 /nfs/dbraw/zinc/72/34/53/1108723453.db2.gz FNIJCKKMCYYFQK-PKOBYXMFSA-N 2 0 356.485 4.397 20 0 FIADRP Cc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000524842189 1109176712 /nfs/dbraw/zinc/17/67/12/1109176712.db2.gz YDJRTFWBEWWFJP-HNNXBMFYSA-N 2 0 361.436 4.209 20 0 FIADRP C[N@H+](CCCCOc1cccc(C(F)(F)F)c1)C[C@H]1CCC[NH+](C)C1 ZINC000525002627 1109227758 /nfs/dbraw/zinc/22/77/58/1109227758.db2.gz YXQUVEMAPJXHMI-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@@H](C)c3ccc4ccccc4c3)C2)CC1 ZINC000525267305 1109325231 /nfs/dbraw/zinc/32/52/31/1109325231.db2.gz NGQUMVROUFAXFK-WMZHIEFXSA-N 2 0 351.538 4.001 20 0 FIADRP Clc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(Br)c1 ZINC000446888177 1109383510 /nfs/dbraw/zinc/38/35/10/1109383510.db2.gz DUBVZNZOADCOHJ-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000428463717 1109407245 /nfs/dbraw/zinc/40/72/45/1109407245.db2.gz PTQNLNLZXMGBPV-JKLQHZFJSA-N 2 0 358.570 4.064 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000525708990 1109488220 /nfs/dbraw/zinc/48/82/20/1109488220.db2.gz APKHJHHBYBCRQT-VQIMIIECSA-N 2 0 364.493 4.013 20 0 FIADRP CCC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccsc1 ZINC000525954721 1109562681 /nfs/dbraw/zinc/56/26/81/1109562681.db2.gz YIWTUCVIMYCVIN-NHCUHLMSSA-N 2 0 357.567 4.168 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)c(F)c1 ZINC000447570925 1109576967 /nfs/dbraw/zinc/57/69/67/1109576967.db2.gz WHNXRLJPWKIXFU-LBPRGKRZSA-N 2 0 355.295 4.113 20 0 FIADRP COC(=O)c1coc([C@H](C)NCc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000447563632 1109582958 /nfs/dbraw/zinc/58/29/58/1109582958.db2.gz RGFZIARSSUODCI-KRWDZBQOSA-N 2 0 370.493 4.149 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447567800 1109584785 /nfs/dbraw/zinc/58/47/85/1109584785.db2.gz FIDCAUHTNVIRGV-QHCPKHFHSA-N 2 0 350.506 4.249 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC[C@H]2CCCOC2)cc1C[NH+]1CCCCC1 ZINC000527933524 1109870435 /nfs/dbraw/zinc/87/04/35/1109870435.db2.gz VMAZYFUVVTWXTR-RBUKOAKNSA-N 2 0 360.542 4.148 20 0 FIADRP CN1C(=O)c2ccccc2[C@@H]1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000527999382 1109881093 /nfs/dbraw/zinc/88/10/93/1109881093.db2.gz DHKQNNVBBKMIAC-FQEVSTJZSA-N 2 0 371.569 4.082 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000449079168 1109974594 /nfs/dbraw/zinc/97/45/94/1109974594.db2.gz XLMTXQQFXCJFJX-XMMPIXPASA-N 2 0 365.565 4.024 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000449128849 1109981985 /nfs/dbraw/zinc/98/19/85/1109981985.db2.gz YOGWTXDQWPQOAE-UHFFFAOYSA-N 2 0 374.569 4.377 20 0 FIADRP CC(C)c1nc(CC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)cs1 ZINC000449113623 1109983815 /nfs/dbraw/zinc/98/38/15/1109983815.db2.gz WPPKUTSKYIXURQ-GOSISDBHSA-N 2 0 371.594 4.494 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000449143863 1109984751 /nfs/dbraw/zinc/98/47/51/1109984751.db2.gz XXCJBXMDBNSNOS-UEXGIBASSA-N 2 0 358.526 4.090 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)[C@@H](C)O1 ZINC000449153945 1109986454 /nfs/dbraw/zinc/98/64/54/1109986454.db2.gz GNMOJBLVZCLFOX-WQJJYIMCSA-N 2 0 370.459 4.244 20 0 FIADRP CCCCn1cc(CNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)c(C)n1 ZINC000449210623 1109996567 /nfs/dbraw/zinc/99/65/67/1109996567.db2.gz WOCQLSXKZWQNOB-LJQANCHMSA-N 2 0 368.569 4.177 20 0 FIADRP Cn1nc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c2ccccc21 ZINC000449247354 1110011224 /nfs/dbraw/zinc/01/12/24/1110011224.db2.gz FOYSXEVFCSNQRY-UHFFFAOYSA-N 2 0 370.585 4.385 20 0 FIADRP Fc1ccc2c(c1Br)CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000449284987 1110016384 /nfs/dbraw/zinc/01/63/84/1110016384.db2.gz CPJMLPFKMFSJAW-QGZVFWFLSA-N 2 0 367.306 4.040 20 0 FIADRP C[C@@H](C[N@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cc(F)cc(F)c1 ZINC000449265215 1110018853 /nfs/dbraw/zinc/01/88/53/1110018853.db2.gz RBHLVBWUPQITKK-WJPUGNRLSA-N 2 0 359.464 4.088 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000449295307 1110019610 /nfs/dbraw/zinc/01/96/10/1110019610.db2.gz RHMMWQMZZSAMTP-IBGZPJMESA-N 2 0 359.517 4.420 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2ccc3n[nH]cc3c2)CC1 ZINC000449316964 1110031284 /nfs/dbraw/zinc/03/12/84/1110031284.db2.gz APKUFBXLNGLNQG-ROUUACIJSA-N 2 0 362.521 4.309 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000449343237 1110034526 /nfs/dbraw/zinc/03/45/26/1110034526.db2.gz IXGLJMWFHLZNFB-GOTSBHOMSA-N 2 0 370.581 4.474 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449339259 1110042226 /nfs/dbraw/zinc/04/22/26/1110042226.db2.gz TXKHHGDXQVKMNU-FQEVSTJZSA-N 2 0 365.565 4.353 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000449675291 1110143733 /nfs/dbraw/zinc/14/37/33/1110143733.db2.gz ZFZRFBOOAHFJBC-UHFFFAOYSA-N 2 0 372.394 4.194 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@](C)(Cc3ccccc3)C3CC3)sc2C1 ZINC000449776891 1110167600 /nfs/dbraw/zinc/16/76/00/1110167600.db2.gz PCAYXEMTUBGFFY-JOCHJYFZSA-N 2 0 369.578 4.411 20 0 FIADRP COc1cc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)ccc1Cl ZINC000450645361 1110322523 /nfs/dbraw/zinc/32/25/23/1110322523.db2.gz TXSLINDCQMFXFR-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000538548273 1111188184 /nfs/dbraw/zinc/18/81/84/1111188184.db2.gz GTOBHBDRZFKYKC-SFHVURJKSA-N 2 0 355.526 4.170 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000538751688 1111281711 /nfs/dbraw/zinc/28/17/11/1111281711.db2.gz HSBAGYIQTYYHKQ-UHFFFAOYSA-N 2 0 360.933 4.284 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)Nc2ccccc2C)CC1)CC1CC1 ZINC000538948904 1111356235 /nfs/dbraw/zinc/35/62/35/1111356235.db2.gz LHVDRMVFMGLSQU-UHFFFAOYSA-N 2 0 371.569 4.158 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000461794489 1111359088 /nfs/dbraw/zinc/35/90/88/1111359088.db2.gz GXSCATROTUREIH-QYZOEREBSA-N 2 0 365.359 4.377 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539057033 1111404007 /nfs/dbraw/zinc/40/40/07/1111404007.db2.gz KXLUIIKCAMJVKA-TZYHBYERSA-N 2 0 358.570 4.304 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000539075833 1111420730 /nfs/dbraw/zinc/42/07/30/1111420730.db2.gz MPEIJHVRAPDZOP-AUSIDOKSSA-N 2 0 354.538 4.109 20 0 FIADRP C[C@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082573 1111424697 /nfs/dbraw/zinc/42/46/97/1111424697.db2.gz INXYWRMXWPGZFR-KRWDZBQOSA-N 2 0 352.478 4.267 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccnc1 ZINC000539199810 1111468768 /nfs/dbraw/zinc/46/87/68/1111468768.db2.gz LUHYCAROHYTFAJ-QFIPXVFZSA-N 2 0 353.510 4.043 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccnc1 ZINC000539199809 1111468784 /nfs/dbraw/zinc/46/87/84/1111468784.db2.gz LUHYCAROHYTFAJ-JOCHJYFZSA-N 2 0 353.510 4.043 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](c3ccc(F)cc3)C3CC3)CC2)oc1C ZINC000539201618 1111470103 /nfs/dbraw/zinc/47/01/03/1111470103.db2.gz ICMYEXGLTGIBFO-JOCHJYFZSA-N 2 0 371.500 4.383 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@@H]1CCc3ccccc31)c1ccccc1O2 ZINC000539396679 1111552812 /nfs/dbraw/zinc/55/28/12/1111552812.db2.gz MLBCNNOPGHAKSZ-SIKLNZKXSA-N 2 0 362.517 4.294 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@]2(C)CCO[C@H]2C2CC2)CC1 ZINC000552067384 1111565114 /nfs/dbraw/zinc/56/51/14/1111565114.db2.gz IGUTUHUGTUSKFG-BBITVKMKSA-N 2 0 356.554 4.224 20 0 FIADRP COCCC[C@@H](C[NH2+]C1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000552091716 1111571448 /nfs/dbraw/zinc/57/14/48/1111571448.db2.gz WIEAQGMWDWCQCY-SFHVURJKSA-N 2 0 352.950 4.313 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000552338231 1111678877 /nfs/dbraw/zinc/67/88/77/1111678877.db2.gz BSSSJJRBSPYJSX-FGTMMUONSA-N 2 0 352.444 4.219 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535838 1111771436 /nfs/dbraw/zinc/77/14/36/1111771436.db2.gz JVUJZBNDGNVRNP-IAGOWNOFSA-N 2 0 374.326 4.040 20 0 FIADRP COc1cc(CNC2CC[NH+](C3CCCCC3)CC2)ccc1OC(F)F ZINC000553538392 1111997138 /nfs/dbraw/zinc/99/71/38/1111997138.db2.gz XAUYXAAOPUGDDO-UHFFFAOYSA-N 2 0 368.468 4.183 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)CC1 ZINC000479338739 1111999203 /nfs/dbraw/zinc/99/92/03/1111999203.db2.gz UIRIBRYFFYCRFD-QFIPXVFZSA-N 2 0 366.553 4.351 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000479381489 1112005129 /nfs/dbraw/zinc/00/51/29/1112005129.db2.gz BAUIEMNXWLCHKV-OAQYLSRUSA-N 2 0 355.526 4.213 20 0 FIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1F ZINC000479550383 1112065949 /nfs/dbraw/zinc/06/59/49/1112065949.db2.gz CGSUOECHLFZJNV-SDVBZNEUSA-N 2 0 360.517 4.467 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCO[C@H](C(F)(F)F)C3)c2)CC1 ZINC000554072892 1112183120 /nfs/dbraw/zinc/18/31/20/1112183120.db2.gz UWSWXKUVPZIUBN-MOPGFXCFSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H](CO)c3ccccc3Cl)CC2)C1 ZINC000554087892 1112198224 /nfs/dbraw/zinc/19/82/24/1112198224.db2.gz DSQFTVXWMQUISE-LMMKCTJWSA-N 2 0 364.961 4.049 20 0 FIADRP COC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccc1 ZINC000554362550 1112318053 /nfs/dbraw/zinc/31/80/53/1112318053.db2.gz UUMQPMBPGVZBHQ-HSZRJFAPSA-N 2 0 352.522 4.396 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CCCC2)[C@@H](C)C1 ZINC000480190271 1112327598 /nfs/dbraw/zinc/32/75/98/1112327598.db2.gz AIROJJASDNFEBX-UNMCSNQZSA-N 2 0 358.570 4.225 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000480207739 1112332878 /nfs/dbraw/zinc/33/28/78/1112332878.db2.gz GHWKXFBXVBARLI-MRXNPFEDSA-N 2 0 359.901 4.060 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC000480426794 1112423059 /nfs/dbraw/zinc/42/30/59/1112423059.db2.gz ODDZCGDEJCMWEX-QHCPKHFHSA-N 2 0 350.506 4.458 20 0 FIADRP Cc1nc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)oc1-c1ccc(Cl)cc1 ZINC000567392436 1112424466 /nfs/dbraw/zinc/42/44/66/1112424466.db2.gz QNVMSCBWHNUADA-QGZVFWFLSA-N 2 0 359.901 4.125 20 0 FIADRP CC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000480539044 1112467569 /nfs/dbraw/zinc/46/75/69/1112467569.db2.gz UNDKFTWNSMICTP-GOSISDBHSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000480608504 1112499121 /nfs/dbraw/zinc/49/91/21/1112499121.db2.gz LFWQYAJSWPRNDU-QRVBRYPASA-N 2 0 374.573 4.235 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c(C)n1 ZINC000480630941 1112510247 /nfs/dbraw/zinc/51/02/47/1112510247.db2.gz LWEGIYYMBXELAB-IAGOWNOFSA-N 2 0 352.526 4.319 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cnn1-c1ccc(F)cc1 ZINC000480617611 1112510568 /nfs/dbraw/zinc/51/05/68/1112510568.db2.gz SDBCUWVJABCGGC-SFHVURJKSA-N 2 0 372.532 4.483 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc2c(c1)OCO2 ZINC000480635488 1112523375 /nfs/dbraw/zinc/52/33/75/1112523375.db2.gz AIJMLZTYJKSCJK-ZWKOTPCHSA-N 2 0 366.505 4.498 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000554858679 1112533425 /nfs/dbraw/zinc/53/34/25/1112533425.db2.gz UDBLIZNJJBUCAE-DNQXCXABSA-N 2 0 363.549 4.309 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(Cl)cc1 ZINC000480721491 1112562832 /nfs/dbraw/zinc/56/28/32/1112562832.db2.gz MVMHLHILNUPIIZ-FQEVSTJZSA-N 2 0 372.944 4.118 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000480714985 1112566819 /nfs/dbraw/zinc/56/68/19/1112566819.db2.gz RMEUQMSSNWDTGN-JOCHJYFZSA-N 2 0 356.485 4.323 20 0 FIADRP Fc1cccc(C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000480742153 1112580798 /nfs/dbraw/zinc/58/07/98/1112580798.db2.gz BLDKFABCCZHPOP-VGSWGCGISA-N 2 0 356.460 4.323 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480769624 1112587702 /nfs/dbraw/zinc/58/77/02/1112587702.db2.gz IUXATHAITYZXSU-FQEVSTJZSA-N 2 0 367.537 4.157 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000554993508 1112605113 /nfs/dbraw/zinc/60/51/13/1112605113.db2.gz BZVQMSKNBJWLDF-CTNGQTDRSA-N 2 0 351.538 4.310 20 0 FIADRP Cc1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)cc(F)c1F ZINC001143605386 1112613226 /nfs/dbraw/zinc/61/32/26/1112613226.db2.gz MVLCKTHSOPBQMH-UHFFFAOYSA-N 2 0 360.448 4.354 20 0 FIADRP CC(C)N1CC[NH+](C2CCN([C@H](C)c3cccc(Cl)c3F)CC2)CC1 ZINC000480872856 1112643511 /nfs/dbraw/zinc/64/35/11/1112643511.db2.gz UWPBONTZGMHYCO-MRXNPFEDSA-N 2 0 367.940 4.031 20 0 FIADRP CSC1(C[NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)CC[NH+](C)CC1 ZINC000555104152 1112670199 /nfs/dbraw/zinc/67/01/99/1112670199.db2.gz FCPOZUCJZZYWQH-AWEZNQCLSA-N 2 0 360.489 4.226 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Cl)cc1 ZINC000480923476 1112676152 /nfs/dbraw/zinc/67/61/52/1112676152.db2.gz ZXSZTMVPPVSPGM-QFIPXVFZSA-N 2 0 371.956 4.328 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cccc(Br)c21 ZINC000481308819 1112883678 /nfs/dbraw/zinc/88/36/78/1112883678.db2.gz GNNWPALDWSHHQY-SCLBCKFNSA-N 2 0 363.343 4.461 20 0 FIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000481651074 1113011861 /nfs/dbraw/zinc/01/18/61/1113011861.db2.gz CUUKVQZVYMEAGN-BRWVUGGUSA-N 2 0 372.475 4.115 20 0 FIADRP CC1(C)CC[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c2ccccc21 ZINC000481659990 1113016162 /nfs/dbraw/zinc/01/61/62/1113016162.db2.gz QWBOAQLKUFWIJT-FDFHNCONSA-N 2 0 356.554 4.157 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000481816797 1113087273 /nfs/dbraw/zinc/08/72/73/1113087273.db2.gz QWVFXAQQDGNUES-FUHWJXTLSA-N 2 0 350.441 4.141 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cs1 ZINC000481907039 1113134472 /nfs/dbraw/zinc/13/44/72/1113134472.db2.gz GTWJTLLOCXRRPQ-YLJYHZDGSA-N 2 0 357.567 4.309 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCC[NH+](C)C)CCC3)cc1 ZINC000481975483 1113144118 /nfs/dbraw/zinc/14/41/18/1113144118.db2.gz SITFWAZKSIKOJW-QGZVFWFLSA-N 2 0 359.539 4.128 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)CC1 ZINC000482130057 1113184195 /nfs/dbraw/zinc/18/41/95/1113184195.db2.gz TUYIHDLOPFHWDG-GOSISDBHSA-N 2 0 368.521 4.018 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000482344093 1113230463 /nfs/dbraw/zinc/23/04/63/1113230463.db2.gz NGWBGLCYKRHBIK-SUMWQHHRSA-N 2 0 351.332 4.319 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000162932918 1113258761 /nfs/dbraw/zinc/25/87/61/1113258761.db2.gz WPMUKYQZGPJBJQ-FQEVSTJZSA-N 2 0 374.532 4.378 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000482490116 1113272836 /nfs/dbraw/zinc/27/28/36/1113272836.db2.gz WVUXXEATCIEWMO-RTWAWAEBSA-N 2 0 365.565 4.278 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)CC1 ZINC000482506387 1113280003 /nfs/dbraw/zinc/28/00/03/1113280003.db2.gz HWEVNSVJGSUHGY-INIZCTEOSA-N 2 0 358.505 4.092 20 0 FIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000482871471 1113385434 /nfs/dbraw/zinc/38/54/34/1113385434.db2.gz XFOGPSVBWJMVRE-HSZRJFAPSA-N 2 0 368.569 4.196 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)cc1Cl ZINC000482876197 1113385956 /nfs/dbraw/zinc/38/59/56/1113385956.db2.gz UHZMHUDZEICRLT-CRAIPNDOSA-N 2 0 359.341 4.271 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(Sc3ccccc3)CC2)[C@@H](C)C1 ZINC000482881619 1113391467 /nfs/dbraw/zinc/39/14/67/1113391467.db2.gz DOMKANKAZLDCPM-ICSRJNTNSA-N 2 0 362.583 4.038 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000486080698 1113500477 /nfs/dbraw/zinc/50/04/77/1113500477.db2.gz LEVPPLUHSVUNRA-NEWSRXKRSA-N 2 0 372.475 4.059 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(-c2cnn(C)c2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486489870 1113577574 /nfs/dbraw/zinc/57/75/74/1113577574.db2.gz PFPCJMJRTUMCPP-WMZHIEFXSA-N 2 0 374.532 4.087 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486535281 1113591564 /nfs/dbraw/zinc/59/15/64/1113591564.db2.gz JBOBSMPTCQVGHJ-FXAWDEMLSA-N 2 0 374.475 4.331 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc(Cl)cs3)CC2)cc1 ZINC000486985418 1113690797 /nfs/dbraw/zinc/69/07/97/1113690797.db2.gz HROKBFIMVBUVRN-UHFFFAOYSA-N 2 0 364.942 4.412 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000488407353 1113921183 /nfs/dbraw/zinc/92/11/83/1113921183.db2.gz PQUWZXSFNFHXIR-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491005407 1114359053 /nfs/dbraw/zinc/35/90/53/1114359053.db2.gz KSABTPAKMTYMLL-FQEVSTJZSA-N 2 0 373.338 4.470 20 0 FIADRP Cc1cc(C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)n(C)n1 ZINC000571780324 1114537467 /nfs/dbraw/zinc/53/74/67/1114537467.db2.gz VDHOKKGXUQVHEK-JOCHJYFZSA-N 2 0 372.532 4.211 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[NH+]2CCCC2)o1 ZINC000588280729 1114569021 /nfs/dbraw/zinc/56/90/21/1114569021.db2.gz BABGHOSJXDCDHN-UHFFFAOYSA-N 2 0 364.493 4.016 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000588708661 1114601322 /nfs/dbraw/zinc/60/13/22/1114601322.db2.gz BLTINWDAFLDWIS-IYBDPMFKSA-N 2 0 370.459 4.027 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2nn(C)c3ccccc23)cc1 ZINC000589640740 1114818869 /nfs/dbraw/zinc/81/88/69/1114818869.db2.gz OZHFLCCETZOEHE-SFHVURJKSA-N 2 0 362.521 4.238 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2cc(Br)ccc2F)CC1 ZINC000589837009 1114847280 /nfs/dbraw/zinc/84/72/80/1114847280.db2.gz VOIUBEYCDDBMQT-UHFFFAOYSA-N 2 0 357.311 4.190 20 0 FIADRP C[C@H](c1cccc(Br)c1)[N@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168394758 1114849642 /nfs/dbraw/zinc/84/96/42/1114849642.db2.gz GEPNVTCWMNQUHU-CQSZACIVSA-N 2 0 351.332 4.316 20 0 FIADRP CC(C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590787206 1114974296 /nfs/dbraw/zinc/97/42/96/1114974296.db2.gz UUDUHDBKHIWQKK-SFHVURJKSA-N 2 0 359.558 4.189 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2ccccc2C(F)(F)F)CC1 ZINC000590786352 1114974494 /nfs/dbraw/zinc/97/44/94/1114974494.db2.gz SZBQGXVGQVLDAW-UHFFFAOYSA-N 2 0 358.448 4.136 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168401471 1115175153 /nfs/dbraw/zinc/17/51/53/1115175153.db2.gz WXAHNBUWDKXYGI-XXBNENTESA-N 2 0 352.497 4.185 20 0 FIADRP COc1ccc([C@H](CC(C)C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000592390457 1115225533 /nfs/dbraw/zinc/22/55/33/1115225533.db2.gz UQRVIWLNTXZCJS-IBGZPJMESA-N 2 0 350.572 4.199 20 0 FIADRP CC(C)(C)OC(=O)[C@H]1C[C@@H](NC2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000593691162 1115342123 /nfs/dbraw/zinc/34/21/23/1115342123.db2.gz ORMWKFRAPRRQOF-VQTJNVASSA-N 2 0 372.553 4.409 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cnn(-c3cc(C)ccc3C)c2C)CC1 ZINC000574909948 1115513842 /nfs/dbraw/zinc/51/38/42/1115513842.db2.gz SGGCFLHUXNOSAQ-GOSISDBHSA-N 2 0 354.542 4.180 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H](CCC[NH3+])c2ccccc2)cc1)C(C)C ZINC000575045092 1115531180 /nfs/dbraw/zinc/53/11/80/1115531180.db2.gz PIIFHUPQAKEIDG-QFIPXVFZSA-N 2 0 367.537 4.127 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)CC3 ZINC000658353093 1115580343 /nfs/dbraw/zinc/58/03/43/1115580343.db2.gz BSFLWYRVNOQQPF-IBGZPJMESA-N 2 0 351.538 4.045 20 0 FIADRP Fc1cccc(CCC[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000598043452 1115704393 /nfs/dbraw/zinc/70/43/93/1115704393.db2.gz HDVZOZRMZDVTMN-UHFFFAOYSA-N 2 0 356.485 4.023 20 0 FIADRP CC[N@H+](CCC1CC[NH+](C[C@@H](O)c2ccc(Cl)cc2)CC1)CC(C)C ZINC001168412711 1115709497 /nfs/dbraw/zinc/70/94/97/1115709497.db2.gz BTWPJKZRQMHSQA-OAQYLSRUSA-N 2 0 366.977 4.453 20 0 FIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1F ZINC000669683863 1115782734 /nfs/dbraw/zinc/78/27/34/1115782734.db2.gz YTDFSULSLHMRBH-MJGOQNOKSA-N 2 0 356.485 4.225 20 0 FIADRP [NH3+]C1(Cc2ccccc2Cl)CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416404 1115854321 /nfs/dbraw/zinc/85/43/21/1115854321.db2.gz XTNUGXBSJNNDIY-HXUWFJFHSA-N 2 0 372.915 4.372 20 0 FIADRP CC(C)(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605323459 1115885719 /nfs/dbraw/zinc/88/57/19/1115885719.db2.gz XIEWRRWVYYSGAU-UNMCSNQZSA-N 2 0 374.569 4.092 20 0 FIADRP CC1([NH2+][C@H]2CCc3cc(F)ccc3C2)CCN(Cc2ccccc2)CC1 ZINC001168420450 1115907225 /nfs/dbraw/zinc/90/72/25/1115907225.db2.gz LDJIQZOQMDMYGC-QFIPXVFZSA-N 2 0 352.497 4.327 20 0 FIADRP CC1([NH2+][C@@H]2CCc3cc(F)ccc3C2)CCN(Cc2ccccc2)CC1 ZINC001168420449 1115907236 /nfs/dbraw/zinc/90/72/36/1115907236.db2.gz LDJIQZOQMDMYGC-JOCHJYFZSA-N 2 0 352.497 4.327 20 0 FIADRP c1ccc(C[C@@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C2CC2)cc1 ZINC000605827341 1115918134 /nfs/dbraw/zinc/91/81/34/1115918134.db2.gz LHPFENHHRXETLQ-XMMPIXPASA-N 2 0 364.533 4.272 20 0 FIADRP Cn1nc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c2ccccc21 ZINC000608058608 1116082415 /nfs/dbraw/zinc/08/24/15/1116082415.db2.gz MLNYHXPJASIXOX-UHFFFAOYSA-N 2 0 374.488 4.088 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000608058518 1116082440 /nfs/dbraw/zinc/08/24/40/1116082440.db2.gz BGHUXFPCDCGWPU-UHFFFAOYSA-N 2 0 360.461 4.078 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000534237181 1116174031 /nfs/dbraw/zinc/17/40/31/1116174031.db2.gz LLWWDGMOSIUZQT-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP CC1(C)CN(Cc2ccccc2)CC[C@H]1[NH2+]CC1=Cc2ccccc2OC1 ZINC000509448695 1116198382 /nfs/dbraw/zinc/19/83/82/1116198382.db2.gz NTGUPELACXAHOP-HSZRJFAPSA-N 2 0 362.517 4.353 20 0 FIADRP CCC[C@@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000535230314 1116283274 /nfs/dbraw/zinc/28/32/74/1116283274.db2.gz RAIXMFMWPZLXTL-LJQANCHMSA-N 2 0 372.384 4.452 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)[C@H](C)C1 ZINC000539819626 1116385099 /nfs/dbraw/zinc/38/50/99/1116385099.db2.gz NXXBEJFDHWZQLB-NQIIRXRSSA-N 2 0 353.510 4.344 20 0 FIADRP CC[N@@H+](Cc1ccc(OC)c(OC)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539861527 1116391819 /nfs/dbraw/zinc/39/18/19/1116391819.db2.gz CWHQXKCDFYQUHR-OAQYLSRUSA-N 2 0 368.521 4.048 20 0 FIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000462747962 1117750454 /nfs/dbraw/zinc/75/04/54/1117750454.db2.gz YTABBXQJDNXHSN-HXUWFJFHSA-N 2 0 357.586 4.141 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000462786876 1117771266 /nfs/dbraw/zinc/77/12/66/1117771266.db2.gz DKSLESZRRDVMMB-GOSISDBHSA-N 2 0 354.542 4.437 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000462788553 1117772804 /nfs/dbraw/zinc/77/28/04/1117772804.db2.gz OYBSJWCGVHJTPV-QGZVFWFLSA-N 2 0 356.485 4.356 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000462796886 1117779564 /nfs/dbraw/zinc/77/95/64/1117779564.db2.gz YLFHWOSAJINJAJ-WWPVKYPJSA-N 2 0 356.554 4.357 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000462802752 1117785685 /nfs/dbraw/zinc/78/56/85/1117785685.db2.gz ADSQYGJYRYGIMR-QXRTWZOPSA-N 2 0 351.332 4.015 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@](C)(O)C2CC2)c2ccc(F)cc2)CC1 ZINC000462815472 1117793423 /nfs/dbraw/zinc/79/34/23/1117793423.db2.gz HYZFZBXGEPJNHE-YADHBBJMSA-N 2 0 362.533 4.130 20 0 FIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2C)CC1)CC1CC1 ZINC000540046173 1117827760 /nfs/dbraw/zinc/82/77/60/1117827760.db2.gz DDOSMURMEBCMGU-LJQANCHMSA-N 2 0 371.569 4.156 20 0 FIADRP COc1ccc([C@H](OC)[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC000540146660 1117898098 /nfs/dbraw/zinc/89/80/98/1117898098.db2.gz KDFSLKKXKXWJIL-NNTZPNAXSA-N 2 0 374.569 4.404 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](c3ccccc3)[C@H]3CCOC3)CC2)C1 ZINC000540137167 1117901043 /nfs/dbraw/zinc/90/10/43/1117901043.db2.gz MJODXAQUWYHMDD-VLSUOOLDSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc2c(s1)CCCC2 ZINC000540158253 1117903365 /nfs/dbraw/zinc/90/33/65/1117903365.db2.gz TVMCKYYQLQICLK-SNRMKQJTSA-N 2 0 362.583 4.045 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000540187650 1117919605 /nfs/dbraw/zinc/91/96/05/1117919605.db2.gz ACOUACQUFFSGKS-IBGZPJMESA-N 2 0 357.567 4.310 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000463145409 1117982371 /nfs/dbraw/zinc/98/23/71/1117982371.db2.gz YGOMXRJBCSZDDK-GOSISDBHSA-N 2 0 363.977 4.159 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CCCC4CCOCC4)[C@H]3C2)cc1 ZINC000463238334 1118046122 /nfs/dbraw/zinc/04/61/22/1118046122.db2.gz UJWRSKTVNQJGSC-VABKMULXSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CCCC4CCOCC4)[C@H]3C2)cc1 ZINC000463238333 1118046197 /nfs/dbraw/zinc/04/61/97/1118046197.db2.gz UJWRSKTVNQJGSC-RJGXRXQPSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H](CC[NH2+]C1CCN(Cc2ccccc2Cl)CC1)[NH+]1CCCCC1 ZINC000463264425 1118059058 /nfs/dbraw/zinc/05/90/58/1118059058.db2.gz GDJABVTZEZQUDE-SFHVURJKSA-N 2 0 363.977 4.159 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O2 ZINC000540461859 1118067171 /nfs/dbraw/zinc/06/71/71/1118067171.db2.gz CEXUPFVOWLVBAZ-FQEVSTJZSA-N 2 0 372.459 4.085 20 0 FIADRP C[C@@H](CC[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)[NH+]1CCCCC1 ZINC000463274582 1118074435 /nfs/dbraw/zinc/07/44/35/1118074435.db2.gz RHZFWEYHZGWREP-SFHVURJKSA-N 2 0 363.977 4.159 20 0 FIADRP CCC1(CC)[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@H]1OC ZINC000540494191 1118091665 /nfs/dbraw/zinc/09/16/65/1118091665.db2.gz XJIGVLLMYXPFDA-CEWLAPEOSA-N 2 0 372.553 4.158 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccccc1O2 ZINC000540494470 1118092192 /nfs/dbraw/zinc/09/21/92/1118092192.db2.gz BJBOVKLIJHTSSG-LJQANCHMSA-N 2 0 372.459 4.085 20 0 FIADRP CSC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000540986440 1118338453 /nfs/dbraw/zinc/33/84/53/1118338453.db2.gz GYXKRXWRNZDTBW-KRWDZBQOSA-N 2 0 360.489 4.431 20 0 FIADRP CCC(CC)(CC)C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000541234886 1118436317 /nfs/dbraw/zinc/43/63/17/1118436317.db2.gz RUHGPPZSZZERQX-UHFFFAOYSA-N 2 0 351.623 4.331 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000541379106 1118494385 /nfs/dbraw/zinc/49/43/85/1118494385.db2.gz XINZIEKZMYUYNN-LJQANCHMSA-N 2 0 368.868 4.233 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000541384178 1118496379 /nfs/dbraw/zinc/49/63/79/1118496379.db2.gz PIBNINGYTSYDPS-SFHVURJKSA-N 2 0 371.488 4.013 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)C1 ZINC000541546618 1118550911 /nfs/dbraw/zinc/55/09/11/1118550911.db2.gz FZFGZLBISVOCJG-PGRDOPGGSA-N 2 0 355.501 4.412 20 0 FIADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCCOc2ccccc2C(F)(F)F)C1 ZINC000464787612 1118695328 /nfs/dbraw/zinc/69/53/28/1118695328.db2.gz CPDWSPWCHCSPLY-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc1 ZINC000173335242 1119033977 /nfs/dbraw/zinc/03/39/77/1119033977.db2.gz PCALBCSSHJNPGJ-GOSISDBHSA-N 2 0 369.578 4.007 20 0 FIADRP C[C@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173947121 1119082003 /nfs/dbraw/zinc/08/20/03/1119082003.db2.gz SEKXYGBBLKNUPG-OAHLLOKOSA-N 2 0 354.897 4.117 20 0 FIADRP C[C@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492404599 1119087888 /nfs/dbraw/zinc/08/78/88/1119087888.db2.gz ZNKKENJBTDWIKQ-RBBKRZOGSA-N 2 0 352.522 4.346 20 0 FIADRP COCC[C@@H]1CCCC[NH+]([C@H](C)CC[N@H+]2CCCC[C@@H](CCOC)C2)C1 ZINC000467274297 1119289265 /nfs/dbraw/zinc/28/92/65/1119289265.db2.gz FZFZRSSFVHHXBJ-FSSWDIPSSA-N 2 0 368.606 4.042 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000542464853 1119339676 /nfs/dbraw/zinc/33/96/76/1119339676.db2.gz LYGFYHVOCKXAJJ-YCRPNKLZSA-N 2 0 350.441 4.298 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178281198 1119382165 /nfs/dbraw/zinc/38/21/65/1119382165.db2.gz OGIYYMSMRBPDJO-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 ZINC000493934907 1119511526 /nfs/dbraw/zinc/51/15/26/1119511526.db2.gz GZIBMBSDYPZAJW-HLRQEUIKSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@H](C)C1 ZINC000542470607 1119511650 /nfs/dbraw/zinc/51/16/50/1119511650.db2.gz KTWJQSGJJOYIBD-DNVFCKCGSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CC[NH+](Cc2cccc(C[N@@H+]3CCS[C@H](C)CC3)c2)CCS1 ZINC000494151958 1119547744 /nfs/dbraw/zinc/54/77/44/1119547744.db2.gz GMHCBNWHACVXLB-QZTJIDSGSA-N 2 0 364.624 4.341 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCCO2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183199280 1119568443 /nfs/dbraw/zinc/56/84/43/1119568443.db2.gz PGCFDOKNDJNRLX-YQVWRLOYSA-N 2 0 358.526 4.152 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2cccs2)cc1 ZINC000186564867 1119736331 /nfs/dbraw/zinc/73/63/31/1119736331.db2.gz VDFJUUSZLOPUNV-QZTJIDSGSA-N 2 0 357.567 4.092 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000186574096 1119736893 /nfs/dbraw/zinc/73/68/93/1119736893.db2.gz STIFEHJBHNKHCK-PMACEKPBSA-N 2 0 367.537 4.156 20 0 FIADRP C[C@@H](O)[C@@](C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1 ZINC000188917587 1119806104 /nfs/dbraw/zinc/80/61/04/1119806104.db2.gz BKGZANILNHFYET-AUSIDOKSSA-N 2 0 358.570 4.003 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000153004500 1119821638 /nfs/dbraw/zinc/82/16/38/1119821638.db2.gz GMRCDNODSCMQDA-QFIPXVFZSA-N 2 0 368.521 4.193 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3nccn3-c3ccccc3)CC2)CC1 ZINC000191470805 1119978747 /nfs/dbraw/zinc/97/87/47/1119978747.db2.gz OIVCMQRHMQLZSQ-UHFFFAOYSA-N 2 0 352.526 4.005 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000191528534 1119982032 /nfs/dbraw/zinc/98/20/32/1119982032.db2.gz RPBTZCYQZMFSBT-HXUWFJFHSA-N 2 0 369.534 4.133 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC000191851776 1119998647 /nfs/dbraw/zinc/99/86/47/1119998647.db2.gz BIMMNVMREMGHJA-IYSOMAHNSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000192542757 1120066890 /nfs/dbraw/zinc/06/68/90/1120066890.db2.gz XYBQQVPHHVOUTH-JPYJTQIMSA-N 2 0 361.489 4.113 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccccc1Cl ZINC000192788086 1120083460 /nfs/dbraw/zinc/08/34/60/1120083460.db2.gz IWAUUDVFSRHCTL-HXUWFJFHSA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000192787724 1120083609 /nfs/dbraw/zinc/08/36/09/1120083609.db2.gz NDGCGIJJQSCITA-LJQANCHMSA-N 2 0 363.615 4.254 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cc(Cl)cs3)cc2)C[C@H](C)O1 ZINC000192994960 1120093823 /nfs/dbraw/zinc/09/38/23/1120093823.db2.gz FTMZYIMTJUXDLE-GJZGRUSLSA-N 2 0 364.942 4.301 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(Cc2ccccc2)c1 ZINC000195136410 1120120063 /nfs/dbraw/zinc/12/00/63/1120120063.db2.gz SVKGHSHVDXGSST-OFNKIYASSA-N 2 0 374.532 4.104 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000226343990 1120194835 /nfs/dbraw/zinc/19/48/35/1120194835.db2.gz ZFSAMIJMCUFTLZ-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000193989962 1120226223 /nfs/dbraw/zinc/22/62/23/1120226223.db2.gz ATPIIAJYWZUOLH-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1F ZINC000542500498 1120227642 /nfs/dbraw/zinc/22/76/42/1120227642.db2.gz ZGFSJQRGLHBWSF-DNVCBOLYSA-N 2 0 362.439 4.147 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCC(c2nc(C)no2)CC1 ZINC000494877351 1120353657 /nfs/dbraw/zinc/35/36/57/1120353657.db2.gz HHJRBAMPYPVXTE-UHFFFAOYSA-N 2 0 356.514 4.036 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(C(=O)N(C)C)cc2)c1 ZINC000494925215 1120381931 /nfs/dbraw/zinc/38/19/31/1120381931.db2.gz XBFSSUXTSOHFOS-GOSISDBHSA-N 2 0 367.537 4.081 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)C1CCCC1 ZINC000495080584 1120464426 /nfs/dbraw/zinc/46/44/26/1120464426.db2.gz RBSXKADDWUCJLT-RJGXRXQPSA-N 2 0 356.554 4.194 20 0 FIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000495261129 1120596490 /nfs/dbraw/zinc/59/64/90/1120596490.db2.gz UTUTXEBEDHZOEY-DYESRHJHSA-N 2 0 355.913 4.093 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495380981 1120768164 /nfs/dbraw/zinc/76/81/64/1120768164.db2.gz TXVRJVQADCGNPC-JUXOCIIHSA-N 2 0 350.506 4.183 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000495547031 1120881868 /nfs/dbraw/zinc/88/18/68/1120881868.db2.gz KTJZRJXPKCGOMJ-IECBHUPTSA-N 2 0 364.533 4.463 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cc(Br)ncc1F ZINC000762729465 1120956112 /nfs/dbraw/zinc/95/61/12/1120956112.db2.gz KGWWMSVQXMUUJO-STQMWFEESA-N 2 0 360.315 4.144 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc(Br)ncc1F ZINC000762738594 1120956848 /nfs/dbraw/zinc/95/68/48/1120956848.db2.gz UWSCJGLFGBPKQJ-ZIAGYGMSSA-N 2 0 372.326 4.146 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(F)cc3)CC2)cc1 ZINC000495788365 1120957646 /nfs/dbraw/zinc/95/76/46/1120957646.db2.gz PILWJVTWROLLHN-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000236810491 1120970053 /nfs/dbraw/zinc/97/00/53/1120970053.db2.gz OTOBEXODIIHCRA-OAQYLSRUSA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)CC1 ZINC000236831199 1120970381 /nfs/dbraw/zinc/97/03/81/1120970381.db2.gz LLYYDIKEWANBQN-UHFFFAOYSA-N 2 0 374.532 4.422 20 0 FIADRP COc1cc(C[NH2+]CC(C)(C)C[NH+](C)C)c(-c2ccccc2)cc1OC ZINC000237121194 1120973402 /nfs/dbraw/zinc/97/34/02/1120973402.db2.gz XUCQDHHFMLTGNB-UHFFFAOYSA-N 2 0 356.510 4.048 20 0 FIADRP Cc1cc(F)ccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000237622199 1120980335 /nfs/dbraw/zinc/98/03/35/1120980335.db2.gz HECYJPAFVDDBHE-ROUUACIJSA-N 2 0 356.485 4.033 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1OC(F)F ZINC000397998020 1121332014 /nfs/dbraw/zinc/33/20/14/1121332014.db2.gz UKFHSTLNTUHOGH-LPHOPBHVSA-N 2 0 360.448 4.288 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3c(C)cc(C)cc3C)cc2)CC1 ZINC000061070154 1121506722 /nfs/dbraw/zinc/50/67/22/1121506722.db2.gz NJWJDNJEOCIMNA-UHFFFAOYSA-N 2 0 365.565 4.039 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Br)s1 ZINC000123617917 1121619463 /nfs/dbraw/zinc/61/94/63/1121619463.db2.gz UVGFHLXPESGIBS-GFCCVEGCSA-N 2 0 353.329 4.423 20 0 FIADRP OC1CCC([NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000671740280 1121642194 /nfs/dbraw/zinc/64/21/94/1121642194.db2.gz FJANNHUGIKUVHK-UHFFFAOYSA-N 2 0 364.533 4.343 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc3[nH]c(=O)oc3c2)c1 ZINC000671741770 1121647002 /nfs/dbraw/zinc/64/70/02/1121647002.db2.gz XVUUCYWYBUKCME-OAHLLOKOSA-N 2 0 353.466 4.226 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(OCc2ccccc2)cc1 ZINC000124371493 1121689017 /nfs/dbraw/zinc/68/90/17/1121689017.db2.gz CJIXSNUJQPZDRR-AZUAARDMSA-N 2 0 350.506 4.401 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(OCc2ccccc2)cc1 ZINC000124371741 1121689180 /nfs/dbraw/zinc/68/91/80/1121689180.db2.gz CJIXSNUJQPZDRR-UYAOXDASSA-N 2 0 350.506 4.401 20 0 FIADRP CCn1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c(C)n1 ZINC001649091172 1121720189 /nfs/dbraw/zinc/72/01/89/1121720189.db2.gz LQDYOHBKCIEYFW-UHFFFAOYSA-N 2 0 368.569 4.036 20 0 FIADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2CCCCN2Cc2cccc(Cl)c2)CC1(C)C ZINC001649095863 1121755500 /nfs/dbraw/zinc/75/55/00/1121755500.db2.gz IBWWOABDZNRWBG-UXHICEINSA-N 2 0 363.977 4.157 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)OCCO2 ZINC000125484344 1121784467 /nfs/dbraw/zinc/78/44/67/1121784467.db2.gz PENMSWXEEKZCPR-MRXNPFEDSA-N 2 0 372.534 4.082 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000125614482 1121797531 /nfs/dbraw/zinc/79/75/31/1121797531.db2.gz AQNVUVGRPVRVIY-JKSUJKDBSA-N 2 0 358.555 4.286 20 0 FIADRP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OCc2nccn2C)cc1 ZINC000125895059 1121863547 /nfs/dbraw/zinc/86/35/47/1121863547.db2.gz JXZSWGRMBAHIIS-FXAWDEMLSA-N 2 0 372.557 4.016 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3CC[NH+](C)CC3)s2)cc1 ZINC000126343418 1121947070 /nfs/dbraw/zinc/94/70/70/1121947070.db2.gz COWJNNISTYQFMD-CQSZACIVSA-N 2 0 359.539 4.120 20 0 FIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)s1 ZINC000126662550 1121973504 /nfs/dbraw/zinc/97/35/04/1121973504.db2.gz NJQASEZGNJWDAH-HOTGVXAUSA-N 2 0 361.530 4.359 20 0 FIADRP Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126725075 1121980682 /nfs/dbraw/zinc/98/06/82/1121980682.db2.gz OJPJVKVBXNXVGM-MSOLQXFVSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3c(F)cccc3F)cc2)C1 ZINC000917008901 1121997682 /nfs/dbraw/zinc/99/76/82/1121997682.db2.gz USPYFVWZCSGBGR-KKSFZXQISA-N 2 0 374.475 4.020 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)c1 ZINC000186381319 1122072468 /nfs/dbraw/zinc/07/24/68/1122072468.db2.gz PDJBPNKNJKAQIJ-UHFFFAOYSA-N 2 0 354.494 4.073 20 0 FIADRP CC(C)C[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000127409074 1122091242 /nfs/dbraw/zinc/09/12/42/1122091242.db2.gz ISXCCJJQYQGGIC-APWZRJJASA-N 2 0 371.491 4.018 20 0 FIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616143 1122103010 /nfs/dbraw/zinc/10/30/10/1122103010.db2.gz QODCVAMIOVCXGE-OYZUSSLQSA-N 2 0 360.542 4.158 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000497387233 1122199108 /nfs/dbraw/zinc/19/91/08/1122199108.db2.gz QTELJIRKRUWCAA-GOUWZUTHSA-N 2 0 364.533 4.264 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630602 1122217204 /nfs/dbraw/zinc/21/72/04/1122217204.db2.gz QODCVAMIOVCXGE-ITTUMRLJSA-N 2 0 360.542 4.158 20 0 FIADRP C[C@@H]([NH2+]C1(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000497593058 1122301152 /nfs/dbraw/zinc/30/11/52/1122301152.db2.gz WNPKVYUKGWPVLX-TZIWHRDSSA-N 2 0 371.569 4.031 20 0 FIADRP CC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)cc1Cl ZINC000128495514 1122317440 /nfs/dbraw/zinc/31/74/40/1122317440.db2.gz ZIGMYLQZDGSWLR-SFHVURJKSA-N 2 0 358.357 4.062 20 0 FIADRP CC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)cc1Cl ZINC000128495726 1122317572 /nfs/dbraw/zinc/31/75/72/1122317572.db2.gz ZIGMYLQZDGSWLR-GOSISDBHSA-N 2 0 358.357 4.062 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@H]([NH3+])c1ccccc1 ZINC000262667281 1122410042 /nfs/dbraw/zinc/41/00/42/1122410042.db2.gz KUKFMOXPYXAXCX-FGSXEWAUSA-N 2 0 365.521 4.336 20 0 FIADRP C[C@H](c1cccc(Br)c1)[NH+]1CCC(Cc2nccn2C)CC1 ZINC000128907359 1122457965 /nfs/dbraw/zinc/45/79/65/1122457965.db2.gz RGLPZDKSCPVJSB-CQSZACIVSA-N 2 0 362.315 4.198 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556053492 1122625693 /nfs/dbraw/zinc/62/56/93/1122625693.db2.gz TVUPZEYJAALGKY-KMDXXIMOSA-N 2 0 363.549 4.249 20 0 FIADRP CN1CC[C@@H]([NH2+]CCc2c[nH]c3ccc(F)cc23)C[C@@H]1c1ccccc1 ZINC000556094300 1122648153 /nfs/dbraw/zinc/64/81/53/1122648153.db2.gz WNMUSVOIXOZIFD-DENIHFKCSA-N 2 0 351.469 4.275 20 0 FIADRP C[C@@H]1C[C@H](N[C@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)C[N@@H+]1Cc1ccccc1 ZINC000556104972 1122656268 /nfs/dbraw/zinc/65/62/68/1122656268.db2.gz OANNHPYKNHDELQ-QLBRKBSLSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cccc(C2CC2)c1 ZINC000556194586 1122726576 /nfs/dbraw/zinc/72/65/76/1122726576.db2.gz WALWEEBJVIFCIE-KRWDZBQOSA-N 2 0 353.510 4.140 20 0 FIADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556232846 1122749895 /nfs/dbraw/zinc/74/98/95/1122749895.db2.gz LGNIDBIDOUUSCD-FSSWDIPSSA-N 2 0 356.554 4.084 20 0 FIADRP c1[nH+]cn2cc(-c3nc(-c4ccccc4C[NH+]4CCCCC4)no3)ccc12 ZINC000556316058 1122804979 /nfs/dbraw/zinc/80/49/79/1122804979.db2.gz PWZZZEUFHSDPCM-UHFFFAOYSA-N 2 0 359.433 4.037 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(Cl)s1 ZINC000498483616 1122829142 /nfs/dbraw/zinc/82/91/42/1122829142.db2.gz JTXFJNMNYMXRPS-CQSZACIVSA-N 2 0 352.931 4.235 20 0 FIADRP C/C(=C/c1ccccc1)C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556407830 1122873966 /nfs/dbraw/zinc/87/39/66/1122873966.db2.gz KFISRGXKEMUDBH-MNDPQUGUSA-N 2 0 350.506 4.353 20 0 FIADRP CC[NH+](CC)CCC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515650 1122938338 /nfs/dbraw/zinc/93/83/38/1122938338.db2.gz RRHVNLRYASTLRZ-IBGZPJMESA-N 2 0 372.475 4.495 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498805383 1123023165 /nfs/dbraw/zinc/02/31/65/1123023165.db2.gz KFLXBFBOSXHYAY-AKIFATBCSA-N 2 0 372.528 4.119 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c(C)c1OC ZINC000556868978 1123151106 /nfs/dbraw/zinc/15/11/06/1123151106.db2.gz ZPRROHBXXQCETH-SFHVURJKSA-N 2 0 362.558 4.421 20 0 FIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000556889470 1123174952 /nfs/dbraw/zinc/17/49/52/1123174952.db2.gz HSFPGQKGNJHIOK-YADARESESA-N 2 0 366.549 4.303 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556890734 1123176649 /nfs/dbraw/zinc/17/66/49/1123176649.db2.gz VMCZYFFMKBSXIF-OKZBNKHCSA-N 2 0 360.542 4.316 20 0 FIADRP C[C@H]1CCC[N@@H+](C(C)(C)CN[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499145496 1123286643 /nfs/dbraw/zinc/28/66/43/1123286643.db2.gz HDYNTLWATNIGCA-SNJCGAMXSA-N 2 0 369.597 4.282 20 0 FIADRP Fc1cccc(F)c1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499149781 1123293301 /nfs/dbraw/zinc/29/33/01/1123293301.db2.gz UKEMERJBHZJNRY-LDLYASANSA-N 2 0 356.460 4.293 20 0 FIADRP Fc1cccc(F)c1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499149783 1123293527 /nfs/dbraw/zinc/29/35/27/1123293527.db2.gz UKEMERJBHZJNRY-REPLKXPHSA-N 2 0 356.460 4.293 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)s1 ZINC000132997143 1123396042 /nfs/dbraw/zinc/39/60/42/1123396042.db2.gz GTVBPXLYBNUZJZ-UHFFFAOYSA-N 2 0 357.567 4.131 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000133465699 1123489859 /nfs/dbraw/zinc/48/98/59/1123489859.db2.gz USXJYDMYFNPYRR-DYESRHJHSA-N 2 0 354.494 4.192 20 0 FIADRP CC(C)[C@@H](CNC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCCCC1 ZINC000195569489 1123738211 /nfs/dbraw/zinc/73/82/11/1123738211.db2.gz SISFYNKSHJUXEZ-HSZRJFAPSA-N 2 0 357.586 4.141 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CCN(Cc2csc(C3CC3)n2)CC1 ZINC000135354485 1123742529 /nfs/dbraw/zinc/74/25/29/1123742529.db2.gz KABPKHABLKAKHV-UHFFFAOYSA-N 2 0 355.551 4.365 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@H](C)C1 ZINC000081094935 1123983986 /nfs/dbraw/zinc/98/39/86/1123983986.db2.gz ZDSXSJDVIZYNHR-GCJKJVERSA-N 2 0 365.521 4.101 20 0 FIADRP CC(C)Oc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000195719157 1124017327 /nfs/dbraw/zinc/01/73/27/1124017327.db2.gz FCTUNBGKMFWGSJ-UHFFFAOYSA-N 2 0 352.522 4.476 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@H]([NH3+])c2ccccc2)cc1 ZINC000263368988 1124030270 /nfs/dbraw/zinc/03/02/70/1124030270.db2.gz XJBCYXNBYOJVKQ-UWJYYQICSA-N 2 0 351.494 4.090 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523949 1124158018 /nfs/dbraw/zinc/15/80/18/1124158018.db2.gz JDXPNDUKNXIQPU-GOSISDBHSA-N 2 0 359.558 4.109 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000245655526 1124170061 /nfs/dbraw/zinc/17/00/61/1124170061.db2.gz DLSMZPQSDZSFAM-OWZKRDHZSA-N 2 0 355.551 4.088 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCCC[NH+]2CCCCC2)C3)cc1 ZINC000245695176 1124204099 /nfs/dbraw/zinc/20/40/99/1124204099.db2.gz KZMSUWADBAYTKX-JOZNFPNDSA-N 3 0 369.597 4.428 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245756720 1124241131 /nfs/dbraw/zinc/24/11/31/1124241131.db2.gz UXRRVHFVQYUEJX-JLLPCOHGSA-N 2 0 369.597 4.140 20 0 FIADRP C[C@H]([NH2+][C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2ccnc2)cc1 ZINC000245844548 1124260747 /nfs/dbraw/zinc/26/07/47/1124260747.db2.gz FFFLAJLKDKEMND-WVFSVQOHSA-N 2 0 369.415 4.331 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000246122272 1124362700 /nfs/dbraw/zinc/36/27/00/1124362700.db2.gz QTCCDLVACTZMRF-PWRODBHTSA-N 2 0 362.945 4.149 20 0 FIADRP CC(C)COc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000246300991 1124439198 /nfs/dbraw/zinc/43/91/98/1124439198.db2.gz DAWHEUAAUNYBGT-OFAXGOBFSA-N 2 0 374.569 4.140 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000542846866 1124447514 /nfs/dbraw/zinc/44/75/14/1124447514.db2.gz OBFFACOVUNWAMK-CYFREDJKSA-N 2 0 366.549 4.303 20 0 FIADRP c1ccc(CN2CC[C@H]([NH2+][C@@H](C3CC3)[C@H]3CCCCO3)CC23CC3)cc1 ZINC000655788979 1124507144 /nfs/dbraw/zinc/50/71/44/1124507144.db2.gz SNAODWDQKPAEEJ-BDTNDASRSA-N 2 0 354.538 4.121 20 0 FIADRP CCCCc1noc([C@H](C)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)n1 ZINC000057924962 1124545797 /nfs/dbraw/zinc/54/57/97/1124545797.db2.gz UQIINXMUEVNJCG-SFHVURJKSA-N 2 0 370.541 4.317 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(Cc3ccccc3)nc2C)C1 ZINC000247183861 1124597283 /nfs/dbraw/zinc/59/72/83/1124597283.db2.gz VKWYSGHHMYUKPA-APWZRJJASA-N 2 0 357.567 4.425 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(F)c1 ZINC000247419821 1124708227 /nfs/dbraw/zinc/70/82/27/1124708227.db2.gz KFHIMBYBYCLRKO-FGTMMUONSA-N 2 0 356.485 4.286 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1F ZINC000248874417 1124821530 /nfs/dbraw/zinc/82/15/30/1124821530.db2.gz LIUSHFYNYKPVBB-SCTDSRPQSA-N 2 0 362.533 4.256 20 0 FIADRP Clc1ccc(N2CCC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c(Cl)c1 ZINC000248961365 1124829971 /nfs/dbraw/zinc/82/99/71/1124829971.db2.gz BEBPRBNURUORCJ-IKGGRYGDSA-N 2 0 368.352 4.179 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cn1 ZINC000249628373 1124870047 /nfs/dbraw/zinc/87/00/47/1124870047.db2.gz RFVIGVFXFIDAMK-LJQANCHMSA-N 2 0 366.553 4.059 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215494 1124891153 /nfs/dbraw/zinc/89/11/53/1124891153.db2.gz BLVASNLZFMQCKW-QZTJIDSGSA-N 2 0 353.510 4.088 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1nc2ccccc2n1C ZINC000091267607 1125060399 /nfs/dbraw/zinc/06/03/99/1125060399.db2.gz QOFIAMUODCUDII-SFHVURJKSA-N 2 0 362.521 4.410 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285519 1125062391 /nfs/dbraw/zinc/06/23/91/1125062391.db2.gz YUYRXWOCPGVJFM-IFXJQAMLSA-N 2 0 370.368 4.060 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091333640 1125066040 /nfs/dbraw/zinc/06/60/40/1125066040.db2.gz YWMKFMGGTCUNAF-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H](CO)c3ccc(Cl)cc3)CC2)C1 ZINC000672619091 1125195716 /nfs/dbraw/zinc/19/57/16/1125195716.db2.gz IOBFRPLVQVSKPP-BLIXFSHQSA-N 2 0 364.961 4.049 20 0 FIADRP C[NH+](C/C=C/C[N@H+](C)CCc1ccc(F)cc1)CCc1ccc(F)cc1 ZINC000065596321 1125273096 /nfs/dbraw/zinc/27/30/96/1125273096.db2.gz RRABUDUZNDEWQD-ONEGZZNKSA-N 2 0 358.476 4.170 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cnc2ccccc2c1 ZINC000499625916 1125370536 /nfs/dbraw/zinc/37/05/36/1125370536.db2.gz OCARCOQPNUAOHM-RTBURBONSA-N 2 0 359.517 4.481 20 0 FIADRP C[NH+](C)CC1CC[NH+](CC/C=C/c2ccc(Br)cc2)CC1 ZINC000604997966 568508262 /nfs/dbraw/zinc/50/82/62/568508262.db2.gz WZBAGUHHFFPHCV-HWKANZROSA-N 2 0 351.332 4.126 20 0 FIADRP Cc1nc(C[N@@H+]2CCCC23CCN(c2cc(C)cc(C)[nH+]2)CC3)cs1 ZINC001164690852 719803755 /nfs/dbraw/zinc/80/37/55/719803755.db2.gz AZWQLOWYXLNMDK-UHFFFAOYSA-N 2 0 356.539 4.098 20 0 FIADRP Cc1[nH+]c(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)cc2[nH]ccc21 ZINC001164995390 722206722 /nfs/dbraw/zinc/20/67/22/722206722.db2.gz NFEBGDUERRQHGM-QFIPXVFZSA-N 2 0 364.468 4.255 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)NC2CC[NH+](CC3CC3)CC2)ccc1OC ZINC000182507120 1125539594 /nfs/dbraw/zinc/53/95/94/1125539594.db2.gz SEQDOMADJUIPEF-SFHVURJKSA-N 2 0 373.585 4.062 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(O)c2)cc1C[NH+]1CCCCC1 ZINC000182746938 1125613274 /nfs/dbraw/zinc/61/32/74/1125613274.db2.gz CWMAMPZWHDNGMG-KRWDZBQOSA-N 2 0 354.494 4.238 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2c(C)noc2C)ccc1OC ZINC000182892399 1125668680 /nfs/dbraw/zinc/66/86/80/1125668680.db2.gz CIRGNYAOZHKZFJ-HNNXBMFYSA-N 2 0 359.514 4.035 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCc2cscn2)cc1C[NH+]1CCCCC1 ZINC000183141997 1125759584 /nfs/dbraw/zinc/75/95/84/1125759584.db2.gz RLJWNUBPGODYLE-MRXNPFEDSA-N 2 0 359.539 4.031 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCc2cscn2)cc1C[NH+]1CCCCC1 ZINC000183141981 1125760080 /nfs/dbraw/zinc/76/00/80/1125760080.db2.gz RLJWNUBPGODYLE-INIZCTEOSA-N 2 0 359.539 4.031 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000579744269 1079607713 /nfs/dbraw/zinc/60/77/13/1079607713.db2.gz YGCGUXVJAZVIFV-RDBSUJKOSA-N 2 0 371.388 4.251 20 0 FIADRP C[C@H](C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1)C[NH+]1CCCC1 ZINC000544828745 1079612340 /nfs/dbraw/zinc/61/23/40/1079612340.db2.gz ZFWNFUJOHKJCEY-UTKZUKDTSA-N 2 0 357.929 4.340 20 0 FIADRP COc1cccc(C[C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)c1 ZINC000643546857 1079671826 /nfs/dbraw/zinc/67/18/26/1079671826.db2.gz VWTMCQSANITNGA-IFMALSPDSA-N 2 0 350.506 4.243 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)ccc1OCCC(C)C ZINC000643547786 1079681652 /nfs/dbraw/zinc/68/16/52/1079681652.db2.gz GQPHZIHGJINXLX-MTFMMBMASA-N 2 0 360.542 4.159 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccccc2Br)CC1 ZINC000510097717 1079999857 /nfs/dbraw/zinc/99/98/57/1079999857.db2.gz DXGVGXMIUAIKAF-UHFFFAOYSA-N 2 0 353.348 4.393 20 0 FIADRP CC[NH+](CC)CCCC1CCN(C(=O)CC[N@H+](C)C2CCCCC2)CC1 ZINC000547737326 1080325908 /nfs/dbraw/zinc/32/59/08/1080325908.db2.gz HMRHFCBZPHHDQQ-UHFFFAOYSA-N 2 0 365.606 4.002 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](CC3CCC(c4ccccc4)CC3)C2)CC1 ZINC000547738386 1080332572 /nfs/dbraw/zinc/33/25/72/1080332572.db2.gz BQKZGMFHCZDVPW-FOJYNEPKSA-N 2 0 369.597 4.061 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180119307 1080451091 /nfs/dbraw/zinc/45/10/91/1080451091.db2.gz JWTKLXRRLNNOTM-GCJKJVERSA-N 2 0 371.956 4.045 20 0 FIADRP C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683347309 1080701228 /nfs/dbraw/zinc/70/12/28/1080701228.db2.gz OBRMVIJNJREULN-YOLZPYMBSA-N 2 0 358.570 4.470 20 0 FIADRP COCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000579898018 1080847601 /nfs/dbraw/zinc/84/76/01/1080847601.db2.gz VSXIMYIYARUOAM-KOUNCHBCSA-N 2 0 356.554 4.369 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547834869 1080947912 /nfs/dbraw/zinc/94/79/12/1080947912.db2.gz MLWHRUQVPJSBCJ-YLJYHZDGSA-N 2 0 374.475 4.331 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC ZINC000312519853 1080965453 /nfs/dbraw/zinc/96/54/53/1080965453.db2.gz OIRGYUJSQYDGPM-RXVVDRJESA-N 2 0 368.521 4.094 20 0 FIADRP FC(F)(F)c1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)nc1 ZINC000683518196 1081045301 /nfs/dbraw/zinc/04/53/01/1081045301.db2.gz FQHSJZQJVFRWOV-UHFFFAOYSA-N 2 0 355.448 4.188 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc(O)ccc2Br)C1 ZINC001648811134 1081125632 /nfs/dbraw/zinc/12/56/32/1081125632.db2.gz FGFAVANTHTVPOK-HUUCEWRRSA-N 2 0 369.347 4.002 20 0 FIADRP Clc1cccc([C@H]([NH2+]C2CCN([C@@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000655734252 1081152027 /nfs/dbraw/zinc/15/20/27/1081152027.db2.gz DBANACYHTWYCBF-NHCUHLMSSA-N 2 0 362.945 4.414 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000655805229 1081211708 /nfs/dbraw/zinc/21/17/08/1081211708.db2.gz LGIALQXPFXKCMA-XCRHUMRWSA-N 2 0 363.299 4.061 20 0 FIADRP CC[C@@H](CCc1ccc(Br)cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806215 1081214685 /nfs/dbraw/zinc/21/46/85/1081214685.db2.gz RNXPQCMHPRBKJP-RYQLBKOJSA-N 2 0 353.348 4.090 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CCC3)cc1 ZINC000655806229 1081214812 /nfs/dbraw/zinc/21/48/12/1081214812.db2.gz RWQJZAFDHLFVTK-LESCRADOSA-N 2 0 371.550 4.126 20 0 FIADRP c1cc2cc(C[NH2+]CC3(N4CCSCC4)CCCCC3)ccc2cn1 ZINC000683768821 1081526905 /nfs/dbraw/zinc/52/69/05/1081526905.db2.gz LUXOSQCORQEPES-UHFFFAOYSA-N 2 0 355.551 4.076 20 0 FIADRP c1nc(C2CC2)c(C[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000683774702 1081539752 /nfs/dbraw/zinc/53/97/52/1081539752.db2.gz IVKPMDJKVPSACU-UFYCRDLUSA-N 2 0 367.562 4.411 20 0 FIADRP C[C@@H](NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000471585485 1081984345 /nfs/dbraw/zinc/98/43/45/1081984345.db2.gz MKILJLNUKXBVDB-PJIZGREPSA-N 2 0 357.586 4.311 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000580501591 1081985147 /nfs/dbraw/zinc/98/51/47/1081985147.db2.gz LYLXFPRDHJTMJB-UGKGYDQZSA-N 2 0 352.522 4.132 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccc5ccccc5n4)C[C@@H]3C2)cc1 ZINC000312889949 1081993755 /nfs/dbraw/zinc/99/37/55/1081993755.db2.gz HZIJYRRZICEWCR-YADHBBJMSA-N 2 0 357.501 4.189 20 0 FIADRP Cc1cnn(CCCCC[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccc(C)s3)C2)c1 ZINC000580718288 1082096500 /nfs/dbraw/zinc/09/65/00/1082096500.db2.gz SNIVLUAUAUFVKT-FQEVSTJZSA-N 2 0 374.598 4.186 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCCC2CCOCC2)cc1 ZINC000656401788 1082332749 /nfs/dbraw/zinc/33/27/49/1082332749.db2.gz JBKMPKFAUYAPGF-KIHHCIJBSA-N 2 0 368.565 4.036 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)C2CCC2)cc1 ZINC000581274985 1082427863 /nfs/dbraw/zinc/42/78/63/1082427863.db2.gz MSQBBSRRZFYXHS-HSZRJFAPSA-N 2 0 367.537 4.352 20 0 FIADRP CCCC[C@@H](CC)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000581384494 1082506993 /nfs/dbraw/zinc/50/69/93/1082506993.db2.gz YQJXNHNRMSTLIS-FGZHOGPDSA-N 2 0 358.570 4.474 20 0 FIADRP CC(C)c1ccc(-c2ncc(C[NH+]3CCC(OCCC[NH3+])CC3)s2)cc1 ZINC000430601806 1082567494 /nfs/dbraw/zinc/56/74/94/1082567494.db2.gz URGAKKCTSGMNFL-UHFFFAOYSA-N 2 0 373.566 4.263 20 0 FIADRP Cc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2ccnn2C)c1 ZINC000558782211 1082676866 /nfs/dbraw/zinc/67/68/66/1082676866.db2.gz HVASMYVHSLIIDE-OAQYLSRUSA-N 2 0 374.532 4.007 20 0 FIADRP COc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)cc1 ZINC000656784041 1082768464 /nfs/dbraw/zinc/76/84/64/1082768464.db2.gz CGVXKIPYJMJICK-GOSISDBHSA-N 2 0 371.550 4.030 20 0 FIADRP CC(C)Cn1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000647171810 1082780498 /nfs/dbraw/zinc/78/04/98/1082780498.db2.gz XIBXNGIIAATQDR-IBGZPJMESA-N 2 0 354.542 4.061 20 0 FIADRP CC[N@H+](C)C[C@H]1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000559068922 1082879764 /nfs/dbraw/zinc/87/97/64/1082879764.db2.gz QRGVBCCLTFDSRH-QGZVFWFLSA-N 2 0 358.476 4.370 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)cn1 ZINC000156682205 1082952431 /nfs/dbraw/zinc/95/24/31/1082952431.db2.gz USHUTLPZBRYRQD-INIZCTEOSA-N 2 0 350.466 4.215 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2nc3ccccc3s2)CC1 ZINC000581911415 1083023292 /nfs/dbraw/zinc/02/32/92/1083023292.db2.gz STOSSTWNIFXOAD-LPHOPBHVSA-N 2 0 357.567 4.472 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)s1 ZINC000090971305 1083096280 /nfs/dbraw/zinc/09/62/80/1083096280.db2.gz BVXRUZJPHFDTSC-GOSISDBHSA-N 2 0 369.578 4.439 20 0 FIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000510685265 1083238011 /nfs/dbraw/zinc/23/80/11/1083238011.db2.gz KLMZZHUXKHWSQH-INIZCTEOSA-N 2 0 359.464 4.187 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)[NH+]2CCC([C@@H](C)[NH3+])CC2)c1 ZINC000430965541 1083260186 /nfs/dbraw/zinc/26/01/86/1083260186.db2.gz KEIGURBZBPIYQS-GCJKJVERSA-N 2 0 365.521 4.042 20 0 FIADRP CO[C@]1(C)C[C@H]([N@H+](C)CCC[NH+]2CCC(Cc3ccccc3)CC2)C1(C)C ZINC001167493448 1083269210 /nfs/dbraw/zinc/26/92/10/1083269210.db2.gz YUYHXTVSDICIIE-LADGPHEKSA-N 2 0 372.597 4.467 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000091317608 1083331852 /nfs/dbraw/zinc/33/18/52/1083331852.db2.gz IGNMLXAARXLXDT-QFIPXVFZSA-N 2 0 360.542 4.017 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)[C@@H]2CCCO[C@H]21 ZINC000658320202 1083405988 /nfs/dbraw/zinc/40/59/88/1083405988.db2.gz RDLCAJRDBZVETR-CIAFKFPVSA-N 2 0 368.565 4.082 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)s1 ZINC000658319516 1083406562 /nfs/dbraw/zinc/40/65/62/1083406562.db2.gz DSRAMHYCPDJCHQ-QFBILLFUSA-N 2 0 355.551 4.404 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000658355398 1083428560 /nfs/dbraw/zinc/42/85/60/1083428560.db2.gz INAHGEMHFAYZGT-GOSISDBHSA-N 2 0 367.459 4.189 20 0 FIADRP COc1cc(CNCCC[NH+]2CCCCC2)ccc1OCc1ccccc1 ZINC000520953394 1083482300 /nfs/dbraw/zinc/48/23/00/1083482300.db2.gz DQAUMOWLQYEMDS-UHFFFAOYSA-N 2 0 368.521 4.240 20 0 FIADRP CC(=O)Nc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000093844543 1083501367 /nfs/dbraw/zinc/50/13/67/1083501367.db2.gz YHJQSTZFHAEVDM-SFHVURJKSA-N 2 0 357.542 4.122 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000510980641 1083556470 /nfs/dbraw/zinc/55/64/70/1083556470.db2.gz YMVBCEVJQZTXKJ-PERKRYKHSA-N 2 0 368.496 4.322 20 0 FIADRP Clc1cccc(Cl)c1CCC[NH2+]C1CCN(C[C@@H]2CCCO2)CC1 ZINC000684614517 1083784414 /nfs/dbraw/zinc/78/44/14/1083784414.db2.gz YJNBMMDJMGRGHP-INIZCTEOSA-N 2 0 371.352 4.159 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1cccc(OCC[NH+](C)C)c1 ZINC000181342098 1083874203 /nfs/dbraw/zinc/87/42/03/1083874203.db2.gz PPIGFZGZDMVUMF-KRWDZBQOSA-N 2 0 371.525 4.050 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000544081869 1083883397 /nfs/dbraw/zinc/88/33/97/1083883397.db2.gz MRRJPURXWUSIMS-KRWDZBQOSA-N 2 0 362.533 4.400 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]Cc3cccc(OCC[NH+](C)C)c3)cc2c1C ZINC000472034607 1084127858 /nfs/dbraw/zinc/12/78/58/1084127858.db2.gz GFEPOZQQFYUZFO-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@]1(C)CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000382384491 1084131366 /nfs/dbraw/zinc/13/13/66/1084131366.db2.gz SDBDFIMOLWISRV-GOTSBHOMSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511020376 1084206064 /nfs/dbraw/zinc/20/60/64/1084206064.db2.gz XOBAAASKWNGHEQ-MJGOQNOKSA-N 2 0 358.476 4.398 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)cc2c1C ZINC000472078685 1084251123 /nfs/dbraw/zinc/25/11/23/1084251123.db2.gz CVFCUWBFYIVKLP-OAQYLSRUSA-N 2 0 361.533 4.439 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c(C)n1 ZINC000157630539 1084422422 /nfs/dbraw/zinc/42/24/22/1084422422.db2.gz RIKCBKOXPMBHRL-DLBZAZTESA-N 2 0 352.526 4.176 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000537972720 1084437989 /nfs/dbraw/zinc/43/79/89/1084437989.db2.gz ZGGIXZSMAIWYDK-GUYCJALGSA-N 2 0 351.332 4.460 20 0 FIADRP Cn1ncc(C2CC2)c1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000657323987 1084566176 /nfs/dbraw/zinc/56/61/76/1084566176.db2.gz KOOYSDXTBGTUCO-UHFFFAOYSA-N 2 0 366.553 4.352 20 0 FIADRP CCCn1nccc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000657323664 1084566363 /nfs/dbraw/zinc/56/63/63/1084566363.db2.gz GHPPRPPKYRDUEW-UHFFFAOYSA-N 2 0 354.542 4.347 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+]Cc3ccnn3-c3cc[nH+]cc3)CC2)c1 ZINC000657345401 1084666372 /nfs/dbraw/zinc/66/63/72/1084666372.db2.gz ORZFRPBQAMZTDM-UHFFFAOYSA-N 2 0 372.394 4.108 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1 ZINC000582141545 1084696734 /nfs/dbraw/zinc/69/67/34/1084696734.db2.gz QXTUKTBSKSVRKX-XPNTWCBSSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582141542 1084696776 /nfs/dbraw/zinc/69/67/76/1084696776.db2.gz QXTUKTBSKSVRKX-FUPPJEDESA-N 2 0 357.586 4.141 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CCCn2ccnc2)c(-c2ccccc2Cl)n1 ZINC000066586637 1084714624 /nfs/dbraw/zinc/71/46/24/1084714624.db2.gz CCTNJSJUXAMKRQ-UHFFFAOYSA-N 2 0 371.916 4.335 20 0 FIADRP Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000657358820 1084717348 /nfs/dbraw/zinc/71/73/48/1084717348.db2.gz HKWBCWBATQYHIC-UHFFFAOYSA-N 2 0 366.553 4.353 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(C)c1 ZINC000582208919 1084763384 /nfs/dbraw/zinc/76/33/84/1084763384.db2.gz SNPGOKBLKDMSGT-NRFANRHFSA-N 2 0 357.586 4.022 20 0 FIADRP Brc1ccc([C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)s1 ZINC000414187450 1084773528 /nfs/dbraw/zinc/77/35/28/1084773528.db2.gz PVLWBLLHVYHDNS-MRXNPFEDSA-N 2 0 362.296 4.399 20 0 FIADRP C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(Cl)cc1 ZINC000657377427 1084809253 /nfs/dbraw/zinc/80/92/53/1084809253.db2.gz TWPKMHGRWIWOQP-XMCHAPAWSA-N 2 0 352.869 4.408 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3c(c(Cl)c2)OCO3)CC1 ZINC000613491351 1084818950 /nfs/dbraw/zinc/81/89/50/1084818950.db2.gz OWSUOSGYLRYIMM-UHFFFAOYSA-N 2 0 352.906 4.013 20 0 FIADRP CCC1(C[NH2+]Cc2c(C3CC3)cnn2C)CC[NH+](Cc2ccccc2)CC1 ZINC000657415998 1084951739 /nfs/dbraw/zinc/95/17/39/1084951739.db2.gz KFNZMRWAKGPETG-UHFFFAOYSA-N 2 0 366.553 4.080 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000132737042 1085016386 /nfs/dbraw/zinc/01/63/86/1085016386.db2.gz WYNZUMZLTDMZTC-UZLBHIALSA-N 2 0 351.519 4.297 20 0 FIADRP CCSCC[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000545629225 1085258337 /nfs/dbraw/zinc/25/83/37/1085258337.db2.gz PSJHGGLPFTVZCL-DOTOQJQBSA-N 2 0 360.489 4.431 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)o2)cc1 ZINC000657536233 1085453337 /nfs/dbraw/zinc/45/33/37/1085453337.db2.gz YSTVNFIDTIFOKT-UHFFFAOYSA-N 2 0 368.521 4.236 20 0 FIADRP C[C@H](CC[N@@H+]1CC[C@H](CC(F)(F)F)C1)[NH+]1CC[C@H](CC(F)(F)F)C1 ZINC000444707420 1085549125 /nfs/dbraw/zinc/54/91/25/1085549125.db2.gz PPINBRFXOFPQKG-MGPQQGTHSA-N 2 0 360.386 4.314 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000237479274 1085663331 /nfs/dbraw/zinc/66/33/31/1085663331.db2.gz ISWTVRMLBVHAOU-JBYIUTFZSA-N 2 0 365.521 4.193 20 0 FIADRP COCc1ccc(C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000549549501 1085671168 /nfs/dbraw/zinc/67/11/68/1085671168.db2.gz UDVDABGUWCVAKZ-MOJGAOKDSA-N 2 0 352.522 4.079 20 0 FIADRP Clc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(Cl)c1 ZINC000657612267 1085688029 /nfs/dbraw/zinc/68/80/29/1085688029.db2.gz LBUUSIMYXDBDLD-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP C[C@@H](CCc1ccccc1)C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613933 1085699275 /nfs/dbraw/zinc/69/92/75/1085699275.db2.gz XPHKIHVQWMDPLI-FQEVSTJZSA-N 2 0 351.538 4.152 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](c2cccnc2)C2CCCCC2)C[C@H](C)O1 ZINC000652166535 1085733186 /nfs/dbraw/zinc/73/31/86/1085733186.db2.gz VHTBRZOWHUVUGX-XQBPLPMBSA-N 2 0 359.558 4.182 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(NC(C)=O)c1 ZINC000120451430 1085837425 /nfs/dbraw/zinc/83/74/25/1085837425.db2.gz WYVLYYGTEMRANL-KRWDZBQOSA-N 2 0 353.510 4.338 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)C[C@H]2CCCN2C(=O)OC(C)(C)C)CC1 ZINC000236761582 1085938347 /nfs/dbraw/zinc/93/83/47/1085938347.db2.gz QCRJWRGIEKQWPV-PKOBYXMFSA-N 2 0 367.578 4.019 20 0 FIADRP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1 ZINC000583048075 1086090156 /nfs/dbraw/zinc/09/01/56/1086090156.db2.gz KZFLEYQOFHHZBQ-FCHUYYIVSA-N 2 0 367.537 4.146 20 0 FIADRP C[C@@H](CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000249053751 1086182703 /nfs/dbraw/zinc/18/27/03/1086182703.db2.gz YCEMTOUNKUBYPY-XXTHSBEZSA-N 2 0 355.570 4.036 20 0 FIADRP Brc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063551912 1086309871 /nfs/dbraw/zinc/30/98/71/1086309871.db2.gz VUDHZFSSHYTEIT-UHFFFAOYSA-N 2 0 373.338 4.451 20 0 FIADRP Clc1cccc(-c2cnc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)o2)c1 ZINC000662290966 1086397255 /nfs/dbraw/zinc/39/72/55/1086397255.db2.gz AQMDFIKOKFZHMF-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP Clc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)co2)cc1 ZINC000662296004 1086400903 /nfs/dbraw/zinc/40/09/03/1086400903.db2.gz JVAUOHVDEAGNKI-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP CC[C@@H](c1ccccc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327120 1086414051 /nfs/dbraw/zinc/41/40/51/1086414051.db2.gz JTTOIHAHNRBLDN-QFIPXVFZSA-N 2 0 352.526 4.207 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000052210051 1086457358 /nfs/dbraw/zinc/45/73/58/1086457358.db2.gz MOEGMZDKJFENQF-LJQANCHMSA-N 2 0 372.475 4.183 20 0 FIADRP COc1c(F)cccc1C[NH+]1CCC2(CC[N@H+](Cc3cccs3)C2)CC1 ZINC001143524507 1086464274 /nfs/dbraw/zinc/46/42/74/1086464274.db2.gz RQNHUQBXKVMFRH-UHFFFAOYSA-N 2 0 374.525 4.384 20 0 FIADRP CC[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cccc(Cl)c1 ZINC000583286080 1086523432 /nfs/dbraw/zinc/52/34/32/1086523432.db2.gz BSNJSNCFJKHFHT-IBGZPJMESA-N 2 0 361.917 4.306 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535987981 1086529340 /nfs/dbraw/zinc/52/93/40/1086529340.db2.gz PGCGMUFLPKVUBP-DNVCBOLYSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC[N@@H+]1C ZINC000165550897 1086537078 /nfs/dbraw/zinc/53/70/78/1086537078.db2.gz LYBXJEPTPYGUER-WMZHIEFXSA-N 2 0 374.532 4.171 20 0 FIADRP Cc1c([C@@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cnn1-c1ccc(F)cc1 ZINC000663468223 1086571908 /nfs/dbraw/zinc/57/19/08/1086571908.db2.gz KLFFYSBIMDMSAO-VQIMIIECSA-N 2 0 370.516 4.092 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469982 1086575503 /nfs/dbraw/zinc/57/55/03/1086575503.db2.gz SHCQPUDPUWJRFY-UYAOXDASSA-N 2 0 371.569 4.239 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000162903294 1086581959 /nfs/dbraw/zinc/58/19/59/1086581959.db2.gz FFRIJVBROARHSL-QGZVFWFLSA-N 2 0 351.494 4.092 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(OCc2ccc(F)cc2)CC1 ZINC001167826872 1086617421 /nfs/dbraw/zinc/61/74/21/1086617421.db2.gz RPOLTNHENOPWSM-SFHVURJKSA-N 2 0 350.522 4.317 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](CC(C)C)c3ccncc3)CC2)oc1C ZINC000647288668 1086629144 /nfs/dbraw/zinc/62/91/44/1086629144.db2.gz KDWWCUWDIPUCEP-NRFANRHFSA-N 2 0 370.541 4.275 20 0 FIADRP C[C@@H]1CN(CCC[NH2+]Cc2ccc(-c3ccccc3F)s2)CCCO1 ZINC000432350349 1086648032 /nfs/dbraw/zinc/64/80/32/1086648032.db2.gz YLCJYUCLVCLVIW-MRXNPFEDSA-N 2 0 362.514 4.145 20 0 FIADRP C[C@@H]1C[C@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000525641289 1086669266 /nfs/dbraw/zinc/66/92/66/1086669266.db2.gz ICHJBCDEXATZJG-IEBWSBKVSA-N 2 0 372.557 4.055 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCC34CCOCC4)cc2)C1 ZINC000548794517 1086671997 /nfs/dbraw/zinc/67/19/97/1086671997.db2.gz KDZKWXYFWDUTLN-JQVVWYNYSA-N 2 0 356.554 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001167834491 1086682518 /nfs/dbraw/zinc/68/25/18/1086682518.db2.gz KPSZLRLRRFLATI-IBGZPJMESA-N 3 0 363.565 4.232 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167837222 1086711275 /nfs/dbraw/zinc/71/12/75/1086711275.db2.gz JOROIKBTWYHZSS-RTBURBONSA-N 2 0 369.594 4.076 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)C1CCCC1 ZINC000432406965 1086728702 /nfs/dbraw/zinc/72/87/02/1086728702.db2.gz JYTXBMDEGLXHNT-AVRDEDQJSA-N 2 0 360.542 4.017 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@]2(CCCN2Cc2ccccc2)C1 ZINC001167842370 1086749082 /nfs/dbraw/zinc/74/90/82/1086749082.db2.gz WPVYFNVGUUHCDZ-FYYLOGMGSA-N 2 0 357.586 4.237 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc3occc3c2)cc1 ZINC000512086198 1086750185 /nfs/dbraw/zinc/75/01/85/1086750185.db2.gz BQLSRXVYSPAHMD-UHFFFAOYSA-N 2 0 352.478 4.443 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)CCCO2 ZINC000432426088 1086753664 /nfs/dbraw/zinc/75/36/64/1086753664.db2.gz YACSNAJLEVTGSM-GHTZIAJQSA-N 2 0 360.542 4.114 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000650706441 1086755255 /nfs/dbraw/zinc/75/52/55/1086755255.db2.gz KOJFAGDMBVZWKY-YVWKXTFCSA-N 2 0 374.525 4.273 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432438977 1086771219 /nfs/dbraw/zinc/77/12/19/1086771219.db2.gz DYVYDLPALHEXSN-ZLGJRNTRSA-N 2 0 351.332 4.158 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCO1 ZINC000657771558 1086798862 /nfs/dbraw/zinc/79/88/62/1086798862.db2.gz CXZHKLKPOZPGPO-FSSWDIPSSA-N 2 0 356.554 4.082 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC000650723701 1086831477 /nfs/dbraw/zinc/83/14/77/1086831477.db2.gz SDAAQVZMRREBFN-CCKFTAQKSA-N 2 0 371.352 4.287 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(Br)c1 ZINC000650752475 1086951323 /nfs/dbraw/zinc/95/13/23/1086951323.db2.gz RKIMGPJJSOVOFI-QGZVFWFLSA-N 2 0 351.263 4.288 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Br)cc1F ZINC000650756450 1086967793 /nfs/dbraw/zinc/96/77/93/1086967793.db2.gz AZKKNTYENXYRDN-LBPRGKRZSA-N 2 0 351.263 4.158 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(OC)cc1Br ZINC000650756683 1086968267 /nfs/dbraw/zinc/96/82/67/1086968267.db2.gz HSIJHOSERJAXBB-CYBMUJFWSA-N 2 0 363.299 4.028 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(OC)c(Br)c1 ZINC000650758066 1086974350 /nfs/dbraw/zinc/97/43/50/1086974350.db2.gz HYLILSHOIMIIOW-CYBMUJFWSA-N 2 0 363.299 4.028 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CCC2CC[NH2+]CC2)c2ccccc2)cc1 ZINC000650762746 1086991629 /nfs/dbraw/zinc/99/16/29/1086991629.db2.gz IYFREKHWBXNGRG-HXUWFJFHSA-N 2 0 360.448 4.357 20 0 FIADRP CCOCc1ccc(C[NH2+]C2CCN(CCc3ccccc3)CC2)cc1 ZINC000151621576 1087179535 /nfs/dbraw/zinc/17/95/35/1087179535.db2.gz SZVHITFLCUMFDT-UHFFFAOYSA-N 2 0 352.522 4.020 20 0 FIADRP CCOc1ccc([C@H]([NH2+]CCc2cncn2C)c2ccccc2Cl)cc1 ZINC000564748109 1087258090 /nfs/dbraw/zinc/25/80/90/1087258090.db2.gz LQEQLYINVFYNKC-NRFANRHFSA-N 2 0 369.896 4.394 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cccc2c[nH]nc21 ZINC000084047318 1087344980 /nfs/dbraw/zinc/34/49/80/1087344980.db2.gz XWZNDGWBBMZSIG-UHFFFAOYSA-N 2 0 360.461 4.078 20 0 FIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC)c(OC)c1 ZINC000089215093 1087380370 /nfs/dbraw/zinc/38/03/70/1087380370.db2.gz UDYHPZXMPGDUHT-FQEVSTJZSA-N 2 0 369.509 4.056 20 0 FIADRP Cc1ccccc1[C@@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)C1CC1 ZINC000091265979 1087426534 /nfs/dbraw/zinc/42/65/34/1087426534.db2.gz FBCHRDXIIGJYMK-QHCPKHFHSA-N 2 0 350.506 4.068 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091333617 1087427841 /nfs/dbraw/zinc/42/78/41/1087427841.db2.gz YPHFVZLKMWIVGD-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP CCOc1ccc(C[N@H+](CCCn2ccnc2)Cc2ccsc2)cc1 ZINC000685451209 1087571535 /nfs/dbraw/zinc/57/15/35/1087571535.db2.gz FWVZDKBMRWZHQJ-UHFFFAOYSA-N 2 0 355.507 4.436 20 0 FIADRP CC[C@H](C)Oc1cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000685463112 1087575642 /nfs/dbraw/zinc/57/56/42/1087575642.db2.gz GRWNLPSEMQBHSN-PXNSSMCTSA-N 2 0 360.542 4.036 20 0 FIADRP COc1cccc(C2(C[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000685655480 1087660043 /nfs/dbraw/zinc/66/00/43/1087660043.db2.gz RBSSEGSCPUNFKV-PZJWPPBQSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H]([NH2+]C[C@]1(C)OCCc2sccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685662043 1087666934 /nfs/dbraw/zinc/66/69/34/1087666934.db2.gz YZFGSYGQLKQZHW-KPLVRAHFSA-N 2 0 370.562 4.036 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)cc2cc1OC ZINC000658034159 1087703774 /nfs/dbraw/zinc/70/37/74/1087703774.db2.gz COIBQOQUXITMLV-DLBZAZTESA-N 2 0 356.510 4.240 20 0 FIADRP Clc1ccc(C2CC([NH2+]CC3CC[NH+](C4CCOCC4)CC3)C2)cc1 ZINC000658069546 1087710679 /nfs/dbraw/zinc/71/06/79/1087710679.db2.gz HHUBFOZJXITHFR-UHFFFAOYSA-N 2 0 362.945 4.067 20 0 FIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658071254 1087711193 /nfs/dbraw/zinc/71/11/93/1087711193.db2.gz WQOMJHPIVHGUOT-FQEVSTJZSA-N 2 0 364.961 4.142 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000658070492 1087711543 /nfs/dbraw/zinc/71/15/43/1087711543.db2.gz WDOXBNBCZPAUSG-HNNXBMFYSA-N 2 0 370.459 4.247 20 0 FIADRP C[C@H]([NH2+]CCc1ccnc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658128245 1087734200 /nfs/dbraw/zinc/73/42/00/1087734200.db2.gz CCHFXPMRKMXOGU-SIKLNZKXSA-N 2 0 359.517 4.278 20 0 FIADRP CC(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658137678 1087742313 /nfs/dbraw/zinc/74/23/13/1087742313.db2.gz HXRPQUBAPMNQCG-JPYJTQIMSA-N 2 0 352.522 4.227 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000658138001 1087742778 /nfs/dbraw/zinc/74/27/78/1087742778.db2.gz LNTGYYCPKXADNE-LAUBAEHRSA-N 2 0 370.562 4.216 20 0 FIADRP CC1(C)Cc2occc2[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000658166732 1087763089 /nfs/dbraw/zinc/76/30/89/1087763089.db2.gz OIQIJTWXCUSZBU-FQEVSTJZSA-N 2 0 353.510 4.190 20 0 FIADRP Fc1ccc2c(c1Cl)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000658167839 1087763843 /nfs/dbraw/zinc/76/38/43/1087763843.db2.gz ZBGPTNPZBWLWPO-LJQANCHMSA-N 2 0 373.903 4.363 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168443 1087763961 /nfs/dbraw/zinc/76/39/61/1087763961.db2.gz XFDNBRYRORZESS-OALUTQOASA-N 2 0 367.537 4.084 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000424138734 1087787796 /nfs/dbraw/zinc/78/77/96/1087787796.db2.gz USBMPUSEMBOJDJ-RTBURBONSA-N 2 0 354.542 4.232 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[N@@H+]3CCC[C@@H](C)C3)C[C@H]2C1 ZINC000424269638 1087891956 /nfs/dbraw/zinc/89/19/56/1087891956.db2.gz PLAIFVIPFKORQO-PHNZBSFLSA-N 2 0 356.554 4.212 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]CC[C@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424308347 1087931906 /nfs/dbraw/zinc/93/19/06/1087931906.db2.gz ZVDPDQFIMIUHSP-RRWKQDFOSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000186615426 1087949174 /nfs/dbraw/zinc/94/91/74/1087949174.db2.gz MSEFDMXGISOIBN-OAHLLOKOSA-N 2 0 374.912 4.066 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000504896656 1087968630 /nfs/dbraw/zinc/96/86/30/1087968630.db2.gz ZDYQTFLXIBOYHO-AUSIDOKSSA-N 2 0 363.549 4.081 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CCC[NH2+]C2)ccc1OCc1ccc(Cl)cc1 ZINC000414826507 1088324152 /nfs/dbraw/zinc/32/41/52/1088324152.db2.gz IYGZLYRGHFGTCQ-SFHVURJKSA-N 2 0 374.912 4.017 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)NC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000513833427 1088435739 /nfs/dbraw/zinc/43/57/39/1088435739.db2.gz CAHBUNFFDMISCA-UHFFFAOYSA-N 2 0 371.569 4.055 20 0 FIADRP C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000311258130 1088473380 /nfs/dbraw/zinc/47/33/80/1088473380.db2.gz MMPRNPYEFMUDGF-HCXYKTFWSA-N 2 0 367.578 4.017 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)[C@@H]2CCC[C@H]21 ZINC000514095663 1088713559 /nfs/dbraw/zinc/71/35/59/1088713559.db2.gz SFAOXJNFKAJOOO-YJSIEXFISA-N 3 0 355.570 4.023 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)c1 ZINC000514101136 1088746341 /nfs/dbraw/zinc/74/63/41/1088746341.db2.gz ZBFWQYCYAFLGGX-SOLBZPMBSA-N 2 0 354.416 4.253 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)c1 ZINC000514101134 1088747068 /nfs/dbraw/zinc/74/70/68/1088747068.db2.gz ZBFWQYCYAFLGGX-LZLYRXPVSA-N 2 0 354.416 4.253 20 0 FIADRP CCOCOc1ccc(C[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000782960918 1088751373 /nfs/dbraw/zinc/75/13/73/1088751373.db2.gz VTGPSCFDUKEVJM-IBGZPJMESA-N 2 0 368.521 4.375 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415033656 1089072179 /nfs/dbraw/zinc/07/21/79/1089072179.db2.gz JCTAPKNMWFXJNG-AZUAARDMSA-N 2 0 360.505 4.065 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)ccc1OCc1ccc(Cl)cc1 ZINC000415041010 1089078690 /nfs/dbraw/zinc/07/86/90/1089078690.db2.gz PJFARCVDZAIBQX-LPHOPBHVSA-N 2 0 374.912 4.145 20 0 FIADRP Cc1cc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)sc1Br ZINC000415044159 1089080848 /nfs/dbraw/zinc/08/08/48/1089080848.db2.gz AJXKBVLMECFCRR-OAHLLOKOSA-N 2 0 353.329 4.389 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(Cl)c1 ZINC000415045802 1089091256 /nfs/dbraw/zinc/09/12/56/1089091256.db2.gz BUDGEFZZBNYKGD-VQIMIIECSA-N 2 0 373.928 4.435 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415046352 1089092196 /nfs/dbraw/zinc/09/21/96/1089092196.db2.gz VACKBGXOHKJGQP-IUODEOHRSA-N 2 0 357.361 4.167 20 0 FIADRP Cc1cc(Br)c(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000415054914 1089099869 /nfs/dbraw/zinc/09/98/69/1089099869.db2.gz OBQQZSDXMWODMY-HNNXBMFYSA-N 2 0 353.329 4.389 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]C1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000415059687 1089110319 /nfs/dbraw/zinc/11/03/19/1089110319.db2.gz VJUHOJXVKATEQX-QFIPXVFZSA-N 2 0 371.956 4.374 20 0 FIADRP c1ccc(-c2ccccc2OCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000415079096 1089135738 /nfs/dbraw/zinc/13/57/38/1089135738.db2.gz HFUKDONYDNWVRZ-VSKRKVRLSA-N 2 0 350.506 4.243 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415085889 1089145116 /nfs/dbraw/zinc/14/51/16/1089145116.db2.gz IYJODWJZXWIHNT-QZTJIDSGSA-N 2 0 369.509 4.140 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)C1 ZINC000415126565 1089177771 /nfs/dbraw/zinc/17/77/71/1089177771.db2.gz POZIGNBCEGXZDG-UYAOXDASSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000415130370 1089195729 /nfs/dbraw/zinc/19/57/29/1089195729.db2.gz QSEPIWWVGYYSDW-PZJWPPBQSA-N 2 0 374.525 4.273 20 0 FIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(C)c1 ZINC000514827878 1089504163 /nfs/dbraw/zinc/50/41/63/1089504163.db2.gz DUGAWLIYUNPBHT-DHIUTWEWSA-N 2 0 351.538 4.024 20 0 FIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000435368861 1089577181 /nfs/dbraw/zinc/57/71/81/1089577181.db2.gz CGICDXDPGSITOA-UHFFFAOYSA-N 2 0 351.313 4.101 20 0 FIADRP CCn1ccnc1CN(Cc1ccc2ccccc2c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435420054 1089635983 /nfs/dbraw/zinc/63/59/83/1089635983.db2.gz APXXAWLGKVWHBB-JOCHJYFZSA-N 2 0 374.532 4.201 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000515249710 1089913350 /nfs/dbraw/zinc/91/33/50/1089913350.db2.gz LEPGVCSOQJHOEA-OAQYLSRUSA-N 2 0 353.510 4.043 20 0 FIADRP CC[NH2+]Cc1cccc(NC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)c1 ZINC000415905866 1089987591 /nfs/dbraw/zinc/98/75/91/1089987591.db2.gz JBNLRAHXVVHCMS-QGZVFWFLSA-N 2 0 368.525 4.047 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc([C@]23CC[NH2+][C@H]2COCC3)cc1 ZINC001167733395 1090255983 /nfs/dbraw/zinc/25/59/83/1090255983.db2.gz SNABOYHSMXNNNV-XZOQPEGZSA-N 2 0 373.585 4.021 20 0 FIADRP FC(F)(F)[C@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)C[C@@H](C(F)(F)F)C1 ZINC000925527638 1090270288 /nfs/dbraw/zinc/27/02/88/1090270288.db2.gz WAKSJMKUYJUCGV-MROQNXINSA-N 2 0 358.370 4.160 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1cccc(OCC[NH+](C)C)c1 ZINC000378389869 1090335699 /nfs/dbraw/zinc/33/56/99/1090335699.db2.gz AQLFOACJXGNFCK-HARLFGEKSA-N 2 0 368.521 4.055 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1cccc(OCC[NH+](C)C)c1 ZINC000378389870 1090335745 /nfs/dbraw/zinc/33/57/45/1090335745.db2.gz AQLFOACJXGNFCK-QTGUNEKASA-N 2 0 368.521 4.055 20 0 FIADRP CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]C1CCN(c2ccccn2)CC1 ZINC000545456775 1090382773 /nfs/dbraw/zinc/38/27/73/1090382773.db2.gz VECRCXMEBXUVMR-MGPUTAFESA-N 2 0 359.901 4.070 20 0 FIADRP c1nc(C2CC2)oc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000628293228 1090387618 /nfs/dbraw/zinc/38/76/18/1090387618.db2.gz RXLVITFBXGVNHE-UHFFFAOYSA-N 2 0 351.494 4.040 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)[C@@H]1C[C@H]1c1cccs1 ZINC000417313683 1090807978 /nfs/dbraw/zinc/80/79/78/1090807978.db2.gz PWDXHUNAJXFUOJ-LSTHTHJFSA-N 2 0 358.551 4.013 20 0 FIADRP O[C@@H](CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccccc1 ZINC000312570832 1090976065 /nfs/dbraw/zinc/97/60/65/1090976065.db2.gz UUDPJUKYLCANCZ-QHCPKHFHSA-N 2 0 364.533 4.098 20 0 FIADRP CCn1cncc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000417853395 1090981868 /nfs/dbraw/zinc/98/18/68/1090981868.db2.gz FVVOIFZPPGRQOW-UHFFFAOYSA-N 2 0 374.532 4.456 20 0 FIADRP Clc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000388315465 1090985197 /nfs/dbraw/zinc/98/51/97/1090985197.db2.gz KTHFLOKFQRVZBV-GOSISDBHSA-N 2 0 365.908 4.500 20 0 FIADRP CCn1cncc1CNc1ccc(C[N@H+](C[C@@H]2CCCCO2)C(C)C)cc1 ZINC000417999899 1091019999 /nfs/dbraw/zinc/01/99/99/1091019999.db2.gz WSGKRVHPCSCCLF-QFIPXVFZSA-N 2 0 370.541 4.295 20 0 FIADRP C[C@H]1C[C@H](NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000390519709 1091163287 /nfs/dbraw/zinc/16/32/87/1091163287.db2.gz FSMVHZYGHNLXAZ-XUZZJYLKSA-N 2 0 365.565 4.151 20 0 FIADRP CCc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000652032932 1091247634 /nfs/dbraw/zinc/24/76/34/1091247634.db2.gz NSWMCIMJYOYRSX-UHFFFAOYSA-N 2 0 351.538 4.069 20 0 FIADRP O[C@H](C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000759842907 1091300170 /nfs/dbraw/zinc/30/01/70/1091300170.db2.gz HDXXXNPSIDOTIG-HXUWFJFHSA-N 2 0 368.924 4.101 20 0 FIADRP Fc1ccc2c(NCc3ccc(OCC[NH+]4CCCC4)cc3)cc[nH+]c2c1 ZINC000500419461 1091484442 /nfs/dbraw/zinc/48/44/42/1091484442.db2.gz JFDLOUWJXIDNRF-UHFFFAOYSA-N 2 0 365.452 4.461 20 0 FIADRP c1cncc([C@H]2CCC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000500452828 1092091703 /nfs/dbraw/zinc/09/17/03/1092091703.db2.gz RXQXRNLHNYJLSG-FPOVZHCZSA-N 2 0 350.510 4.009 20 0 FIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000500452830 1092092096 /nfs/dbraw/zinc/09/20/96/1092092096.db2.gz RXQXRNLHNYJLSG-TZIWHRDSSA-N 2 0 350.510 4.009 20 0 FIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000500452829 1092092159 /nfs/dbraw/zinc/09/21/59/1092092159.db2.gz RXQXRNLHNYJLSG-PZJWPPBQSA-N 2 0 350.510 4.009 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc(Cl)c1O ZINC000508338187 1092255042 /nfs/dbraw/zinc/25/50/42/1092255042.db2.gz JCTPDQISUILQCN-UHFFFAOYSA-N 2 0 374.912 4.330 20 0 FIADRP C[C@H]1CC([NH2+]Cc2cccc(C[NH+](C)C)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012413 1092335823 /nfs/dbraw/zinc/33/58/23/1092335823.db2.gz ZRCKQGVIRGEAFC-PMACEKPBSA-N 3 0 365.565 4.279 20 0 FIADRP Cc1ncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000428248515 1092574503 /nfs/dbraw/zinc/57/45/03/1092574503.db2.gz LXAAIIDQNFNGDM-SESVDKBCSA-N 2 0 355.551 4.232 20 0 FIADRP Oc1cccc2c1CC[C@H]2[NH2+]CCCCC[NH2+][C@@H]1CCc2c1cccc2O ZINC000451179989 1092636800 /nfs/dbraw/zinc/63/68/00/1092636800.db2.gz SFXYOZXEOILGJT-NHCUHLMSSA-N 2 0 366.505 4.122 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cncc(Br)c1 ZINC000521464043 1092708379 /nfs/dbraw/zinc/70/83/79/1092708379.db2.gz IVTWBGWDRATURH-HNNXBMFYSA-N 2 0 354.336 4.151 20 0 FIADRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000521514023 1092734345 /nfs/dbraw/zinc/73/43/45/1092734345.db2.gz FVPDYZSUHKLJOK-MAUKXSAKSA-N 2 0 361.942 4.380 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)CC2)cc1 ZINC000442761884 1092751244 /nfs/dbraw/zinc/75/12/44/1092751244.db2.gz DFYNBSZFKGXMLZ-HXUWFJFHSA-N 2 0 359.517 4.137 20 0 FIADRP c1cc2cc(CC[NH2+][C@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)ccc2[nH]1 ZINC000442820254 1092789700 /nfs/dbraw/zinc/78/97/00/1092789700.db2.gz KFBODLBSQYMZQM-FIXSFTCYSA-N 2 0 359.517 4.211 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c2ccccc2)c1 ZINC000442893252 1092846382 /nfs/dbraw/zinc/84/63/82/1092846382.db2.gz XFKNQCCJJRLDLJ-QHCPKHFHSA-N 2 0 365.565 4.008 20 0 FIADRP COCCC[NH+]1CCC(NCc2cccc(OCC3CCCCC3)c2)CC1 ZINC000521832692 1092933314 /nfs/dbraw/zinc/93/33/14/1092933314.db2.gz LIHDOZDXZCQODY-UHFFFAOYSA-N 2 0 374.569 4.236 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000474053379 1093153805 /nfs/dbraw/zinc/15/38/05/1093153805.db2.gz DLNHPEXIFYAQAU-HKUYNNGSSA-N 2 0 350.497 4.355 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)C1CCC(F)(F)CC1 ZINC000474057831 1093164794 /nfs/dbraw/zinc/16/47/94/1093164794.db2.gz PJVJKHPOVITNCP-MRXNPFEDSA-N 2 0 354.485 4.321 20 0 FIADRP C[C@@H]([NH2+]C1CCN([C@H](C)c2ccncc2)CC1)C1CCC(F)(F)CC1 ZINC000474073819 1093188593 /nfs/dbraw/zinc/18/85/93/1093188593.db2.gz PKKFIISLUWYLJI-HZPDHXFCSA-N 2 0 351.485 4.411 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CC3(CO)CC(c4ccccc4)C3)CC2)C1 ZINC000433094079 1093241568 /nfs/dbraw/zinc/24/15/68/1093241568.db2.gz TXUPQOAJYVMKOG-ZOGZRVJRSA-N 2 0 370.581 4.175 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000469787216 1093295987 /nfs/dbraw/zinc/29/59/87/1093295987.db2.gz NXVTZHCUEIOBTF-RXVVDRJESA-N 2 0 364.599 4.414 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000389082517 1093347578 /nfs/dbraw/zinc/34/75/78/1093347578.db2.gz DMSRXISUTXJOCV-UGKGYDQZSA-N 2 0 352.522 4.215 20 0 FIADRP C[C@H]1CC([NH2+][C@@H]2COc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024705 1093412554 /nfs/dbraw/zinc/41/25/54/1093412554.db2.gz HUDSRRRUDKSMTR-SPEDKVCISA-N 2 0 350.506 4.021 20 0 FIADRP C[C@H](C[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)CC(C)(C)CC[NH3+] ZINC001168028051 1093529376 /nfs/dbraw/zinc/52/93/76/1093529376.db2.gz ODKYILOMBLEUOK-UFYCRDLUSA-N 3 0 359.602 4.419 20 0 FIADRP COc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1OCc1ccccc1 ZINC000513070476 1093774116 /nfs/dbraw/zinc/77/41/16/1093774116.db2.gz QCCYHKWICZTQSU-IBGZPJMESA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)c1ccco1 ZINC000513078777 1093781062 /nfs/dbraw/zinc/78/10/62/1093781062.db2.gz WBWGZPLONVMURT-HLAWJBBLSA-N 2 0 361.574 4.295 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000474481182 1093827640 /nfs/dbraw/zinc/82/76/40/1093827640.db2.gz WQVSCIQFKLPYKJ-UHFFFAOYSA-N 2 0 372.553 4.274 20 0 FIADRP Cc1ccc(C[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)s1 ZINC000513439569 1094126617 /nfs/dbraw/zinc/12/66/17/1094126617.db2.gz PNUTYQKFYVZYEV-UHFFFAOYSA-N 2 0 357.567 4.219 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc(OC)c1 ZINC000513501496 1094175032 /nfs/dbraw/zinc/17/50/32/1094175032.db2.gz SXWIVGYXQSOPIV-UYAOXDASSA-N 2 0 368.521 4.094 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000513667393 1094262998 /nfs/dbraw/zinc/26/29/98/1094262998.db2.gz RGQUCOJHSLSMDZ-RMRNXIRCSA-N 2 0 370.581 4.470 20 0 FIADRP CC(C)[N@@H+](C1C[C@@H](C)N(Cc2ccccc2)[C@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168037174 1094346763 /nfs/dbraw/zinc/34/67/63/1094346763.db2.gz XCRDOJRQEMMQHA-UGESXGAOSA-N 2 0 357.586 4.408 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)c(OC(F)F)c1 ZINC000513698101 1094360547 /nfs/dbraw/zinc/36/05/47/1094360547.db2.gz WMFWQPFZIYRRRB-RCCFBDPRSA-N 2 0 368.468 4.039 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000513702609 1094382840 /nfs/dbraw/zinc/38/28/40/1094382840.db2.gz KSVIGYGBWSJWHU-UHFFFAOYSA-N 2 0 365.521 4.178 20 0 FIADRP CC(C)c1ccc([C@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000500992776 1094409129 /nfs/dbraw/zinc/40/91/29/1094409129.db2.gz PKUWLVHVORXHED-HSZRJFAPSA-N 2 0 357.586 4.363 20 0 FIADRP C[NH+]1CCN(CCC[NH2+][C@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000501051807 1094456807 /nfs/dbraw/zinc/45/68/07/1094456807.db2.gz GOKIRTSLGPLJAR-LJQANCHMSA-N 2 0 351.966 4.044 20 0 FIADRP C[N@H+](CCSc1ccccc1F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501074136 1094493041 /nfs/dbraw/zinc/49/30/41/1094493041.db2.gz BVLVDSYXJSQXLV-UHFFFAOYSA-N 2 0 359.514 4.161 20 0 FIADRP Cc1cccc2nc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn21 ZINC000513708851 1094552385 /nfs/dbraw/zinc/55/23/85/1094552385.db2.gz YFPOWIWRALIJCO-UHFFFAOYSA-N 2 0 362.521 4.176 20 0 FIADRP CC(C)OCCN1CCC([NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000474797346 1094615750 /nfs/dbraw/zinc/61/57/50/1094615750.db2.gz ZCTXHPASSOINBR-BHYGNILZSA-N 2 0 370.990 4.373 20 0 FIADRP Fc1ccc(C(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccc(F)cc2)cc1 ZINC000501404007 1094697713 /nfs/dbraw/zinc/69/77/13/1094697713.db2.gz FDRAPBHRRPYMRL-NHCUHLMSSA-N 2 0 356.460 4.313 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000389222017 1094700174 /nfs/dbraw/zinc/70/01/74/1094700174.db2.gz WSEUTXIJKFPMOL-JBACZVJFSA-N 2 0 350.506 4.053 20 0 FIADRP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420316160 1094880228 /nfs/dbraw/zinc/88/02/28/1094880228.db2.gz XZETYZARHDLIOK-QXRTWZOPSA-N 2 0 359.901 4.424 20 0 FIADRP CCC[N@H+](CC[C@@H]1CCC[NH2+]C1)CC(=O)Nc1ccc(Cl)cc1Cl ZINC000420325005 1094889709 /nfs/dbraw/zinc/88/97/09/1094889709.db2.gz VXLMYNCVHAROPG-AWEZNQCLSA-N 2 0 372.340 4.034 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000420372343 1094903218 /nfs/dbraw/zinc/90/32/18/1094903218.db2.gz FEBKXAOJSVOOGB-PKOBYXMFSA-N 2 0 368.974 4.041 20 0 FIADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000420370462 1094903601 /nfs/dbraw/zinc/90/36/01/1094903601.db2.gz VUKRQNQCOFCTSU-MRXNPFEDSA-N 2 0 374.941 4.194 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000420416907 1094914312 /nfs/dbraw/zinc/91/43/12/1094914312.db2.gz WAXHYJDNMNBJSY-ZFWWWQNUSA-N 2 0 352.400 4.107 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000501784236 1094923530 /nfs/dbraw/zinc/92/35/30/1094923530.db2.gz DHGJPUKVKZSNDI-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(C)nc3ccccc23)CC1 ZINC000501792190 1094925295 /nfs/dbraw/zinc/92/52/95/1094925295.db2.gz CKNCHFZMQZEDPY-UHFFFAOYSA-N 2 0 369.553 4.114 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000237107636 1094996682 /nfs/dbraw/zinc/99/66/82/1094996682.db2.gz GCZCNGUVGNFKFA-DLBZAZTESA-N 2 0 358.448 4.228 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000237107722 1094996722 /nfs/dbraw/zinc/99/67/22/1094996722.db2.gz GCZCNGUVGNFKFA-IRXDYDNUSA-N 2 0 358.448 4.228 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000237107688 1094997135 /nfs/dbraw/zinc/99/71/35/1094997135.db2.gz GCZCNGUVGNFKFA-SJORKVTESA-N 2 0 358.448 4.228 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)cc1 ZINC000237110708 1095003154 /nfs/dbraw/zinc/00/31/54/1095003154.db2.gz SZPWFDCQSPIOHD-UHFFFAOYSA-N 2 0 368.521 4.020 20 0 FIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000502059015 1095076857 /nfs/dbraw/zinc/07/68/57/1095076857.db2.gz VHRQNFNWRLLPCZ-OFNKIYASSA-N 2 0 374.569 4.235 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccc(F)cc1F ZINC000420932493 1095173104 /nfs/dbraw/zinc/17/31/04/1095173104.db2.gz HHISOXNMBUGYBM-QFIPXVFZSA-N 2 0 374.475 4.284 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)C1 ZINC000502278020 1095296150 /nfs/dbraw/zinc/29/61/50/1095296150.db2.gz SSTOXVIQWUTIBB-DENIHFKCSA-N 2 0 356.554 4.357 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCC23CCOCC3)CC1 ZINC000502431866 1095452194 /nfs/dbraw/zinc/45/21/94/1095452194.db2.gz CCFZBYFEKPLNDC-JOCHJYFZSA-N 2 0 356.554 4.357 20 0 FIADRP C[NH+](C)C1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000421368652 1095564781 /nfs/dbraw/zinc/56/47/81/1095564781.db2.gz GRYCBDFUYAQWQR-UHFFFAOYSA-N 2 0 351.332 4.158 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421373766 1095573294 /nfs/dbraw/zinc/57/32/94/1095573294.db2.gz OABGUTDCOFWPKW-UHFFFAOYSA-N 2 0 374.960 4.164 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000421373949 1095575021 /nfs/dbraw/zinc/57/50/21/1095575021.db2.gz OGASEJKESXLYQN-UHFFFAOYSA-N 2 0 366.431 4.058 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)nn1C ZINC000502705941 1095732068 /nfs/dbraw/zinc/73/20/68/1095732068.db2.gz CYENLMROSKWJLH-FQEVSTJZSA-N 2 0 368.569 4.114 20 0 FIADRP COc1ccc(OC)c(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000513755866 1095896959 /nfs/dbraw/zinc/89/69/59/1095896959.db2.gz USIWIMGYOUGKPT-UHFFFAOYSA-N 2 0 368.521 4.237 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421829270 1095941555 /nfs/dbraw/zinc/94/15/55/1095941555.db2.gz HIDLVAVPGSBLND-NRFANRHFSA-N 2 0 360.448 4.276 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000421886034 1095975450 /nfs/dbraw/zinc/97/54/50/1095975450.db2.gz UYDGBOVRBMKDHG-ZEPSKSRBSA-N 2 0 355.295 4.038 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH+]1CCC(C[NH3+])CC1 ZINC000414661819 1096362743 /nfs/dbraw/zinc/36/27/43/1096362743.db2.gz YBUVPFPXYWXIDF-UHFFFAOYSA-N 2 0 360.505 4.018 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)CCCC1 ZINC000422730098 1096464013 /nfs/dbraw/zinc/46/40/13/1096464013.db2.gz DDJJZWMACDTNNL-MRXNPFEDSA-N 2 0 353.510 4.020 20 0 FIADRP CC[C@H]1C[C@@H](C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000503581070 1096475290 /nfs/dbraw/zinc/47/52/90/1096475290.db2.gz IWODGEWXWAAZHL-VXKWHMMOSA-N 2 0 358.570 4.474 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)NCC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000422760733 1096476120 /nfs/dbraw/zinc/47/61/20/1096476120.db2.gz LFLUPUXOKWAHJG-ROUUACIJSA-N 2 0 366.553 4.163 20 0 FIADRP CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1Cl ZINC000422742654 1096478177 /nfs/dbraw/zinc/47/81/77/1096478177.db2.gz GSFIVHSZTLUIOF-VFNWGFHPSA-N 2 0 374.960 4.236 20 0 FIADRP C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)CC1 ZINC000422747206 1096480352 /nfs/dbraw/zinc/48/03/52/1096480352.db2.gz PMCLBCJLKAMUGC-YJSIEXFISA-N 2 0 355.570 4.112 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000422769360 1096486290 /nfs/dbraw/zinc/48/62/90/1096486290.db2.gz OTEVTTPRTZLNCV-OWSXEPHWSA-N 2 0 362.517 4.472 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1OC ZINC000422781447 1096489880 /nfs/dbraw/zinc/48/98/80/1096489880.db2.gz KQBKOIGDLDABOZ-UWVAXJGDSA-N 2 0 356.510 4.011 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c(OC)c1 ZINC000422797170 1096493550 /nfs/dbraw/zinc/49/35/50/1096493550.db2.gz LFZBGDIFDSIUMC-XOBRGWDASA-N 2 0 362.901 4.164 20 0 FIADRP FC(F)(F)COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422805590 1096496063 /nfs/dbraw/zinc/49/60/63/1096496063.db2.gz MEPDOFCCRJQSTF-KZNAEPCWSA-N 2 0 356.432 4.028 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OC(C)C ZINC000422805431 1096496285 /nfs/dbraw/zinc/49/62/85/1096496285.db2.gz GSIYKGYULUUKPT-LSDHHAIUSA-N 2 0 357.498 4.056 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1OC(F)F ZINC000422809900 1096497265 /nfs/dbraw/zinc/49/72/65/1096497265.db2.gz SQWVPFXEQCKPCU-LFRPXUGBSA-N 2 0 374.431 4.195 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cn2)c1 ZINC000422848831 1096504220 /nfs/dbraw/zinc/50/42/20/1096504220.db2.gz UIVHHFZYXRNXSJ-PWRODBHTSA-N 2 0 369.484 4.413 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422881143 1096511168 /nfs/dbraw/zinc/51/11/68/1096511168.db2.gz POJKZXPVDHWTJK-KBXCAEBGSA-N 2 0 371.352 4.149 20 0 FIADRP CC1CC[NH+](CCc2cccc(NC(=O)CC[C@@H]3CCCC[N@@H+]3C)c2)CC1 ZINC000503663795 1096514328 /nfs/dbraw/zinc/51/43/28/1096514328.db2.gz QRFRTOXHPGTGSX-QFIPXVFZSA-N 2 0 371.569 4.164 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000422874192 1096517440 /nfs/dbraw/zinc/51/74/40/1096517440.db2.gz CGCVMMYVGXBXSX-DLBZAZTESA-N 2 0 371.500 4.175 20 0 FIADRP c1ccc(SC2(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422911332 1096521180 /nfs/dbraw/zinc/52/11/80/1096521180.db2.gz STNUIQFGXMMGJW-PZJWPPBQSA-N 2 0 366.530 4.157 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccccc2)cc1OC ZINC000422908921 1096521344 /nfs/dbraw/zinc/52/13/44/1096521344.db2.gz NDFBVLFAVZAFSO-JITJBCMDSA-N 2 0 368.521 4.095 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000422939096 1096530794 /nfs/dbraw/zinc/53/07/94/1096530794.db2.gz QTBNDHFNPRCTEP-KRWDZBQOSA-N 2 0 361.489 4.245 20 0 FIADRP CC(C)(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422945129 1096534460 /nfs/dbraw/zinc/53/44/60/1096534460.db2.gz MOSZHARRPGHZQR-BHIFYINESA-N 2 0 370.581 4.153 20 0 FIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422945650 1096535547 /nfs/dbraw/zinc/53/55/47/1096535547.db2.gz NOOIICFUAVILAO-QKNQBKEWSA-N 2 0 354.881 4.173 20 0 FIADRP Clc1cccc(CCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422945634 1096535600 /nfs/dbraw/zinc/53/56/00/1096535600.db2.gz NMINLQWPDDLVFN-FPOVZHCZSA-N 2 0 356.897 4.118 20 0 FIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422945651 1096536131 /nfs/dbraw/zinc/53/61/31/1096536131.db2.gz NOOIICFUAVILAO-ZJOUEHCJSA-N 2 0 354.881 4.173 20 0 FIADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(c3ccccc3Cl)CCOCC2)c2ccccc21 ZINC000422954945 1096538989 /nfs/dbraw/zinc/53/89/89/1096538989.db2.gz IPYGXLCKRHQLRB-PMACEKPBSA-N 2 0 356.897 4.123 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000422992377 1096541024 /nfs/dbraw/zinc/54/10/24/1096541024.db2.gz PVXUKBIVRCZFOY-XJKSGUPXSA-N 2 0 352.931 4.473 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000422992373 1096541390 /nfs/dbraw/zinc/54/13/90/1096541390.db2.gz PVXUKBIVRCZFOY-CJNGLKHVSA-N 2 0 352.931 4.473 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000422992375 1096541773 /nfs/dbraw/zinc/54/17/73/1096541773.db2.gz PVXUKBIVRCZFOY-CZUORRHYSA-N 2 0 352.931 4.473 20 0 FIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)c2)nc1 ZINC000422993809 1096542946 /nfs/dbraw/zinc/54/29/46/1096542946.db2.gz GHQICHTXIPEQNP-VWNXMTODSA-N 2 0 371.484 4.094 20 0 FIADRP Clc1ccc(COCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000423021799 1096551893 /nfs/dbraw/zinc/55/18/93/1096551893.db2.gz CXHLGRLQGKECLJ-KBAYOESNSA-N 2 0 357.325 4.020 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@@H](C)CCCC[NH3+])on1 ZINC000423050760 1096565297 /nfs/dbraw/zinc/56/52/97/1096565297.db2.gz ZIKFYZGOTJDKCD-HNNXBMFYSA-N 2 0 353.466 4.111 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)ccn1 ZINC000423082034 1096567410 /nfs/dbraw/zinc/56/74/10/1096567410.db2.gz DSKPGLBXGZETAD-YTQUADARSA-N 2 0 355.457 4.023 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089871 1096571244 /nfs/dbraw/zinc/57/12/44/1096571244.db2.gz WETDCLKTZGYCIL-JAXLGGSGSA-N 2 0 352.453 4.049 20 0 FIADRP FC(F)(F)c1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCOCC2)c1 ZINC000423101171 1096575109 /nfs/dbraw/zinc/57/51/09/1096575109.db2.gz IFWYPPPNVHTHQT-SWDXFRIISA-N 2 0 368.443 4.046 20 0 FIADRP c1cc2cc(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2s1 ZINC000423120916 1096578445 /nfs/dbraw/zinc/57/84/45/1096578445.db2.gz HVDUCMGSXFNWKE-NQIIRXRSSA-N 2 0 350.487 4.247 20 0 FIADRP CCSc1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423129453 1096581491 /nfs/dbraw/zinc/58/14/91/1096581491.db2.gz LXLUFLNCBZEPBL-FPOVZHCZSA-N 2 0 354.519 4.144 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423113089 1096585668 /nfs/dbraw/zinc/58/56/68/1096585668.db2.gz YIVXSSRVGYSJLT-SZNDQCEHSA-N 2 0 373.928 4.321 20 0 FIADRP C[C@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@H]1C[NH3+] ZINC000414719004 1096588712 /nfs/dbraw/zinc/58/87/12/1096588712.db2.gz XENLKYXWYFLUOU-UWJYYQICSA-N 2 0 372.557 4.042 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000423139897 1096594590 /nfs/dbraw/zinc/59/45/90/1096594590.db2.gz WUECVEIMAVVRAA-SCLBCKFNSA-N 2 0 351.416 4.236 20 0 FIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000503932287 1096600191 /nfs/dbraw/zinc/60/01/91/1096600191.db2.gz XYOAQQKGZXVBFY-PEZBUJJGSA-N 2 0 370.459 4.151 20 0 FIADRP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423172908 1096602687 /nfs/dbraw/zinc/60/26/87/1096602687.db2.gz VXVHZQRNSJKUDA-UTQVJTIVSA-N 2 0 372.871 4.181 20 0 FIADRP CC[C@@H](C[N@H+](Cc1nccs1)[C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000414723835 1096615229 /nfs/dbraw/zinc/61/52/29/1096615229.db2.gz QNLWZIAEXPSEMJ-HKUYNNGSSA-N 2 0 355.551 4.281 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423220624 1096620448 /nfs/dbraw/zinc/62/04/48/1096620448.db2.gz YNCPBKVCNXVMTH-WDEREUQCSA-N 2 0 354.338 4.374 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423222141 1096622759 /nfs/dbraw/zinc/62/27/59/1096622759.db2.gz ZVNWLAHDLNGLHG-KBAYOESNSA-N 2 0 355.551 4.474 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cc(F)ccc2F)c1 ZINC000423247065 1096628593 /nfs/dbraw/zinc/62/85/93/1096628593.db2.gz KQMDBYUYLMXUKO-VBKZILBWSA-N 2 0 362.489 4.365 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000423291486 1096635638 /nfs/dbraw/zinc/63/56/38/1096635638.db2.gz IMECAIKMSBVCMK-APPDUMDISA-N 2 0 363.274 4.385 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Br)c1 ZINC000423291105 1096636154 /nfs/dbraw/zinc/63/61/54/1096636154.db2.gz GUHIXOAOLHSIJH-QWHCGFSZSA-N 2 0 363.299 4.328 20 0 FIADRP CCC([NH3+])(CC)C[NH2+][C@H](CCCOC)c1ccc(Br)cc1 ZINC000423289951 1096636174 /nfs/dbraw/zinc/63/61/74/1096636174.db2.gz YOZIDZKAUIYVRZ-MRXNPFEDSA-N 2 0 357.336 4.024 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000423293161 1096637082 /nfs/dbraw/zinc/63/70/82/1096637082.db2.gz QASAPGUGVSJZCA-QMTHXVAHSA-N 2 0 351.313 4.307 20 0 FIADRP C[C@@H]1C[C@@H](C[NH+]2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]1 ZINC000414731227 1096641607 /nfs/dbraw/zinc/64/16/07/1096641607.db2.gz AHLALPPYEAKRCO-CABCVRRESA-N 2 0 371.352 4.363 20 0 FIADRP CC1(C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]CC1 ZINC000423319688 1096642564 /nfs/dbraw/zinc/64/25/64/1096642564.db2.gz DRMFRHQYCVBXNW-INIZCTEOSA-N 2 0 359.514 4.306 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423317801 1096642584 /nfs/dbraw/zinc/64/25/84/1096642584.db2.gz AZOCICPYEOCOCG-LLVKDONJSA-N 2 0 368.344 4.271 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296174 1096644507 /nfs/dbraw/zinc/64/45/07/1096644507.db2.gz YNWNWOZDHINKDT-JKSUJKDBSA-N 2 0 354.498 4.087 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296171 1096644724 /nfs/dbraw/zinc/64/47/24/1096644724.db2.gz YNWNWOZDHINKDT-CVEARBPZSA-N 2 0 354.498 4.087 20 0 FIADRP CCOc1ccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423344108 1096646764 /nfs/dbraw/zinc/64/67/64/1096646764.db2.gz MPMWVPLDMRXDKM-OAQYLSRUSA-N 2 0 356.897 4.337 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2(C)CC[NH2+]CC2)CCC3)cc1 ZINC000423343811 1096652265 /nfs/dbraw/zinc/65/22/65/1096652265.db2.gz XGAUHSQKVMMLOZ-QGZVFWFLSA-N 2 0 371.550 4.175 20 0 FIADRP Clc1cc(Br)ccc1[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CC1 ZINC000423360625 1096656313 /nfs/dbraw/zinc/65/63/13/1096656313.db2.gz WGBZNXQKLIWPGJ-MRXNPFEDSA-N 2 0 355.707 4.063 20 0 FIADRP Brc1ccc([C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)s1 ZINC000423366630 1096657963 /nfs/dbraw/zinc/65/79/63/1096657963.db2.gz BXJJSPZBHXZLAV-KRWDZBQOSA-N 2 0 363.324 4.355 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(Br)cc1C(F)(F)F ZINC000423403263 1096672505 /nfs/dbraw/zinc/67/25/05/1096672505.db2.gz RYOBCOCJAQGUKX-PKFCDNJMSA-N 2 0 365.237 4.117 20 0 FIADRP Brc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407258 1096673318 /nfs/dbraw/zinc/67/33/18/1096673318.db2.gz ZPDFVJUXPFDNNG-LJQANCHMSA-N 2 0 357.295 4.220 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+][C@H](C)CCC[NH3+])nc1 ZINC000423450571 1096680571 /nfs/dbraw/zinc/68/05/71/1096680571.db2.gz HLXDOYVUKAQKSY-IIBYNOLFSA-N 2 0 359.945 4.168 20 0 FIADRP COCCC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423459925 1096689125 /nfs/dbraw/zinc/68/91/25/1096689125.db2.gz AJROLRBQIQFMEL-QGTPRVQTSA-N 2 0 369.347 4.024 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423478689 1096696830 /nfs/dbraw/zinc/69/68/30/1096696830.db2.gz UJWNTZZVOBVZEM-CVAIRZPRSA-N 2 0 360.448 4.485 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423480480 1096698514 /nfs/dbraw/zinc/69/85/14/1096698514.db2.gz NIXIPJJVEGICRN-FUHWJXTLSA-N 2 0 371.550 4.318 20 0 FIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000423509953 1096703443 /nfs/dbraw/zinc/70/34/43/1096703443.db2.gz RTGFKLOPWBBAKF-BEFAXECRSA-N 2 0 351.494 4.047 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000423496279 1096707369 /nfs/dbraw/zinc/70/73/69/1096707369.db2.gz GKCGSLBYHBVKSY-CCKFTAQKSA-N 2 0 359.311 4.256 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423511705 1096709734 /nfs/dbraw/zinc/70/97/34/1096709734.db2.gz NYFFTAXPPZNEEA-VHYCJAOWSA-N 3 0 365.565 4.499 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423516560 1096711120 /nfs/dbraw/zinc/71/11/20/1096711120.db2.gz YCDZXKSQPFEMGU-UWJYYQICSA-N 2 0 368.525 4.347 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccccc2)cc1 ZINC000423537612 1096715514 /nfs/dbraw/zinc/71/55/14/1096715514.db2.gz DICCHEUBKUMZOB-QEUVDIPISA-N 2 0 372.459 4.355 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccco2)cc1 ZINC000423546135 1096718145 /nfs/dbraw/zinc/71/81/45/1096718145.db2.gz YTUPWCWSYFXVJK-GOSISDBHSA-N 2 0 361.283 4.031 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423551856 1096720088 /nfs/dbraw/zinc/72/00/88/1096720088.db2.gz UKWUEWYCHUQTEF-LMWIJYBJSA-N 2 0 359.514 4.296 20 0 FIADRP C[C@@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000423574767 1096724343 /nfs/dbraw/zinc/72/43/43/1096724343.db2.gz PPHNTDWOTFGVTK-OAHLLOKOSA-N 2 0 363.958 4.046 20 0 FIADRP CN1CC[C@@H]([NH2+]Cc2ccc(-n3ccnc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000514694954 1098560311 /nfs/dbraw/zinc/56/03/11/1098560311.db2.gz UEMSTECGPXJRKX-NHCUHLMSSA-N 2 0 366.896 4.061 20 0 FIADRP C[C@@H](CCO)C1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCC1 ZINC000515439749 1098578944 /nfs/dbraw/zinc/57/89/44/1098578944.db2.gz LNMSXCCWYGTFNZ-KPQWGBOZSA-N 2 0 358.570 4.208 20 0 FIADRP FC(F)(F)COc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000533075674 1098741408 /nfs/dbraw/zinc/74/14/08/1098741408.db2.gz WZNJINPVDNNXRH-VQIMIIECSA-N 2 0 368.443 4.076 20 0 FIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000515702534 1098845789 /nfs/dbraw/zinc/84/57/89/1098845789.db2.gz NZVODVDQEJUBJE-FQEVSTJZSA-N 2 0 354.469 4.207 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000286138974 1098925687 /nfs/dbraw/zinc/92/56/87/1098925687.db2.gz OVYKHBXTWNZHMF-QFIPXVFZSA-N 2 0 367.537 4.227 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1cc(F)ccc1N1CC[NH+](C)CC1 ZINC001211994290 1099156888 /nfs/dbraw/zinc/15/68/88/1099156888.db2.gz QUQSTNMKQSOOED-UHFFFAOYSA-N 2 0 370.516 4.163 20 0 FIADRP Cc1ccncc1CCC[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000516116561 1099197256 /nfs/dbraw/zinc/19/72/56/1099197256.db2.gz NMGKSZLAUGERFB-HXUWFJFHSA-N 2 0 351.538 4.487 20 0 FIADRP COCCC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000287666105 1099325314 /nfs/dbraw/zinc/32/53/14/1099325314.db2.gz VPLXJKAJZMFPKG-HOJAQTOUSA-N 2 0 350.934 4.067 20 0 FIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccccc2OCc2cccnc2)CC1 ZINC000067691077 1099487575 /nfs/dbraw/zinc/48/75/75/1099487575.db2.gz XPRPJVQYWSCWTP-UHFFFAOYSA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OCc2cccnc2)C1 ZINC000067691521 1099488410 /nfs/dbraw/zinc/48/84/10/1099488410.db2.gz WFOUENVYBXFEOT-HXUWFJFHSA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@]1([NH3+])CCCC[C@H]1c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000261891736 1099674066 /nfs/dbraw/zinc/67/40/66/1099674066.db2.gz XNVZSNAXDMJZJD-GHTZIAJQSA-N 2 0 354.498 4.098 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(CC[NH2+]C)CC3)cs2)cc1 ZINC000261983777 1099684198 /nfs/dbraw/zinc/68/41/98/1099684198.db2.gz JFPPSPDXSQDBNF-UHFFFAOYSA-N 2 0 359.539 4.030 20 0 FIADRP CC1(C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC[NH2+]CC1 ZINC000414900184 1099756113 /nfs/dbraw/zinc/75/61/13/1099756113.db2.gz HXAQDZFPTSETPG-UHFFFAOYSA-N 2 0 371.912 4.072 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000162492350 1099809842 /nfs/dbraw/zinc/80/98/42/1099809842.db2.gz OSOMZHDTRIPGCA-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccccc1F ZINC000508692885 1099826963 /nfs/dbraw/zinc/82/69/63/1099826963.db2.gz BPZUNCCJIVRRJS-HBFSDRIKSA-N 2 0 356.485 4.093 20 0 FIADRP Cc1csc(CCCC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000508698581 1099830798 /nfs/dbraw/zinc/83/07/98/1099830798.db2.gz PFBMYGOQBZXOLX-AZUAARDMSA-N 2 0 357.567 4.274 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162554976 1099842356 /nfs/dbraw/zinc/84/23/56/1099842356.db2.gz ASJCPOMYGNAREV-OAHLLOKOSA-N 2 0 362.514 4.339 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2cccnc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508700789 1099855460 /nfs/dbraw/zinc/85/54/60/1099855460.db2.gz RJNFXKMFCMUMDV-XXBNENTESA-N 2 0 359.517 4.278 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1cccc(F)c1 ZINC000508702104 1099858593 /nfs/dbraw/zinc/85/85/93/1099858593.db2.gz YNXRTPFAKIXUMC-HBFSDRIKSA-N 2 0 356.485 4.093 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000516870694 1099899671 /nfs/dbraw/zinc/89/96/71/1099899671.db2.gz KVDJIISYHVGUIV-ICSRJNTNSA-N 2 0 364.574 4.275 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000508709810 1099900644 /nfs/dbraw/zinc/90/06/44/1099900644.db2.gz JOMTZMFQRRLSSA-RDPSFJRHSA-N 3 0 365.565 4.139 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508711065 1099903078 /nfs/dbraw/zinc/90/30/78/1099903078.db2.gz OBHACPIRMGCZSK-NNMXDRDESA-N 2 0 352.522 4.126 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2ccccc21 ZINC000516890981 1099912763 /nfs/dbraw/zinc/91/27/63/1099912763.db2.gz YGKHHFYYAWEJHJ-VXKWHMMOSA-N 2 0 367.537 4.386 20 0 FIADRP C[C@H](NC1CC[NH+](CC2CCCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508716219 1099913080 /nfs/dbraw/zinc/91/30/80/1099913080.db2.gz KIZRRCNBGQWJAJ-REWPJTCUSA-N 2 0 369.597 4.141 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000533776136 1099930240 /nfs/dbraw/zinc/93/02/40/1099930240.db2.gz QBBAAMGQBFVZEE-UHFFFAOYSA-N 2 0 367.415 4.134 20 0 FIADRP CO[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000508721165 1099939538 /nfs/dbraw/zinc/93/95/38/1099939538.db2.gz UANVVRIKQWTLBG-UCNVEGJOSA-N 2 0 356.485 4.013 20 0 FIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459401813 1100106506 /nfs/dbraw/zinc/10/65/06/1100106506.db2.gz YGHHOGIMOFJLIP-HNNXBMFYSA-N 2 0 363.427 4.290 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459402246 1100110675 /nfs/dbraw/zinc/11/06/75/1100110675.db2.gz FSTVUHVHANIWOL-QGZVFWFLSA-N 2 0 371.550 4.077 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459418706 1100145024 /nfs/dbraw/zinc/14/50/24/1100145024.db2.gz TZOGVAVNWDISTA-DEOSSOPVSA-N 2 0 373.500 4.438 20 0 FIADRP COc1ccccc1/C=C/CN(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536673994 1100161158 /nfs/dbraw/zinc/16/11/58/1100161158.db2.gz IZXRIRAWACNKRJ-HSRJRILOSA-N 2 0 350.506 4.162 20 0 FIADRP c1cc(N2CCC([NH2+]Cc3ccc(OC4CCCC4)cc3)CC2)cc[nH+]1 ZINC000459461116 1100206628 /nfs/dbraw/zinc/20/66/28/1100206628.db2.gz IKXJGJBACPECIM-UHFFFAOYSA-N 2 0 351.494 4.162 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc(Cl)c1O ZINC000459462305 1100206998 /nfs/dbraw/zinc/20/69/98/1100206998.db2.gz KUFXOCMCFVMZIA-GOEBONIOSA-N 2 0 366.933 4.187 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCc2ccc(F)cc21 ZINC000536713245 1100214678 /nfs/dbraw/zinc/21/46/78/1100214678.db2.gz MCZWFHSEWKMLTB-JOCHJYFZSA-N 2 0 353.485 4.447 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000379638035 1100235576 /nfs/dbraw/zinc/23/55/76/1100235576.db2.gz UEIVSIXSTBVIER-APWZRJJASA-N 2 0 358.913 4.491 20 0 FIADRP FC(F)(F)[C@@H](CC[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459595049 1100334659 /nfs/dbraw/zinc/33/46/59/1100334659.db2.gz SRBFKBQOHCMGQQ-IBGZPJMESA-N 2 0 363.427 4.376 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000536821012 1100338288 /nfs/dbraw/zinc/33/82/88/1100338288.db2.gz MGLYQUHIVZJHCU-OAHLLOKOSA-N 2 0 359.901 4.311 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000425939194 1100362569 /nfs/dbraw/zinc/36/25/69/1100362569.db2.gz ZDZXFOUBSIDOLJ-WIYYLYMNSA-N 2 0 357.929 4.340 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000536860362 1100376618 /nfs/dbraw/zinc/37/66/18/1100376618.db2.gz YZWLFHBEWJDTLU-BXWFABGCSA-N 2 0 370.484 4.218 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(OC(F)(F)F)c1 ZINC000536859452 1100376831 /nfs/dbraw/zinc/37/68/31/1100376831.db2.gz UYNXXYJSRUBJBP-BZUAXINKSA-N 2 0 374.447 4.125 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2Cl)[C@@H](C)C1 ZINC000536875012 1100397431 /nfs/dbraw/zinc/39/74/31/1100397431.db2.gz GPVBCVYDKCMWIM-MAUKXSAKSA-N 2 0 373.368 4.263 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]CC[C@@H]2CCOC2)c1 ZINC000438062338 1100404119 /nfs/dbraw/zinc/40/41/19/1100404119.db2.gz DCUXEXYGEJYTET-OAQYLSRUSA-N 2 0 364.533 4.466 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000536882438 1100407192 /nfs/dbraw/zinc/40/71/92/1100407192.db2.gz NOVHRVMDJDDCNS-HNNXBMFYSA-N 2 0 365.359 4.377 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000414921851 1100417548 /nfs/dbraw/zinc/41/75/48/1100417548.db2.gz FAJSFYGOSPRUCQ-ZNEWLNCYSA-N 2 0 361.533 4.146 20 0 FIADRP CN(Cc1cc2c(cccc2F)[nH]1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000438112014 1100437248 /nfs/dbraw/zinc/43/72/48/1100437248.db2.gz XYYRDBFXAAPAFS-GOSISDBHSA-N 2 0 351.469 4.261 20 0 FIADRP C[N@H+](CCCNCc1ccccc1OCc1ccncc1)C1CCCCC1 ZINC000517525256 1100452754 /nfs/dbraw/zinc/45/27/54/1100452754.db2.gz IPIHVNTYEPGCNR-UHFFFAOYSA-N 2 0 367.537 4.405 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)[C@@H](C)C1 ZINC000438189443 1100501383 /nfs/dbraw/zinc/50/13/83/1100501383.db2.gz KPGMLAPJYHKYJU-FCJDFRRUSA-N 2 0 358.570 4.223 20 0 FIADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccccc3C[N@@H+]3CC[C@H](O)C3)oc2c1 ZINC000426049729 1100716199 /nfs/dbraw/zinc/71/61/99/1100716199.db2.gz JWPSMBGIEFOEFI-UTKZUKDTSA-N 2 0 364.489 4.159 20 0 FIADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccccc3C[N@@H+]3CC[C@@H](O)C3)oc2c1 ZINC000426049726 1100716376 /nfs/dbraw/zinc/71/63/76/1100716376.db2.gz JWPSMBGIEFOEFI-DYESRHJHSA-N 2 0 364.489 4.159 20 0 FIADRP Cc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000517968730 1100838964 /nfs/dbraw/zinc/83/89/64/1100838964.db2.gz HJJVUKPKTQVCLH-HXUWFJFHSA-N 2 0 370.562 4.075 20 0 FIADRP Cc1noc(C2CCC([NH2+]C[C@@]3(C)CCCN3Cc3ccccc3)CC2)n1 ZINC000518045342 1100885445 /nfs/dbraw/zinc/88/54/45/1100885445.db2.gz ADQPMUPEZSPBEX-QETWGEEDSA-N 2 0 368.525 4.049 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC[NH2+]1 ZINC000414955339 1100925596 /nfs/dbraw/zinc/92/55/96/1100925596.db2.gz UCBTVDKIRBWRQE-QWHCGFSZSA-N 2 0 365.340 4.408 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1O ZINC000426159747 1100929883 /nfs/dbraw/zinc/92/98/83/1100929883.db2.gz IOMKZJIHUAIFEI-QGZVFWFLSA-N 2 0 360.542 4.109 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)C[C@H](C)c2cccc(Br)c2)CC1 ZINC000506381718 1100947308 /nfs/dbraw/zinc/94/73/08/1100947308.db2.gz OOFCYETZEVEHID-HNNXBMFYSA-N 2 0 353.348 4.357 20 0 FIADRP C[C@H](CCCO)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000438836877 1100955095 /nfs/dbraw/zinc/95/50/95/1100955095.db2.gz ORXWCCUVLFKORH-WIYYLYMNSA-N 2 0 350.522 4.130 20 0 FIADRP COc1ccc2c(c1)c(C[C@@H](C)[NH3+])cn2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167963748 1101203958 /nfs/dbraw/zinc/20/39/58/1101203958.db2.gz CGVYFFWRYURRSX-AZCLRUCKSA-N 2 0 367.537 4.118 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000426302858 1101236696 /nfs/dbraw/zinc/23/66/96/1101236696.db2.gz VGKSQWOEOSBDNV-HOJAQTOUSA-N 2 0 359.533 4.037 20 0 FIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000414989548 1101271642 /nfs/dbraw/zinc/27/16/42/1101271642.db2.gz HMWBEEWHFMAPSY-QCDJMGEHSA-N 2 0 353.491 4.162 20 0 FIADRP C[C@H](C[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1)CN1CC[NH+](C)CC1 ZINC000467383478 1101286788 /nfs/dbraw/zinc/28/67/88/1101286788.db2.gz TYVNWNUEQWRWPM-UTKZUKDTSA-N 2 0 363.977 4.044 20 0 FIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459722399 1101344514 /nfs/dbraw/zinc/34/45/14/1101344514.db2.gz BFZMZLRXHGOEMP-GOSISDBHSA-N 2 0 374.960 4.023 20 0 FIADRP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000537012763 1101393823 /nfs/dbraw/zinc/39/38/23/1101393823.db2.gz GFQJJGAWMNTMGF-HXUWFJFHSA-N 2 0 357.498 4.227 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000414999509 1101482455 /nfs/dbraw/zinc/48/24/55/1101482455.db2.gz JEIVHIOUXMTUSS-DOMZBBRYSA-N 2 0 369.456 4.436 20 0 FIADRP Cc1cccc(CC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000537160154 1101506308 /nfs/dbraw/zinc/50/63/08/1101506308.db2.gz DXCSDFXYWIGVHP-OAQYLSRUSA-N 2 0 350.506 4.115 20 0 FIADRP COc1cccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1OC(C)C ZINC000518763516 1101518940 /nfs/dbraw/zinc/51/89/40/1101518940.db2.gz RTFMRJUAGMCLAY-RTBURBONSA-N 2 0 362.558 4.330 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000518765630 1101522422 /nfs/dbraw/zinc/52/24/22/1101522422.db2.gz SBCFFXULRJIEEU-HOTGVXAUSA-N 2 0 358.448 4.085 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cc(C)c(C)cc2C)CC1 ZINC000518761384 1101532978 /nfs/dbraw/zinc/53/29/78/1101532978.db2.gz RABCQOLZVSSQMP-UHFFFAOYSA-N 2 0 365.565 4.039 20 0 FIADRP COc1cc(C[NH2+]CCC[N@H+](C)C(C)C)c(-c2ccccc2)cc1OC ZINC000518770539 1101548481 /nfs/dbraw/zinc/54/84/81/1101548481.db2.gz PHJYSWRUVRAKJK-UHFFFAOYSA-N 2 0 356.510 4.191 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2c(Cl)cccc2N2CCCC2)CC1 ZINC000537205213 1101559647 /nfs/dbraw/zinc/55/96/47/1101559647.db2.gz ARBFLELHYLKJKG-UHFFFAOYSA-N 2 0 363.977 4.492 20 0 FIADRP COc1ccc(CC2([NH3+])CC[NH+]([C@H](C)Cc3ccc(Cl)cc3)CC2)cc1 ZINC001168166086 1101768177 /nfs/dbraw/zinc/76/81/77/1101768177.db2.gz HFAGNTCGWZQECZ-QGZVFWFLSA-N 2 0 372.940 4.316 20 0 FIADRP COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1C(F)(F)F ZINC001167965343 1101830483 /nfs/dbraw/zinc/83/04/83/1101830483.db2.gz BPJICWDRTQYSBO-ALOPSCKCSA-N 2 0 368.443 4.209 20 0 FIADRP COc1cccc(CC2([NH3+])CC[NH+]([C@@H](C)Cc3ccc(Cl)cc3)CC2)c1 ZINC001168169174 1101850466 /nfs/dbraw/zinc/85/04/66/1101850466.db2.gz XLORNGCMMUNFPW-KRWDZBQOSA-N 2 0 372.940 4.316 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1OC ZINC000036804150 1102094618 /nfs/dbraw/zinc/09/46/18/1102094618.db2.gz VRBQOIFJBOVIQS-CQSZACIVSA-N 2 0 357.336 4.058 20 0 FIADRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000120988840 1102301234 /nfs/dbraw/zinc/30/12/34/1102301234.db2.gz DLQHWWHFQTXCHK-VQTJNVASSA-N 2 0 367.537 4.013 20 0 FIADRP C[C@@H]1C[C@H](NC[C@H](c2ccco2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000532441724 1102329528 /nfs/dbraw/zinc/32/95/28/1102329528.db2.gz FHAKPWRZKLRPMI-CEMLEFRQSA-N 2 0 367.537 4.059 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3cc(-c4ccccc4)cs3)CC2)C1 ZINC000415126454 1102366031 /nfs/dbraw/zinc/36/60/31/1102366031.db2.gz PIHLSDQPBDHFTL-CTNGQTDRSA-N 2 0 356.535 4.133 20 0 FIADRP c1ccc(N2CCCCC2)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167971537 1102452577 /nfs/dbraw/zinc/45/25/77/1102452577.db2.gz XMHNHMWPFOFCHJ-FRIKZZABSA-N 2 0 353.554 4.172 20 0 FIADRP Fc1ccc(C(F)(F)F)cc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167971563 1102464883 /nfs/dbraw/zinc/46/48/83/1102464883.db2.gz YPWWFZONEMCWIM-AYHJJNSGSA-N 2 0 370.434 4.382 20 0 FIADRP CC1CCC([NH+]2CCC3(C[C@@H]([N@H+](C)Cc4cccs4)CO3)CC2)CC1 ZINC001168212879 1102490057 /nfs/dbraw/zinc/49/00/57/1102490057.db2.gz SVALUDBSRCKIHP-CTWPCTMYSA-N 2 0 362.583 4.382 20 0 FIADRP [NH3+][C@H]1CCc2c3cc(F)ccc3n(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2C1 ZINC001167974336 1102546717 /nfs/dbraw/zinc/54/67/17/1102546717.db2.gz WQOUAUMHGAVTIU-HTUJPFKRSA-N 2 0 367.512 4.174 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2ccsc2S1 ZINC000122318349 1102565516 /nfs/dbraw/zinc/56/55/16/1102565516.db2.gz FZZPTQYNBFFXLH-WMLDXEAASA-N 2 0 362.564 4.404 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(OC(F)F)cc1 ZINC000122384229 1102569980 /nfs/dbraw/zinc/56/99/80/1102569980.db2.gz UGDALJKCBGDYCB-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(NC(=O)N(CC)CC)cc2)CC1 ZINC000122644254 1102603266 /nfs/dbraw/zinc/60/32/66/1102603266.db2.gz WKQZHZCUHYGEHV-SFHVURJKSA-N 2 0 374.573 4.333 20 0 FIADRP CC(C)c1ccc(CC[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1 ZINC000122866667 1102621493 /nfs/dbraw/zinc/62/14/93/1102621493.db2.gz UTEDOGTVYQGEKC-UHFFFAOYSA-N 2 0 366.549 4.099 20 0 FIADRP COc1ccccc1CC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC1 ZINC001167975554 1102650105 /nfs/dbraw/zinc/65/01/05/1102650105.db2.gz SATDATPQGBIMCJ-SEJPIABJSA-N 2 0 354.538 4.155 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Br)cc3Cl)CC2)CC[N@@H+]1C ZINC000550882926 1102652892 /nfs/dbraw/zinc/65/28/92/1102652892.db2.gz RTCGIYPVRHRIOI-OCCSQVGLSA-N 2 0 371.750 4.206 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)ccn1 ZINC000550886301 1102658518 /nfs/dbraw/zinc/65/85/18/1102658518.db2.gz GUSWWWNTEQTLHE-ZWKOTPCHSA-N 2 0 353.510 4.173 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)CC1 ZINC000550920878 1102693916 /nfs/dbraw/zinc/69/39/16/1102693916.db2.gz KNXFAHPULJPWOS-HOIMLPCSSA-N 2 0 368.565 4.367 20 0 FIADRP C[C@@H](c1cnccn1)[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837032 1102696928 /nfs/dbraw/zinc/69/69/28/1102696928.db2.gz YYANQLCFTMVPCB-AVRDEDQJSA-N 2 0 364.537 4.160 20 0 FIADRP CC1(NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC[NH+](Cc2ccccc2)CC1 ZINC001167979255 1102739353 /nfs/dbraw/zinc/73/93/53/1102739353.db2.gz YLZHTRZWOBTTML-NOTZXAQLSA-N 2 0 367.581 4.036 20 0 FIADRP FC(F)(F)c1ccc(-c2nc(C[NH2+][C@@H]3CC34CC[NH2+]CC4)cs2)cc1 ZINC000666954019 1102760877 /nfs/dbraw/zinc/76/08/77/1102760877.db2.gz NTRWQXHNUUTGPT-OAHLLOKOSA-N 2 0 367.440 4.061 20 0 FIADRP OC1(c2ccc(Cl)cc2)CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167981627 1102783985 /nfs/dbraw/zinc/78/39/85/1102783985.db2.gz CBJDXCVDTDTWMT-WCRBZPEASA-N 2 0 374.956 4.029 20 0 FIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCOC(c3ccccc3)c3ccccc3)C2)C1 ZINC000550238344 1102802740 /nfs/dbraw/zinc/80/27/40/1102802740.db2.gz BIZWHSQATQLKRP-XMMPIXPASA-N 2 0 364.533 4.210 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)CCC2 ZINC000359892370 1102900730 /nfs/dbraw/zinc/90/07/30/1102900730.db2.gz BGIUMOSVYZZDAZ-KBXCAEBGSA-N 2 0 359.539 4.120 20 0 FIADRP CN1CC[C@H]([NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@@H]1c1ccccc1 ZINC000551086693 1102905649 /nfs/dbraw/zinc/90/56/49/1102905649.db2.gz ARNFEWTYCMDCBO-NSKBAKJYSA-N 2 0 372.553 4.312 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(OC)c2OC(F)F)CC1 ZINC000506868194 1102919399 /nfs/dbraw/zinc/91/93/99/1102919399.db2.gz QWFAOHSLNNCQAJ-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133011396 1102928320 /nfs/dbraw/zinc/92/83/20/1102928320.db2.gz SHGOWHAWPXISPN-ROUUACIJSA-N 2 0 362.583 4.339 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccc(C)cc2)CC1 ZINC000506932916 1102967886 /nfs/dbraw/zinc/96/78/86/1102967886.db2.gz UETJCRNQQHZRDF-UHFFFAOYSA-N 2 0 354.542 4.329 20 0 FIADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551263643 1103023632 /nfs/dbraw/zinc/02/36/32/1103023632.db2.gz DDUREAVJZFVRRR-SIKLNZKXSA-N 2 0 356.554 4.084 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)ccn1 ZINC000551288674 1103048332 /nfs/dbraw/zinc/04/83/32/1103048332.db2.gz UWGFAMSFTCUGLW-QGZVFWFLSA-N 2 0 365.477 4.166 20 0 FIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[C@@H](O)Cc1ccccc1 ZINC000551316882 1103074284 /nfs/dbraw/zinc/07/42/84/1103074284.db2.gz NVQNQYWHZUNPAX-RFRZSCIPSA-N 2 0 366.549 4.011 20 0 FIADRP C[C@@H](Cn1ccnc1)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000532828642 1103244678 /nfs/dbraw/zinc/24/46/78/1103244678.db2.gz MVTKQCVMGBPBDD-NSHDSACASA-N 2 0 367.305 4.492 20 0 FIADRP COc1cccc(C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc2)c1 ZINC000507425349 1103377953 /nfs/dbraw/zinc/37/79/53/1103377953.db2.gz VSCVUWBIAYQRIL-QFIPXVFZSA-N 2 0 352.522 4.301 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccc(F)cc2)cc1 ZINC000507428968 1103381468 /nfs/dbraw/zinc/38/14/68/1103381468.db2.gz MMGFOLLBXPNYCZ-NRFANRHFSA-N 2 0 356.485 4.245 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000551575758 1103387202 /nfs/dbraw/zinc/38/72/02/1103387202.db2.gz NLLJTKCTAMXHBW-SFHVURJKSA-N 2 0 371.956 4.123 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@H]1CCC[NH2+]CC1)C1CCCCC1 ZINC000427291208 1103415980 /nfs/dbraw/zinc/41/59/80/1103415980.db2.gz ZERCNRCUMQKXAS-SFHVURJKSA-N 2 0 357.542 4.169 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)CCO1 ZINC000507484044 1103430595 /nfs/dbraw/zinc/43/05/95/1103430595.db2.gz IRXKAQYCTOCPCH-GNJRFXKQSA-N 2 0 356.554 4.080 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000507537004 1103460291 /nfs/dbraw/zinc/46/02/91/1103460291.db2.gz XPBMKPDWFPCIJO-SFHVURJKSA-N 2 0 367.537 4.215 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1Cl ZINC000551778471 1103624181 /nfs/dbraw/zinc/62/41/81/1103624181.db2.gz ITGDRIZJWDDVMX-SJORKVTESA-N 2 0 368.949 4.279 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccnc1 ZINC000551816764 1103699333 /nfs/dbraw/zinc/69/93/33/1103699333.db2.gz KJPDMWCPALYWOV-QFIPXVFZSA-N 2 0 353.510 4.042 20 0 FIADRP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000188037531 1103783878 /nfs/dbraw/zinc/78/38/78/1103783878.db2.gz CWFHNLLFRMTANF-XXBNENTESA-N 2 0 356.554 4.317 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(CC)(CC)c2ccc(OC)c(OC)c2)[C@H](C)C1 ZINC000461081809 1104081902 /nfs/dbraw/zinc/08/19/02/1104081902.db2.gz BOIFXYPHOITUCJ-IEBWSBKVSA-N 2 0 362.558 4.082 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cn(C)nc2C(C)(C)C)CC1 ZINC000538305433 1104126419 /nfs/dbraw/zinc/12/64/19/1104126419.db2.gz SZOYQYMZUJKQME-GOSISDBHSA-N 2 0 360.590 4.194 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000520203315 1104170779 /nfs/dbraw/zinc/17/07/79/1104170779.db2.gz XCSBFXJNZTXZOZ-ROUUACIJSA-N 2 0 362.521 4.331 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000520205051 1104171309 /nfs/dbraw/zinc/17/13/09/1104171309.db2.gz QYSKMRGMVFLBLH-HNNXBMFYSA-N 2 0 369.347 4.202 20 0 FIADRP c1cc2c(cc1C[NH+]1CCC(c3nc4c(s3)CCCC4)CC1)C[NH2+]CC2 ZINC000520239974 1104193785 /nfs/dbraw/zinc/19/37/85/1104193785.db2.gz DZNNEJSYIATKIP-UHFFFAOYSA-N 2 0 367.562 4.047 20 0 FIADRP COC1(c2ccccc2)CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167994399 1104491007 /nfs/dbraw/zinc/49/10/07/1104491007.db2.gz CNIMYOGHRWQUSK-CBQGHPETSA-N 2 0 354.538 4.030 20 0 FIADRP COc1ccccc1C1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167994481 1104491186 /nfs/dbraw/zinc/49/11/86/1104491186.db2.gz GDRFJNGTEIIHBZ-WCRBZPEASA-N 2 0 354.538 4.280 20 0 FIADRP Cc1cc(F)cc(C[NH+]2CCC3(CC2)C[N@H+](Cc2ccccc2)CCO3)c1 ZINC001143586473 1105013782 /nfs/dbraw/zinc/01/37/82/1105013782.db2.gz NWRMHASTTDXTIC-UHFFFAOYSA-N 2 0 368.496 4.001 20 0 FIADRP COc1ccc(C[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001168004217 1105027752 /nfs/dbraw/zinc/02/77/52/1105027752.db2.gz RRGSYKYVSLLVTF-JYEDNEFCSA-N 2 0 368.565 4.355 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152394483 1105075526 /nfs/dbraw/zinc/07/55/26/1105075526.db2.gz QEVKVYHOLCHCOX-CRAIPNDOSA-N 2 0 353.535 4.261 20 0 FIADRP COc1cccc(OCC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168007400 1105132715 /nfs/dbraw/zinc/13/27/15/1105132715.db2.gz AMEKNBQKESNUFG-RTBURBONSA-N 2 0 368.521 4.105 20 0 FIADRP C[C@H]1CC([N@H+](CCC[NH3+])C2CCCCC2)C[C@H](C)N1Cc1ccccc1 ZINC001168008001 1105151563 /nfs/dbraw/zinc/15/15/63/1105151563.db2.gz CBOQXHDJVIYEQE-PMACEKPBSA-N 2 0 357.586 4.412 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H](CCO)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168009145 1105208016 /nfs/dbraw/zinc/20/80/16/1105208016.db2.gz HAKOLKNKABZTPB-YDLSIGKMSA-N 2 0 352.522 4.141 20 0 FIADRP Clc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)C1 ZINC000665234009 1105227493 /nfs/dbraw/zinc/22/74/93/1105227493.db2.gz VNRZJFRYTGJECL-LCLWPZTBSA-N 2 0 361.961 4.067 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000507874307 1105251937 /nfs/dbraw/zinc/25/19/37/1105251937.db2.gz CFJCIQVSJQXEFJ-UHFFFAOYSA-N 2 0 372.553 4.273 20 0 FIADRP CCOC(=O)[C@@H]1CCCC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168064981 1106886092 /nfs/dbraw/zinc/88/60/92/1106886092.db2.gz TWJZFLFPKJVHDT-SFHLNBCPSA-N 2 0 372.553 4.093 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC(C)C ZINC000192922106 1106902984 /nfs/dbraw/zinc/90/29/84/1106902984.db2.gz XLXKIASPKRYCHT-OAQYLSRUSA-N 2 0 368.521 4.094 20 0 FIADRP C[NH+](C)C[C@H](N[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000530227498 1106915887 /nfs/dbraw/zinc/91/58/87/1106915887.db2.gz YIIOKMROTDVRQC-QYZOEREBSA-N 2 0 364.320 4.331 20 0 FIADRP Clc1c2ccccc2sc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530239960 1106922309 /nfs/dbraw/zinc/92/23/09/1106922309.db2.gz JHFCUWPFZKQWTL-HNNXBMFYSA-N 2 0 364.942 4.145 20 0 FIADRP C[C@@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530241452 1106923270 /nfs/dbraw/zinc/92/32/70/1106923270.db2.gz PYMVBWRJEYAYQM-XJKSGUPXSA-N 2 0 357.325 4.145 20 0 FIADRP C[C@H]([NH2+]CCc1ccccc1OC(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530513405 1107105694 /nfs/dbraw/zinc/10/56/94/1107105694.db2.gz WAZSFDIVKLHGFQ-FXAWDEMLSA-N 2 0 374.475 4.331 20 0 FIADRP CCc1c(C)[nH+]c2ccccc2c1NC1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000302043163 1107274598 /nfs/dbraw/zinc/27/45/98/1107274598.db2.gz OJAXMEKMWJMLSA-QGZVFWFLSA-N 2 0 353.510 4.018 20 0 FIADRP CC(C[NH+]1CCC[C@]2(CCSC2)C1)C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000451980251 1107411696 /nfs/dbraw/zinc/41/16/96/1107411696.db2.gz QXCVPTKGQGGVFZ-PMACEKPBSA-N 2 0 368.656 4.061 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[N@@H+]1C ZINC000152434127 1107423938 /nfs/dbraw/zinc/42/39/38/1107423938.db2.gz BLFCHZNKVUXLLN-HOCLYGCPSA-N 2 0 371.352 4.114 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@H](c1cccs1)C1(CO)CCC1 ZINC000452058533 1107454552 /nfs/dbraw/zinc/45/45/52/1107454552.db2.gz ITCVJCNZCSTOBM-HXUWFJFHSA-N 2 0 367.518 4.236 20 0 FIADRP C[C@@H](C[NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Br)c1 ZINC000475566001 1107752972 /nfs/dbraw/zinc/75/29/72/1107752972.db2.gz GACHJSOBUXUIQW-NNGSBXSVSA-N 2 0 351.332 4.159 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1OCc1ccccc1 ZINC000531389923 1107842326 /nfs/dbraw/zinc/84/23/26/1107842326.db2.gz XTHAOBUTPZRSHP-SFTDATJTSA-N 2 0 368.521 4.237 20 0 FIADRP CCc1nc(C)c(CN2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)o1 ZINC000428366703 1107899417 /nfs/dbraw/zinc/89/94/17/1107899417.db2.gz YWLBLOUMVNMRIY-UXHICEINSA-N 2 0 353.510 4.032 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1cnc2ccccc2c1)C1CC[NH+](C)CC1 ZINC000531596071 1108011603 /nfs/dbraw/zinc/01/16/03/1108011603.db2.gz DBMHFCITZKKCNH-UHFFFAOYSA-N 2 0 374.532 4.055 20 0 FIADRP CCOC[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000531691764 1108054261 /nfs/dbraw/zinc/05/42/61/1108054261.db2.gz ULPWCGNYOPXRAZ-LJQANCHMSA-N 2 0 352.522 4.464 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CCC[NH+]2CCCC2)c2ccc(OC)cc2)cc1 ZINC000531688720 1108056261 /nfs/dbraw/zinc/05/62/61/1108056261.db2.gz BQGFTKYFGXYHFD-QHCPKHFHSA-N 2 0 368.521 4.063 20 0 FIADRP FC(F)(F)C[C@H]1CC[N@H+](C/C=C/C[NH+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000444689650 1108093498 /nfs/dbraw/zinc/09/34/98/1108093498.db2.gz GPEXYPOOJRBXIA-CZMZKRSCSA-N 2 0 358.370 4.091 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000531692676 1108097035 /nfs/dbraw/zinc/09/70/35/1108097035.db2.gz UYQISVUJHXRHEM-HJNYFJLDSA-N 2 0 373.585 4.439 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cccc(N2CCCC2=O)c1 ZINC000531717860 1108111026 /nfs/dbraw/zinc/11/10/26/1108111026.db2.gz FEYAIGKNMUECQU-IBGZPJMESA-N 2 0 357.542 4.120 20 0 FIADRP C[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453065185 1108142703 /nfs/dbraw/zinc/14/27/03/1108142703.db2.gz SSZYWPDHFTUTAN-QGZVFWFLSA-N 2 0 351.494 4.399 20 0 FIADRP CCn1ccnc1[C@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000453109309 1108176344 /nfs/dbraw/zinc/17/63/44/1108176344.db2.gz MEZABQSQRGHPQN-FQEVSTJZSA-N 2 0 368.569 4.289 20 0 FIADRP c1csc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)n1 ZINC000453144448 1108195323 /nfs/dbraw/zinc/19/53/23/1108195323.db2.gz MNIXZEQBXUHGPH-UFYCRDLUSA-N 2 0 355.551 4.109 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453164091 1108234992 /nfs/dbraw/zinc/23/49/92/1108234992.db2.gz QQDZWZGEDVSFGY-PWRODBHTSA-N 2 0 362.945 4.149 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453235433 1108308877 /nfs/dbraw/zinc/30/88/77/1108308877.db2.gz ZTCVVJMWVICFGY-QGZVFWFLSA-N 2 0 351.494 4.399 20 0 FIADRP CC(C)c1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)cc1 ZINC000531932863 1108402199 /nfs/dbraw/zinc/40/21/99/1108402199.db2.gz MSEUYPSOUGGJJK-WMZHIEFXSA-N 2 0 351.538 4.248 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccccc1C[NH+](C)C1CCCCC1 ZINC000531939140 1108415773 /nfs/dbraw/zinc/41/57/73/1108415773.db2.gz XOKDIVRYBJYSGO-MSYCTHLASA-N 3 0 357.586 4.269 20 0 FIADRP Cc1c([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cnn1-c1cccc(Cl)c1 ZINC000453338417 1108432405 /nfs/dbraw/zinc/43/24/05/1108432405.db2.gz FXQXOPWIKYAIAB-DXJOGWAWSA-N 2 0 358.917 4.110 20 0 FIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(F)cc(Br)c1 ZINC000453355042 1108456050 /nfs/dbraw/zinc/45/60/50/1108456050.db2.gz OMFHVRRDOIQAFV-NPYXIHBLSA-N 2 0 355.295 4.254 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCCOc2ccc(Br)cc21)C1CC1 ZINC000453386110 1108472089 /nfs/dbraw/zinc/47/20/89/1108472089.db2.gz AAASRRDEYDHDCO-QGZVFWFLSA-N 2 0 367.331 4.127 20 0 FIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000531971171 1108482228 /nfs/dbraw/zinc/48/22/28/1108482228.db2.gz BOLJYRRHCXNJMN-UZUQRXQVSA-N 2 0 368.496 4.323 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000453375705 1108494260 /nfs/dbraw/zinc/49/42/60/1108494260.db2.gz JOWKULUXIDTLDI-ILZDJORESA-N 2 0 374.550 4.259 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(Cl)s2)CC1 ZINC000532042131 1108580072 /nfs/dbraw/zinc/58/00/72/1108580072.db2.gz UXUNKLPCUZGJIP-UHFFFAOYSA-N 2 0 363.958 4.223 20 0 FIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453590771 1108647694 /nfs/dbraw/zinc/64/76/94/1108647694.db2.gz BFVSYKVPFYGTIG-UHFFFAOYSA-N 2 0 374.960 4.166 20 0 FIADRP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446889433 1109378558 /nfs/dbraw/zinc/37/85/58/1109378558.db2.gz WYTRQNQZGFFNGU-ZRHASKPBSA-N 2 0 356.554 4.427 20 0 FIADRP Clc1sc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Br ZINC000446884964 1109382137 /nfs/dbraw/zinc/38/21/37/1109382137.db2.gz SKUPMZGNJQHZIG-UHFFFAOYSA-N 2 0 363.752 4.128 20 0 FIADRP CCC1(C[NH2+][C@@H](C)c2nccnc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000446924580 1109390731 /nfs/dbraw/zinc/39/07/31/1109390731.db2.gz HSHWKAQMBUYYFO-IBGZPJMESA-N 2 0 352.526 4.128 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@H](C)c3cccc4ccccc43)C2)CC1 ZINC000525779468 1109515785 /nfs/dbraw/zinc/51/57/85/1109515785.db2.gz RRDRXWIPBGAYKG-CTNGQTDRSA-N 2 0 351.538 4.001 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000525869926 1109547329 /nfs/dbraw/zinc/54/73/29/1109547329.db2.gz XCVPVLJGVWQTQO-UWVAXJGDSA-N 2 0 352.950 4.170 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccsc1 ZINC000447546303 1109574929 /nfs/dbraw/zinc/57/49/29/1109574929.db2.gz USWDOJDHIOLLCA-LRSLUSHPSA-N 2 0 369.578 4.136 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cnn1-c1cc(C)ccc1C ZINC000447568540 1109576498 /nfs/dbraw/zinc/57/64/98/1109576498.db2.gz KHYPTGFKKJEFJX-GOSISDBHSA-N 2 0 366.553 4.323 20 0 FIADRP Cc1cc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccnc2)ccc1F ZINC000447556972 1109579697 /nfs/dbraw/zinc/57/96/97/1109579697.db2.gz ILEXMWXDWGTVJG-JOCHJYFZSA-N 2 0 353.485 4.083 20 0 FIADRP Fc1cc(Br)cc2c1CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447565869 1109584247 /nfs/dbraw/zinc/58/42/47/1109584247.db2.gz OIJBITFPZGHAQH-SFHVURJKSA-N 2 0 367.306 4.040 20 0 FIADRP FC(F)(F)CSCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447586844 1109587542 /nfs/dbraw/zinc/58/75/42/1109587542.db2.gz PCRDSMLABVWCND-BJWYYQGGSA-N 2 0 358.473 4.067 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+]Cc3ccc(C(F)F)cc3)c2)CCO1 ZINC000526038173 1109597355 /nfs/dbraw/zinc/59/73/55/1109597355.db2.gz VGOIISFOSXVFAF-INIZCTEOSA-N 2 0 360.448 4.135 20 0 FIADRP C[C@@H](C[NH+]1CCCCCC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447608319 1109601344 /nfs/dbraw/zinc/60/13/44/1109601344.db2.gz VCHTZRKNOSJPNO-XXTHSBEZSA-N 2 0 355.570 4.036 20 0 FIADRP COC[C@H](C)C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000527116292 1109698939 /nfs/dbraw/zinc/69/89/39/1109698939.db2.gz NVKYSEGCUYGJEO-LJQANCHMSA-N 2 0 352.522 4.322 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000527222463 1109716562 /nfs/dbraw/zinc/71/65/62/1109716562.db2.gz XGXLRSTVNSSIFK-BJKOFHAPSA-N 2 0 365.565 4.005 20 0 FIADRP COc1cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cc(C(F)(F)F)c1 ZINC000527635635 1109791034 /nfs/dbraw/zinc/79/10/34/1109791034.db2.gz ZDRNQSKUMUIVJY-UHFFFAOYSA-N 2 0 352.400 4.065 20 0 FIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000527852929 1109838979 /nfs/dbraw/zinc/83/89/79/1109838979.db2.gz PKYYSBQDQUYXCO-RBUKOAKNSA-N 2 0 366.553 4.198 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)OC)c1 ZINC000527921009 1109856071 /nfs/dbraw/zinc/85/60/71/1109856071.db2.gz PPARYOWNHPMQPH-AGHHOFFYSA-N 2 0 360.542 4.015 20 0 FIADRP C[C@@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)c1cc(F)cc(F)c1 ZINC000449014884 1109954206 /nfs/dbraw/zinc/95/42/06/1109954206.db2.gz AKAFNUQDDBNVHX-KRWDZBQOSA-N 2 0 373.491 4.102 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(CCc3ccccc3)s2)CC1 ZINC000449013587 1109954405 /nfs/dbraw/zinc/95/44/05/1109954405.db2.gz DHPWGSWCIVEXJX-UHFFFAOYSA-N 2 0 357.567 4.092 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(CCc3ccccc3)s2)[C@H](C)C1 ZINC000449028947 1109959657 /nfs/dbraw/zinc/95/96/57/1109959657.db2.gz NHULIUGHTDNGAC-YLJYHZDGSA-N 2 0 357.567 4.090 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnc(CCc3ccccc3)s2)cc1 ZINC000449063686 1109965376 /nfs/dbraw/zinc/96/53/76/1109965376.db2.gz QRFGVXXUPLGLHR-UHFFFAOYSA-N 2 0 365.546 4.280 20 0 FIADRP CO[C@H](C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000449085146 1109970548 /nfs/dbraw/zinc/97/05/48/1109970548.db2.gz KRBKWKMZQMYYMF-AUSIDOKSSA-N 2 0 352.522 4.059 20 0 FIADRP CCc1nc(CC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)sc1C ZINC000449117666 1109979887 /nfs/dbraw/zinc/97/98/87/1109979887.db2.gz VLZVVULMEFMUBW-KRWDZBQOSA-N 2 0 371.594 4.242 20 0 FIADRP C[C@@H](Cc1cccc(O)c1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449131752 1109982272 /nfs/dbraw/zinc/98/22/72/1109982272.db2.gz PHNHNRJLVFYEGJ-OALUTQOASA-N 2 0 352.522 4.008 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449131620 1109982536 /nfs/dbraw/zinc/98/25/36/1109982536.db2.gz OIXQRUYDMCKXJZ-MOPGFXCFSA-N 2 0 352.522 4.008 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1 ZINC000449184202 1109994001 /nfs/dbraw/zinc/99/40/01/1109994001.db2.gz DLBDBQIDDYIDGK-ZEQRLZLVSA-N 2 0 364.533 4.129 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]Cc2cnc(CCc3ccccc3)s2)CC1 ZINC000449198400 1109997387 /nfs/dbraw/zinc/99/73/87/1109997387.db2.gz BLRXJAXXSXLAHE-UHFFFAOYSA-N 2 0 357.567 4.138 20 0 FIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CC1 ZINC000449235171 1109998757 /nfs/dbraw/zinc/99/87/57/1109998757.db2.gz FIDIJIMBPOUJCR-RZFJCUDFSA-N 2 0 358.570 4.267 20 0 FIADRP c1cc(C[NH2+]Cc2ccc3c(c2)OCCCCO3)cc(C[NH+]2CCCC2)c1 ZINC000449217910 1109999704 /nfs/dbraw/zinc/99/97/04/1109999704.db2.gz CRLXQTLABVECLJ-UHFFFAOYSA-N 2 0 366.505 4.124 20 0 FIADRP C[C@@H](CCO)C1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCC1 ZINC000449255010 1110007176 /nfs/dbraw/zinc/00/71/76/1110007176.db2.gz ZINFJFPLQRYKOR-SFHVURJKSA-N 2 0 352.607 4.444 20 0 FIADRP Clc1cccnc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000528510664 1110012381 /nfs/dbraw/zinc/01/23/81/1110012381.db2.gz BWOFCNJLEGZIRP-UHFFFAOYSA-N 2 0 355.913 4.223 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000449308490 1110022832 /nfs/dbraw/zinc/02/28/32/1110022832.db2.gz XPPOQNGNFRAMKM-PWIZWCRZSA-N 2 0 366.496 4.222 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)cc1)C(F)(F)F ZINC000450599898 1110318303 /nfs/dbraw/zinc/31/83/03/1110318303.db2.gz LXSCPGWJCAMUJQ-GRGSLBFTSA-N 2 0 370.459 4.036 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCc1cccs1)c1ccccc1O2 ZINC000538307069 1111087652 /nfs/dbraw/zinc/08/76/52/1111087652.db2.gz SIOMOZJEKGWXFN-IBGZPJMESA-N 2 0 356.535 4.259 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000538410878 1111130272 /nfs/dbraw/zinc/13/02/72/1111130272.db2.gz LHXIRIGBCSCLII-TZIWHRDSSA-N 2 0 374.532 4.420 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)Nc2ccc(F)cc2)c1 ZINC000539071347 1111418739 /nfs/dbraw/zinc/41/87/39/1111418739.db2.gz JJUGFANQRVKMOZ-KRWDZBQOSA-N 2 0 371.500 4.173 20 0 FIADRP CC(C)CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccoc1 ZINC000552033604 1111451211 /nfs/dbraw/zinc/45/12/11/1111451211.db2.gz KKUFDBJWUUESBM-QHCPKHFHSA-N 2 0 369.553 4.294 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159282 1111455476 /nfs/dbraw/zinc/45/54/76/1111455476.db2.gz NQRIOTYOEHKUDX-OXJNMPFZSA-N 2 0 359.514 4.332 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3SCCc4ccccc43)CC2)cc1 ZINC000462113673 1111501956 /nfs/dbraw/zinc/50/19/56/1111501956.db2.gz UICPFRXQPKKGCZ-QHCPKHFHSA-N 2 0 366.574 4.314 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)[C@@H](C)C1 ZINC000477855782 1111579237 /nfs/dbraw/zinc/57/92/37/1111579237.db2.gz IUSUUQNLMCZSAM-LRDDRELGSA-N 2 0 354.325 4.337 20 0 FIADRP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C[C@@H]4CCC5(CCCC5)O4)C3)C2)cc1 ZINC000552156933 1111596077 /nfs/dbraw/zinc/59/60/77/1111596077.db2.gz CJWDRZLQARPWLJ-VXKWHMMOSA-N 2 0 354.538 4.076 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000477930992 1111605901 /nfs/dbraw/zinc/60/59/01/1111605901.db2.gz BWUPZKQLKROGHO-OTUUDDROSA-N 2 0 364.533 4.264 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000552338233 1111678871 /nfs/dbraw/zinc/67/88/71/1111678871.db2.gz BSSSJJRBSPYJSX-OKZBNKHCSA-N 2 0 352.444 4.219 20 0 FIADRP CC1(C)CC(N[C@H]2CCCc3nn(-c4ccccc4)cc32)CC(C)(C)[NH2+]1 ZINC000479327785 1111993500 /nfs/dbraw/zinc/99/35/00/1111993500.db2.gz RJDJWGBRMWQNKH-IBGZPJMESA-N 2 0 352.526 4.149 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479364415 1112007391 /nfs/dbraw/zinc/00/73/91/1112007391.db2.gz RVYYQXGAYCQUJK-RXVVDRJESA-N 2 0 354.542 4.350 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000479464292 1112034665 /nfs/dbraw/zinc/03/46/65/1112034665.db2.gz LPCSBUDWUKUGQD-FPOVZHCZSA-N 2 0 360.505 4.045 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(F)cc3)C2)[C@@H](C)C1 ZINC000479492963 1112045897 /nfs/dbraw/zinc/04/58/97/1112045897.db2.gz XVPMDDDAEUZGEF-BZNRXQDOSA-N 2 0 362.533 4.188 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000479547085 1112065177 /nfs/dbraw/zinc/06/51/77/1112065177.db2.gz APHWUFLCDWDFQA-HNNXBMFYSA-N 2 0 369.347 4.059 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000479872168 1112171536 /nfs/dbraw/zinc/17/15/36/1112171536.db2.gz HIVWGHGDCGTGNS-MSOLQXFVSA-N 2 0 360.546 4.132 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000479872171 1112171580 /nfs/dbraw/zinc/17/15/80/1112171580.db2.gz HIVWGHGDCGTGNS-ZWKOTPCHSA-N 2 0 360.546 4.132 20 0 FIADRP COc1cc(OC)c([C@@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC000480050108 1112253430 /nfs/dbraw/zinc/25/34/30/1112253430.db2.gz UDTOYGJNZXIGOK-GFCCVEGCSA-N 2 0 354.922 4.317 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000480157798 1112307019 /nfs/dbraw/zinc/30/70/19/1112307019.db2.gz HCMCQBMOGHKVNF-MRXNPFEDSA-N 2 0 372.484 4.290 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000480163582 1112309810 /nfs/dbraw/zinc/30/98/10/1112309810.db2.gz FMOJJDOAGMXLCO-HSZRJFAPSA-N 2 0 350.506 4.458 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CCCC2)[C@H](C)C1 ZINC000480190269 1112327365 /nfs/dbraw/zinc/32/73/65/1112327365.db2.gz AIROJJASDNFEBX-IRLDBZIGSA-N 2 0 358.570 4.225 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CCCC2)[C@@H](C)C1 ZINC000480190270 1112327415 /nfs/dbraw/zinc/32/74/15/1112327415.db2.gz AIROJJASDNFEBX-RBBKRZOGSA-N 2 0 358.570 4.225 20 0 FIADRP Cc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480243864 1112341608 /nfs/dbraw/zinc/34/16/08/1112341608.db2.gz WMEGSOFSCBASAI-YDIMBITNSA-N 2 0 364.533 4.381 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)CCCC(F)(F)F)cc2)CC1 ZINC000480236510 1112344707 /nfs/dbraw/zinc/34/47/07/1112344707.db2.gz ZSAHCEFXEDQYSU-KRWDZBQOSA-N 2 0 371.491 4.035 20 0 FIADRP CCC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000480539665 1112467441 /nfs/dbraw/zinc/46/74/41/1112467441.db2.gz VOQBMVMJJVOTSD-IBGZPJMESA-N 2 0 371.491 4.162 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)N1CC[NH+](C)CC1 ZINC000480548518 1112470471 /nfs/dbraw/zinc/47/04/71/1112470471.db2.gz JONLSYPHQSIMBI-RXVVDRJESA-N 2 0 371.594 4.338 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000480612385 1112500943 /nfs/dbraw/zinc/50/09/43/1112500943.db2.gz LRTLBKCIECLMEP-LPHOPBHVSA-N 2 0 371.491 4.162 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000554811631 1112507732 /nfs/dbraw/zinc/50/77/32/1112507732.db2.gz MHKKEPPCVNEBHA-YUVXSKOASA-N 2 0 356.554 4.224 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480636190 1112524714 /nfs/dbraw/zinc/52/47/14/1112524714.db2.gz CZKZLUPZGJAURZ-KZNAEPCWSA-N 2 0 371.569 4.325 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000480734083 1112568633 /nfs/dbraw/zinc/56/86/33/1112568633.db2.gz UXCGIWQTCFJWKC-GOSISDBHSA-N 2 0 368.521 4.288 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(Cl)cc1 ZINC000480738158 1112571154 /nfs/dbraw/zinc/57/11/54/1112571154.db2.gz QPCVLSGTBRHTTH-HXUWFJFHSA-N 2 0 372.944 4.118 20 0 FIADRP Fc1cccc(C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000480742150 1112580694 /nfs/dbraw/zinc/58/06/94/1112580694.db2.gz BLDKFABCCZHPOP-HTAPYJJXSA-N 2 0 356.460 4.323 20 0 FIADRP Fc1cccc(C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000480742151 1112580980 /nfs/dbraw/zinc/58/09/80/1112580980.db2.gz BLDKFABCCZHPOP-JTSKRJEESA-N 2 0 356.460 4.323 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480769627 1112587768 /nfs/dbraw/zinc/58/77/68/1112587768.db2.gz IUXATHAITYZXSU-HXUWFJFHSA-N 2 0 367.537 4.157 20 0 FIADRP CN(Cc1ccccc1)[C@H](C[NH2+]C1CCC2(CCOCC2)CC1)C1CC1 ZINC000480762089 1112591065 /nfs/dbraw/zinc/59/10/65/1112591065.db2.gz UIPDAJCQZCCYDN-JOCHJYFZSA-N 2 0 356.554 4.226 20 0 FIADRP CCOCc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000480810378 1112615534 /nfs/dbraw/zinc/61/55/34/1112615534.db2.gz DYVQUYMOWXFHPL-WMZHIEFXSA-N 2 0 352.522 4.223 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc(C)c1F ZINC000480876869 1112651014 /nfs/dbraw/zinc/65/10/14/1112651014.db2.gz IBARZDCGCRHUBT-IBGZPJMESA-N 2 0 369.528 4.041 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC001649004386 1112661744 /nfs/dbraw/zinc/66/17/44/1112661744.db2.gz FNDSLJKJLJLFPY-YKSBVNFPSA-N 2 0 369.597 4.141 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2CO[C@H](C3CC3)C2)cc1 ZINC000667778284 1112670894 /nfs/dbraw/zinc/67/08/94/1112670894.db2.gz ZFWXMVVPDCICIP-GMAHTHKFSA-N 2 0 350.506 4.072 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(C)cc4)sc32)C1 ZINC000481302053 1112887718 /nfs/dbraw/zinc/88/77/18/1112887718.db2.gz BYJKTPLNOAJDCV-WMZOPIPTSA-N 2 0 355.551 4.427 20 0 FIADRP CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(Br)c1 ZINC000481318125 1112890618 /nfs/dbraw/zinc/89/06/18/1112890618.db2.gz JFHZOAHKGIEKKG-GOSISDBHSA-N 2 0 351.332 4.364 20 0 FIADRP Cc1cc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)cc(F)c1F ZINC001143609897 1112969608 /nfs/dbraw/zinc/96/96/08/1112969608.db2.gz NFTQUUSFCOSDJD-UHFFFAOYSA-N 2 0 356.460 4.371 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2ccccc2n1 ZINC000481724324 1113055568 /nfs/dbraw/zinc/05/55/68/1113055568.db2.gz HCDHCLYXIZTPKB-WMZHIEFXSA-N 2 0 359.517 4.278 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732136 1113059020 /nfs/dbraw/zinc/05/90/20/1113059020.db2.gz DWZRYNCQVUZFRU-DLBZAZTESA-N 2 0 355.295 4.113 20 0 FIADRP C[NH+](C)[C@H]1CCc2cc(NC(=O)NCCCCC[NH+]3CCCCC3)ccc21 ZINC000455928009 1113097765 /nfs/dbraw/zinc/09/77/65/1113097765.db2.gz NSSPVJDLUBWBAS-NRFANRHFSA-N 2 0 372.557 4.013 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3F)C2)[C@H](C)C1 ZINC000482074769 1113172137 /nfs/dbraw/zinc/17/21/37/1113172137.db2.gz KYNHVFUTXQYOBK-YXTQBTIXSA-N 2 0 362.533 4.188 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)[C@@H](C)C1 ZINC000482236555 1113206277 /nfs/dbraw/zinc/20/62/77/1113206277.db2.gz AGVCTHUZYULKNS-FXAWDEMLSA-N 2 0 364.961 4.098 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)[C@H](C)C1 ZINC000482236557 1113206576 /nfs/dbraw/zinc/20/65/76/1113206576.db2.gz AGVCTHUZYULKNS-XLIONFOSSA-N 2 0 364.961 4.098 20 0 FIADRP COc1cccc(C[C@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000482321809 1113226095 /nfs/dbraw/zinc/22/60/95/1113226095.db2.gz BTGARJAHFALOQC-QHCPKHFHSA-N 2 0 352.522 4.301 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000482339592 1113229517 /nfs/dbraw/zinc/22/95/17/1113229517.db2.gz VRUXCEIQJXEZJM-RDPSFJRHSA-N 3 0 365.565 4.139 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000482344090 1113230610 /nfs/dbraw/zinc/23/06/10/1113230610.db2.gz NGWBGLCYKRHBIK-CXAGYDPISA-N 2 0 351.332 4.319 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3c2cc(Br)cc3F)C1 ZINC000482345922 1113231007 /nfs/dbraw/zinc/23/10/07/1113231007.db2.gz SURIJBXDBAMLFI-ACJLOTCBSA-N 2 0 369.322 4.286 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1OC ZINC000482433638 1113252954 /nfs/dbraw/zinc/25/29/54/1113252954.db2.gz CWKVAGBFXQDVDK-IRLDBZIGSA-N 2 0 352.522 4.301 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000482497524 1113275986 /nfs/dbraw/zinc/27/59/86/1113275986.db2.gz AJVKXTHCVGZBSF-XLIONFOSSA-N 2 0 351.966 4.044 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482532793 1113285908 /nfs/dbraw/zinc/28/59/08/1113285908.db2.gz KGUVJHKEAFFKGL-YCRPNKLZSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc2c(c1)OCO2 ZINC000482557442 1113295087 /nfs/dbraw/zinc/29/50/87/1113295087.db2.gz OHPMLICFTRJSHU-GOSISDBHSA-N 2 0 366.505 4.498 20 0 FIADRP CC(C)CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482625937 1113317200 /nfs/dbraw/zinc/31/72/00/1113317200.db2.gz CNQOSGVGVROUBA-FXAWDEMLSA-N 2 0 351.966 4.043 20 0 FIADRP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1F ZINC000482652749 1113323435 /nfs/dbraw/zinc/32/34/35/1113323435.db2.gz ULDRTRJZDOPMLC-UTKZUKDTSA-N 2 0 356.485 4.225 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(OC)c1 ZINC000482899690 1113395510 /nfs/dbraw/zinc/39/55/10/1113395510.db2.gz MLHLMPDSCVUXCW-HSZRJFAPSA-N 2 0 368.521 4.411 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1cccc(OCCCc2ccccc2)c1 ZINC000482906548 1113396519 /nfs/dbraw/zinc/39/65/19/1113396519.db2.gz WPMKRSDLBDXZNQ-GBXCKJPGSA-N 2 0 366.549 4.171 20 0 FIADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cccc(OCc2ccccn2)c1 ZINC000162282543 1113451168 /nfs/dbraw/zinc/45/11/68/1113451168.db2.gz WUHKDOAAPFKCEU-IBGZPJMESA-N 2 0 353.510 4.187 20 0 FIADRP CC(C)N(C)c1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cn1 ZINC000483257305 1113475011 /nfs/dbraw/zinc/47/50/11/1113475011.db2.gz GZDUVAZNBIWNDI-UHFFFAOYSA-N 2 0 358.574 4.014 20 0 FIADRP COc1cc(C)c(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000486522132 1113587674 /nfs/dbraw/zinc/58/76/74/1113587674.db2.gz YCJRZYCGTHPXMR-AZUAARDMSA-N 2 0 368.521 4.012 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000486521725 1113590259 /nfs/dbraw/zinc/59/02/59/1113590259.db2.gz XAIMUVYCQQSQBA-FXAWDEMLSA-N 2 0 370.562 4.417 20 0 FIADRP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486708704 1113627134 /nfs/dbraw/zinc/62/71/34/1113627134.db2.gz KDCLBLUVLKJJPN-QFBILLFUSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc1 ZINC000488107721 1113855700 /nfs/dbraw/zinc/85/57/00/1113855700.db2.gz GZIBMBSDYPZAJW-XYEHWOGUSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@H](c1ccccc1Br)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488329925 1113909976 /nfs/dbraw/zinc/90/99/76/1113909976.db2.gz XMFLVIULOZGLJT-OAHLLOKOSA-N 2 0 351.332 4.318 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2Oc2cccnc2)CC1 ZINC000488377941 1113917997 /nfs/dbraw/zinc/91/79/97/1113917997.db2.gz TZCIYARIBCKWDF-UHFFFAOYSA-N 2 0 353.510 4.428 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000490151166 1114218937 /nfs/dbraw/zinc/21/89/37/1114218937.db2.gz POUPIAIDKCLTKQ-OAQYLSRUSA-N 2 0 374.912 4.132 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccccc1F ZINC000490124035 1114220796 /nfs/dbraw/zinc/22/07/96/1114220796.db2.gz IBXYDEBPPYGBJI-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccc(F)cn1 ZINC000490134754 1114222495 /nfs/dbraw/zinc/22/24/95/1114222495.db2.gz CTPODWNBGWNKGV-OAQYLSRUSA-N 2 0 371.500 4.182 20 0 FIADRP Cc1cc(C(C)(C)C)cc(C)c1C[N@@H+]1CC[C@@H](N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000490653925 1114311840 /nfs/dbraw/zinc/31/18/40/1114311840.db2.gz WAUMGIBEYRGBLE-NFBKMPQASA-N 2 0 371.613 4.059 20 0 FIADRP CC(C)[NH2+]CCCC[C@H](N)c1nc(-c2ccc(OC(C)(C)C)cc2)no1 ZINC001212145004 1114416876 /nfs/dbraw/zinc/41/68/76/1114416876.db2.gz IZWTXQBHEZGTNJ-KRWDZBQOSA-N 2 0 360.502 4.082 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000572855920 1114807197 /nfs/dbraw/zinc/80/71/97/1114807197.db2.gz RURPNGZNADVVHS-KRWDZBQOSA-N 2 0 352.526 4.400 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3nn(C)c4ccccc34)cc2)CC1 ZINC000589638941 1114818140 /nfs/dbraw/zinc/81/81/40/1114818140.db2.gz IDFFBJYMVUWHNH-UHFFFAOYSA-N 2 0 362.521 4.095 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000589837696 1114847812 /nfs/dbraw/zinc/84/78/12/1114847812.db2.gz YUZLRIGIONTQGV-CALCHBBNSA-N 2 0 372.475 4.475 20 0 FIADRP CCC[C@@H](NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1)c1ccccc1 ZINC000590786826 1114974580 /nfs/dbraw/zinc/97/45/80/1114974580.db2.gz NZXAPCYYLLWVOK-SIKLNZKXSA-N 2 0 373.585 4.085 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cn(C)nc3C(C)(C)C)cc2)CC1 ZINC000093946988 1115023846 /nfs/dbraw/zinc/02/38/46/1115023846.db2.gz ZWWLKEMSAIGIBH-UHFFFAOYSA-N 2 0 368.569 4.239 20 0 FIADRP CC(C)(C)OC(=O)[C@@H]1C[C@@H](NC2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000593691163 1115342365 /nfs/dbraw/zinc/34/23/65/1115342365.db2.gz ORMWKFRAPRRQOF-WOJBJXKFSA-N 2 0 372.553 4.409 20 0 FIADRP Cc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000574395585 1115359503 /nfs/dbraw/zinc/35/95/03/1115359503.db2.gz CGXZRMMUEPSFGC-UWJYYQICSA-N 2 0 351.494 4.008 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(N2CCCC2=O)cc1 ZINC000157891659 1115381317 /nfs/dbraw/zinc/38/13/17/1115381317.db2.gz PGCGMSHMCFGMIM-OALUTQOASA-N 2 0 357.542 4.119 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1cccc(O)c1 ZINC000669617960 1115673062 /nfs/dbraw/zinc/67/30/62/1115673062.db2.gz MIRPLCFMBPGTRZ-RMVZNSSTSA-N 2 0 350.506 4.344 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2cc(Br)ccc2C)CC[NH+](C)CC1 ZINC000599047376 1115780328 /nfs/dbraw/zinc/78/03/28/1115780328.db2.gz UIAWOYHQWMZODY-CQSZACIVSA-N 2 0 371.388 4.236 20 0 FIADRP Oc1ccc([C@@H]2CCC[NH+]2CCC[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000607151093 1116003449 /nfs/dbraw/zinc/00/34/49/1116003449.db2.gz WRPCOOIFTQVOEI-GOTSBHOMSA-N 2 0 366.505 4.462 20 0 FIADRP C[NH+](C)[C@H]1CCc2cc(NC(=O)c3cccc(C[NH+]4CCCC4)c3)ccc21 ZINC000456292733 1116174834 /nfs/dbraw/zinc/17/48/34/1116174834.db2.gz ZUAPZJLJSHFLDP-QFIPXVFZSA-N 2 0 363.505 4.084 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)cc1 ZINC000456341761 1116179767 /nfs/dbraw/zinc/17/97/67/1116179767.db2.gz YOTQFTMRFCXOJX-JOCHJYFZSA-N 2 0 365.521 4.330 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000509702284 1116228749 /nfs/dbraw/zinc/22/87/49/1116228749.db2.gz YUGXWBXBMVVSAW-UHFFFAOYSA-N 2 0 374.532 4.363 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000534797996 1116238976 /nfs/dbraw/zinc/23/89/76/1116238976.db2.gz AWESDVQHXWQPED-BHDDXSALSA-N 2 0 354.538 4.110 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535231018 1116283405 /nfs/dbraw/zinc/28/34/05/1116283405.db2.gz UWSFTATWGFMBNA-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP Brc1ccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CCC2)cc1 ZINC000539624543 1116355615 /nfs/dbraw/zinc/35/56/15/1116355615.db2.gz DPNOFSLDYQUFPK-UHFFFAOYSA-N 2 0 363.343 4.292 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2OCC(F)(F)F)C1 ZINC000462681882 1116390151 /nfs/dbraw/zinc/39/01/51/1116390151.db2.gz WGPBQTXFWGQVIW-IRXDYDNUSA-N 2 0 372.475 4.475 20 0 FIADRP Oc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000462812258 1117782347 /nfs/dbraw/zinc/78/23/47/1117782347.db2.gz GZEUSWQQICTARQ-JOCHJYFZSA-N 2 0 366.505 4.034 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@@](C)(O)C2CC2)c2ccc(F)cc2)CC1 ZINC000462815469 1117793371 /nfs/dbraw/zinc/79/33/71/1117793371.db2.gz HYZFZBXGEPJNHE-FCHUYYIVSA-N 2 0 362.533 4.130 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CC[C@H](O)CC2)c2ccc(F)cc2)CC1 ZINC000462818831 1117795381 /nfs/dbraw/zinc/79/53/81/1117795381.db2.gz QNKIFMVDQYZXEH-FKBYEOEOSA-N 2 0 362.533 4.272 20 0 FIADRP CCC1(C[NH2+][C@H]2CCCc3c2cnn3C)CC[NH+](Cc2ccccc2)CC1 ZINC000540141574 1117894075 /nfs/dbraw/zinc/89/40/75/1117894075.db2.gz OMWCMMKUMPSTRP-NRFANRHFSA-N 2 0 366.553 4.080 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](c3ccccc3)[C@H]3CCOC3)CC2)C1 ZINC000540137166 1117900842 /nfs/dbraw/zinc/90/08/42/1117900842.db2.gz MJODXAQUWYHMDD-VGSGFSFPSA-N 2 0 356.554 4.397 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000540136440 1117901115 /nfs/dbraw/zinc/90/11/15/1117901115.db2.gz QHUYLKHAKJGOQU-SFHVURJKSA-N 2 0 353.510 4.438 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cccc3ccccc32)[C@H](C)C1 ZINC000540169454 1117912301 /nfs/dbraw/zinc/91/23/01/1117912301.db2.gz TUTMNJQGOOOFLU-XXBNENTESA-N 2 0 354.538 4.109 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000540165231 1117918251 /nfs/dbraw/zinc/91/82/51/1117918251.db2.gz ZYGNMLLQIWLPAG-NMNUPHIUSA-N 2 0 374.569 4.284 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccnc1 ZINC000540262365 1117963117 /nfs/dbraw/zinc/96/31/17/1117963117.db2.gz KAHSHLYBPHXVAN-PWHSHALESA-N 2 0 367.537 4.178 20 0 FIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCCCn2c(C)nc3ccccc32)C1 ZINC000463096081 1117964139 /nfs/dbraw/zinc/96/41/39/1117964139.db2.gz GPQJYQDSMDRRMS-HXUWFJFHSA-N 2 0 356.558 4.179 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)[C@H](C)C1 ZINC000463108974 1117968349 /nfs/dbraw/zinc/96/83/49/1117968349.db2.gz IIXRUQSWZLMBDT-NQIIRXRSSA-N 2 0 356.558 4.177 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)cc1 ZINC000540315366 1117980491 /nfs/dbraw/zinc/98/04/91/1117980491.db2.gz DNGUCWMFJDQNOR-AABGKKOBSA-N 2 0 350.934 4.005 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(Cc2ccccc2Cl)CC1 ZINC000463138932 1117986789 /nfs/dbraw/zinc/98/67/89/1117986789.db2.gz FOHSSHHHXRJPBD-GOSISDBHSA-N 2 0 363.977 4.159 20 0 FIADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475942 1118077349 /nfs/dbraw/zinc/07/73/49/1118077349.db2.gz WOHNZSQBQKPVMS-VQIMIIECSA-N 2 0 356.535 4.257 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cccc(F)c1F)c1ccccc1O2 ZINC000540494468 1118091844 /nfs/dbraw/zinc/09/18/44/1118091844.db2.gz BJBOVKLIJHTSSG-IBGZPJMESA-N 2 0 372.459 4.085 20 0 FIADRP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@H](C)CN1CC[NH+](CC)CC1 ZINC000540593958 1118138263 /nfs/dbraw/zinc/13/82/63/1118138263.db2.gz CBFUHKSHYDOUOI-OALUTQOASA-N 2 0 371.569 4.228 20 0 FIADRP CCC1(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000540709406 1118196632 /nfs/dbraw/zinc/19/66/32/1118196632.db2.gz BXSRZPWGYDMHRE-VXKWHMMOSA-N 2 0 358.570 4.472 20 0 FIADRP CC1(C)Cc2cccc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)c2O1 ZINC000540810644 1118258662 /nfs/dbraw/zinc/25/86/62/1118258662.db2.gz DRAJGYBUEGTOJF-UHFFFAOYSA-N 2 0 350.506 4.286 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000540992090 1118342158 /nfs/dbraw/zinc/34/21/58/1118342158.db2.gz UVJQBSCUYXWKME-RPWUZVMVSA-N 2 0 366.549 4.447 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000541215498 1118431097 /nfs/dbraw/zinc/43/10/97/1118431097.db2.gz DVNKLMSHNCLXKQ-KCZVDYSFSA-N 2 0 368.569 4.285 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000464075515 1118433122 /nfs/dbraw/zinc/43/31/22/1118433122.db2.gz NQRXPUAWTTZBNK-UHFFFAOYSA-N 2 0 354.542 4.294 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000541536194 1118553667 /nfs/dbraw/zinc/55/36/67/1118553667.db2.gz DLXXPRJKYABIRL-NRFANRHFSA-N 2 0 350.441 4.442 20 0 FIADRP COC(=O)c1sc2ccccc2c1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000609133519 1118604979 /nfs/dbraw/zinc/60/49/79/1118604979.db2.gz PSEZVVUZQHPHGV-UHFFFAOYSA-N 2 0 374.550 4.240 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Br)C[C@@H]1C ZINC000542279469 1118879579 /nfs/dbraw/zinc/87/95/79/1118879579.db2.gz XWBWSVOORDZIFE-RDJZCZTQSA-N 2 0 353.348 4.186 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Br)C[C@H]1C ZINC000542279468 1118880050 /nfs/dbraw/zinc/88/00/50/1118880050.db2.gz XWBWSVOORDZIFE-NVXWUHKLSA-N 2 0 353.348 4.186 20 0 FIADRP CC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(C3CC3)cc2F)CC1 ZINC000491559245 1118960275 /nfs/dbraw/zinc/96/02/75/1118960275.db2.gz JIDSVDCSEXCDJT-UHFFFAOYSA-N 2 0 367.512 4.135 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2ccccc2)c1 ZINC000492223660 1119051003 /nfs/dbraw/zinc/05/10/03/1119051003.db2.gz LTZJIRORCGNOPG-UPVQGACJSA-N 2 0 366.549 4.219 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000492251451 1119058123 /nfs/dbraw/zinc/05/81/23/1119058123.db2.gz HVSLCUCRPCWUDC-YADHBBJMSA-N 2 0 372.940 4.256 20 0 FIADRP C[C@@H]([NH2+]CCCOc1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492371743 1119080459 /nfs/dbraw/zinc/08/04/59/1119080459.db2.gz DQPRDTFOJCZCMD-QUCCMNQESA-N 2 0 356.485 4.095 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492598587 1119141283 /nfs/dbraw/zinc/14/12/83/1119141283.db2.gz AYVPPUHJHVWOHV-FYYLOGMGSA-N 3 0 357.586 4.143 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492598590 1119141336 /nfs/dbraw/zinc/14/13/36/1119141336.db2.gz AYVPPUHJHVWOHV-JTHBVZDNSA-N 3 0 357.586 4.143 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000177306442 1119322893 /nfs/dbraw/zinc/32/28/93/1119322893.db2.gz ADCASENZKDFSTF-JOCHJYFZSA-N 2 0 365.521 4.050 20 0 FIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000177751645 1119349681 /nfs/dbraw/zinc/34/96/81/1119349681.db2.gz TVZQKTXFRJWNLF-XHSDSOJGSA-N 2 0 373.566 4.220 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311807394 1119389525 /nfs/dbraw/zinc/38/95/25/1119389525.db2.gz LHQQEMSQCKHTJH-BVSLBCMMSA-N 2 0 356.554 4.369 20 0 FIADRP FC(F)(F)Oc1cccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311858859 1119392706 /nfs/dbraw/zinc/39/27/06/1119392706.db2.gz XFPPEIXYHHSJSV-GOSISDBHSA-N 2 0 364.411 4.197 20 0 FIADRP COCc1cccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000312048549 1119397601 /nfs/dbraw/zinc/39/76/01/1119397601.db2.gz AVZHJKGLYPITOH-HSZRJFAPSA-N 2 0 352.522 4.225 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000178634463 1119399093 /nfs/dbraw/zinc/39/90/93/1119399093.db2.gz LKCKLXUMQBFKLJ-GOSISDBHSA-N 2 0 365.521 4.208 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCc3cc(Br)cc(C)c32)C1 ZINC000493916679 1119506078 /nfs/dbraw/zinc/50/60/78/1119506078.db2.gz MCLNFWTYHCWWTE-PBHICJAKSA-N 2 0 351.332 4.066 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493935289 1119511637 /nfs/dbraw/zinc/51/16/37/1119511637.db2.gz HZUOJBCBPKFGMR-LSJNQWAISA-N 2 0 365.359 4.405 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493945782 1119513597 /nfs/dbraw/zinc/51/35/97/1119513597.db2.gz ULCNBIHWQLDSFI-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000493969529 1119518438 /nfs/dbraw/zinc/51/84/38/1119518438.db2.gz NXUZTIPENWWKRO-WMZHIEFXSA-N 2 0 352.522 4.264 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000493978391 1119523147 /nfs/dbraw/zinc/52/31/47/1119523147.db2.gz SCVLUNVIKASOER-XXBNENTESA-N 2 0 368.521 4.027 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000186599218 1119739119 /nfs/dbraw/zinc/73/91/19/1119739119.db2.gz QCEKZWNDNSWLNW-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP Cc1nc2ccc(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)cc2s1 ZINC000494340528 1119828440 /nfs/dbraw/zinc/82/84/40/1119828440.db2.gz UCTQQRMNHFUSPL-UHFFFAOYSA-N 2 0 369.534 4.225 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000494481468 1119876931 /nfs/dbraw/zinc/87/69/31/1119876931.db2.gz AIJQKRHIJASPAB-NHCUHLMSSA-N 2 0 367.880 4.454 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000189257356 1119877322 /nfs/dbraw/zinc/87/73/22/1119877322.db2.gz WQNGHFOKUFLRJR-NVFTXBOLSA-N 2 0 356.554 4.082 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2C)nc1)c1ccc2c(c1)CCCO2 ZINC000153076530 1119895697 /nfs/dbraw/zinc/89/56/97/1119895697.db2.gz PKURQKYBZKGQSW-HXUWFJFHSA-N 2 0 362.477 4.142 20 0 FIADRP CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542485084 1119902230 /nfs/dbraw/zinc/90/22/30/1119902230.db2.gz IELMXIDFAXVDLV-MGPUTAFESA-N 2 0 370.884 4.095 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000191463030 1119978777 /nfs/dbraw/zinc/97/87/77/1119978777.db2.gz AYWBBEFRGQZJME-UHFFFAOYSA-N 2 0 365.768 4.374 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccnn1-c1ccccc1 ZINC000467374495 1119981130 /nfs/dbraw/zinc/98/11/30/1119981130.db2.gz XRAFDDDNGBPDSX-CTNGQTDRSA-N 2 0 360.505 4.045 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1ccc(C2CC2)cc1)C1CC[NH+](C)CC1 ZINC000191683154 1119989809 /nfs/dbraw/zinc/98/98/09/1119989809.db2.gz WXAQGAKYMXSSIE-UHFFFAOYSA-N 2 0 363.549 4.384 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000191855922 1119999080 /nfs/dbraw/zinc/99/90/80/1119999080.db2.gz JTXGRAWPEAMSFD-HARLFGEKSA-N 2 0 368.521 4.055 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](Cc2ccccc2)c2cccs2)CC1 ZINC000192795651 1120084073 /nfs/dbraw/zinc/08/40/73/1120084073.db2.gz RSXFJLRMGQQENN-OAQYLSRUSA-N 2 0 371.594 4.038 20 0 FIADRP COc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000195132594 1120119114 /nfs/dbraw/zinc/11/91/14/1120119114.db2.gz TYQIFNHIGDIPTK-UYAOXDASSA-N 2 0 368.521 4.185 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000195139667 1120120671 /nfs/dbraw/zinc/12/06/71/1120120671.db2.gz IXRMNANMJYPRGC-QZTJIDSGSA-N 2 0 355.551 4.195 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494774773 1120184658 /nfs/dbraw/zinc/18/46/58/1120184658.db2.gz LCSBGDPSHBXSFA-VNHKHXMHSA-N 2 0 352.522 4.263 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C2CCC(c3nc(C)no3)CC2)c1 ZINC000494923644 1120380748 /nfs/dbraw/zinc/38/07/48/1120380748.db2.gz QSXHDPCCZLNFHZ-UHFFFAOYSA-N 2 0 356.514 4.036 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cc(Cl)cs3)CC2)C[C@H](C)O1 ZINC000494985348 1120410674 /nfs/dbraw/zinc/41/06/74/1120410674.db2.gz JJEUPVFNFKHPAU-GASCZTMLSA-N 2 0 356.963 4.113 20 0 FIADRP C[C@@H]([NH2+]CCOc1ccc(C(F)(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542532741 1120428316 /nfs/dbraw/zinc/42/83/16/1120428316.db2.gz PTCHHTCADZOSSH-CVEARBPZSA-N 2 0 370.459 4.327 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc2c(c1)CCCO2 ZINC000153388555 1120582850 /nfs/dbraw/zinc/58/28/50/1120582850.db2.gz UDHAUHODOJHADV-OAQYLSRUSA-N 2 0 368.521 4.193 20 0 FIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000670153971 1120709945 /nfs/dbraw/zinc/70/99/45/1120709945.db2.gz SFLCCHJPFFMXGP-LMMKCTJWSA-N 2 0 363.343 4.433 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc(Br)ncc1F ZINC000762737734 1120956709 /nfs/dbraw/zinc/95/67/09/1120956709.db2.gz TZDCMWDJZAQWBN-AWEZNQCLSA-N 2 0 372.326 4.146 20 0 FIADRP c1ccc(CCCOc2cccc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)c2)cc1 ZINC000236738777 1120969557 /nfs/dbraw/zinc/96/95/57/1120969557.db2.gz GZVFDGSOIVFTGP-QFIPXVFZSA-N 2 0 364.533 4.272 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001168496336 1120997354 /nfs/dbraw/zinc/99/73/54/1120997354.db2.gz IQDKSVPVQVIASM-LJQANCHMSA-N 2 0 352.497 4.355 20 0 FIADRP O[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000089553936 1121002896 /nfs/dbraw/zinc/00/28/96/1121002896.db2.gz KMTZVPXVEFIQSI-IBGZPJMESA-N 2 0 370.459 4.126 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000542666286 1121024467 /nfs/dbraw/zinc/02/44/67/1121024467.db2.gz WZBMGDCOGVFYBU-XMSQKQJNSA-N 2 0 370.924 4.074 20 0 FIADRP Cc1nc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)nc2ccccc12 ZINC000103143000 1121044866 /nfs/dbraw/zinc/04/48/66/1121044866.db2.gz DHJFROPQSGRWOG-UHFFFAOYSA-N 2 0 374.532 4.282 20 0 FIADRP Cc1sc(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)cc1Br ZINC001235706722 1121098621 /nfs/dbraw/zinc/09/86/21/1121098621.db2.gz WINQWRXEMGAKAQ-UHFFFAOYSA-N 2 0 357.361 4.031 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2CC(F)(F)F)[C@@H](C)C1 ZINC000624307314 1121152330 /nfs/dbraw/zinc/15/23/30/1121152330.db2.gz GXOQQTMDQNXYKJ-LPHOPBHVSA-N 2 0 372.475 4.018 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)ccc1F ZINC000397560599 1121218846 /nfs/dbraw/zinc/21/88/46/1121218846.db2.gz VXSOIZYDQNPVFR-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP COc1ccc(OC)c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397705144 1121289703 /nfs/dbraw/zinc/28/97/03/1121289703.db2.gz WWSPKZRQRZXAJZ-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP C[NH+](C)CCOc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000670272341 1121298650 /nfs/dbraw/zinc/29/86/50/1121298650.db2.gz VIQWGKNOIHFAJF-SFHVURJKSA-N 2 0 370.459 4.182 20 0 FIADRP C[N@H+](CCC[NH2+]Cc1c[nH]nc1-c1ccc(Cl)cc1)Cc1ccccc1 ZINC000061556920 1121521711 /nfs/dbraw/zinc/52/17/11/1121521711.db2.gz KOYDQRSDKFRRMD-UHFFFAOYSA-N 2 0 368.912 4.342 20 0 FIADRP C[C@H](c1ccccc1)[C@@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671752424 1121735207 /nfs/dbraw/zinc/73/52/07/1121735207.db2.gz XOZUJGLQHINZPU-DLQXEOFGSA-N 2 0 366.549 4.184 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2OCCc3ccccc32)CC1 ZINC000671752042 1121738617 /nfs/dbraw/zinc/73/86/17/1121738617.db2.gz YJTFPBBFNOUMQK-IWAAJCSBSA-N 2 0 364.533 4.333 20 0 FIADRP Cc1nccn1CCCCN1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000125497868 1121785285 /nfs/dbraw/zinc/78/52/85/1121785285.db2.gz VHOVMCHQRJKWMR-GOSISDBHSA-N 2 0 368.308 4.352 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(OC)c1 ZINC000125512781 1121787320 /nfs/dbraw/zinc/78/73/20/1121787320.db2.gz ZMLFONLGUUFNDM-MRXNPFEDSA-N 2 0 374.550 4.328 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](CCCOC)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000671764653 1121798128 /nfs/dbraw/zinc/79/81/28/1121798128.db2.gz POEHMTIZTAIABC-KPFFTGBYSA-N 2 0 352.950 4.170 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)CCO2)cc1 ZINC001168597470 1121805053 /nfs/dbraw/zinc/80/50/53/1121805053.db2.gz BDCXCVBMAPFEOK-HROGELHOSA-N 2 0 360.542 4.049 20 0 FIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608277 1121970747 /nfs/dbraw/zinc/97/07/47/1121970747.db2.gz CRNDTMNGIZNDQI-UGKGYDQZSA-N 2 0 360.542 4.158 20 0 FIADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126663752 1121974590 /nfs/dbraw/zinc/97/45/90/1121974590.db2.gz UTYHKTQBOOAEJV-BTYIYWSLSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2sccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126727999 1121981627 /nfs/dbraw/zinc/98/16/27/1121981627.db2.gz UWELNGOMBYLGGA-KXBFYZLASA-N 2 0 373.541 4.367 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3F)cc2)CC1 ZINC000916999665 1121996244 /nfs/dbraw/zinc/99/62/44/1121996244.db2.gz NRIAKYXCMAZIDN-JOCHJYFZSA-N 2 0 374.475 4.020 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3c(F)cccc3F)cc2)CC1 ZINC000917000838 1121996383 /nfs/dbraw/zinc/99/63/83/1121996383.db2.gz YIBVQBSGUGHGBH-OAQYLSRUSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(-c2ccccc2F)s1 ZINC000765792182 1121997793 /nfs/dbraw/zinc/99/77/93/1121997793.db2.gz PMATWTRQXKZETK-ARFHVFGLSA-N 2 0 360.498 4.068 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168616157 1122104279 /nfs/dbraw/zinc/10/42/79/1122104279.db2.gz LOCDVNJJSBKPGN-RQGSJKACSA-N 2 0 358.526 4.040 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H](c3ncc[nH]3)c3ccccc3)CC2)CC1 ZINC000128185477 1122202975 /nfs/dbraw/zinc/20/29/75/1122202975.db2.gz QAKGNAKNCSHHBD-CBNMVNINSA-N 2 0 352.526 4.132 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)C2CCC2)o1 ZINC000542680637 1122272491 /nfs/dbraw/zinc/27/24/91/1122272491.db2.gz CZSNNGDBWXJHHX-GGAORHGYSA-N 2 0 368.521 4.176 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000556094868 1122648262 /nfs/dbraw/zinc/64/82/62/1122648262.db2.gz ZGQPJHHNVKJTNG-ZEYPLWLESA-N 2 0 360.505 4.358 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)[C@H](C)C1 ZINC000556216708 1122735094 /nfs/dbraw/zinc/73/50/94/1122735094.db2.gz JGGIOVATYXMTOU-APWZRJJASA-N 2 0 354.485 4.025 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1Br ZINC000556230786 1122757151 /nfs/dbraw/zinc/75/71/51/1122757151.db2.gz ASAWZUVYPWDICP-OAHLLOKOSA-N 2 0 369.347 4.374 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCCNc4ccccc43)cc2)CC1 ZINC000556610816 1123004535 /nfs/dbraw/zinc/00/45/35/1123004535.db2.gz IRACCOLWYRYSCR-QHCPKHFHSA-N 2 0 365.521 4.196 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000556868685 1123149657 /nfs/dbraw/zinc/14/96/57/1123149657.db2.gz AGVUPCIOJJLDAV-OAQYLSRUSA-N 2 0 370.541 4.151 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@@H]2CCC[C@@H]21 ZINC000556869704 1123150570 /nfs/dbraw/zinc/15/05/70/1123150570.db2.gz ANBHXMBKESMCKQ-FUDKSRODSA-N 2 0 374.532 4.047 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccoc1 ZINC000556889923 1123177329 /nfs/dbraw/zinc/17/73/29/1123177329.db2.gz KVFYDOCECGMMFE-FCHUYYIVSA-N 2 0 356.510 4.113 20 0 FIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000074982097 1123437529 /nfs/dbraw/zinc/43/75/29/1123437529.db2.gz ARGPKGQMDLZAOP-CQSZACIVSA-N 2 0 362.905 4.115 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]C2CCN(Cc3ccccc3)CC2)c1 ZINC000236667605 1123547294 /nfs/dbraw/zinc/54/72/94/1123547294.db2.gz XPLJNXGUMCYLCQ-UHFFFAOYSA-N 2 0 365.565 4.281 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2nnc(-c3cccc(C)c3)o2)CC1 ZINC000921231363 1123593622 /nfs/dbraw/zinc/59/36/22/1123593622.db2.gz YJAHRPZIZJVFCB-QGZVFWFLSA-N 2 0 356.514 4.160 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCCC(=O)Nc2c(C)cccc2C)CC1 ZINC000137400076 1123971135 /nfs/dbraw/zinc/97/11/35/1123971135.db2.gz KPINRDLBZRLASI-UHFFFAOYSA-N 2 0 373.585 4.466 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)Nc1ccccc1 ZINC000615314852 1123988653 /nfs/dbraw/zinc/98/86/53/1123988653.db2.gz JAUCWYQIEPJIPO-RBUKOAKNSA-N 2 0 365.521 4.178 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000245677440 1124186661 /nfs/dbraw/zinc/18/66/61/1124186661.db2.gz IGNLUJIJNRJWKI-XXTHSBEZSA-N 2 0 355.570 4.036 20 0 FIADRP CO[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000245701844 1124210074 /nfs/dbraw/zinc/21/00/74/1124210074.db2.gz LTTQEEFKZGSJQS-KAOXLYBCSA-N 2 0 368.496 4.298 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245750753 1124239772 /nfs/dbraw/zinc/23/97/72/1124239772.db2.gz TZHHCWDQVWYPKN-XGAJZPNHSA-N 3 0 369.597 4.284 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000245897517 1124274702 /nfs/dbraw/zinc/27/47/02/1124274702.db2.gz NIGWYJGIBFRGRO-YPAWHYETSA-N 2 0 368.521 4.205 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1 ZINC000245925776 1124286110 /nfs/dbraw/zinc/28/61/10/1124286110.db2.gz SLAXXOGLLONPIA-NOOVBMIQSA-N 2 0 351.494 4.179 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc2ccccc2c1 ZINC000246306677 1124440645 /nfs/dbraw/zinc/44/06/45/1124440645.db2.gz DLYQYYRCBZXBOD-JJEOQYAHSA-N 2 0 352.522 4.258 20 0 FIADRP CCCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1 ZINC000542846109 1124443111 /nfs/dbraw/zinc/44/31/11/1124443111.db2.gz JWAVGAPXJVDRGJ-DHIUTWEWSA-N 2 0 352.522 4.274 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccccc1C(F)(F)F ZINC000246320374 1124445837 /nfs/dbraw/zinc/44/58/37/1124445837.db2.gz FHMQJSWLOZRFBD-ZOCIIQOWSA-N 2 0 370.459 4.124 20 0 FIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000542846873 1124447198 /nfs/dbraw/zinc/44/71/98/1124447198.db2.gz OBFFACOVUNWAMK-NTKDMRAZSA-N 2 0 366.549 4.303 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)nnn1-c1ccc(F)cc1 ZINC000246923309 1124574738 /nfs/dbraw/zinc/57/47/38/1124574738.db2.gz GUXGGSVBTACXTD-IAGOWNOFSA-N 2 0 373.520 4.020 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000247234207 1124604390 /nfs/dbraw/zinc/60/43/90/1124604390.db2.gz YMSLOHIVUGIMOA-PBHICJAKSA-N 2 0 359.514 4.258 20 0 FIADRP CN1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000248120076 1124742987 /nfs/dbraw/zinc/74/29/87/1124742987.db2.gz NFYADQVIDAVOQZ-YOEHRIQHSA-N 2 0 359.514 4.258 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(-n2ccnc2)cc1 ZINC000248395277 1124760662 /nfs/dbraw/zinc/76/06/62/1124760662.db2.gz GEMFAJHZLWHZTL-BJLQDIEVSA-N 2 0 352.526 4.176 20 0 FIADRP COCC[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412046 1124764558 /nfs/dbraw/zinc/76/45/58/1124764558.db2.gz ZYRFVYKYAJVYOM-YFVAEKQCSA-N 2 0 362.533 4.016 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248409050 1124764928 /nfs/dbraw/zinc/76/49/28/1124764928.db2.gz WGQFNLPYSZFWGF-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCCC2=O)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248409586 1124765126 /nfs/dbraw/zinc/76/51/26/1124765126.db2.gz WUFXWSIDAOHZKB-NSHGMRRFSA-N 2 0 369.553 4.117 20 0 FIADRP CC1(C)Cc2occc2[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C1 ZINC000248438888 1124769360 /nfs/dbraw/zinc/76/93/60/1124769360.db2.gz ICXIYWTURDPWRT-FPOVZHCZSA-N 2 0 368.521 4.040 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)cc1 ZINC000248439345 1124769618 /nfs/dbraw/zinc/76/96/18/1124769618.db2.gz INDRUXXDXQPIQO-NHCUHLMSSA-N 2 0 358.913 4.148 20 0 FIADRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000248461888 1124774256 /nfs/dbraw/zinc/77/42/56/1124774256.db2.gz XWJDFUIIRJCDRA-XXBNENTESA-N 2 0 352.522 4.111 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000089695980 1124928230 /nfs/dbraw/zinc/92/82/30/1124928230.db2.gz MRZYOKLTNGDNGM-DIFFPNOSSA-N 2 0 369.734 4.164 20 0 FIADRP C[NH+]1CCC(Oc2ccc(CNc3cc[nH+]c4cc(F)ccc34)cc2)CC1 ZINC000672296644 1124969342 /nfs/dbraw/zinc/96/93/42/1124969342.db2.gz GGZSSSOTGLHYMC-UHFFFAOYSA-N 2 0 365.452 4.459 20 0 FIADRP Cc1cc2cc([C@H](C)[NH2+]Cc3ccnc(OCC[NH+](C)C)c3)oc2cc1C ZINC000090937217 1125027734 /nfs/dbraw/zinc/02/77/34/1125027734.db2.gz NXRFMIVXAZURPF-KRWDZBQOSA-N 2 0 367.493 4.236 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2cccs2)C2CCCC2)ccn1 ZINC000090936885 1125028131 /nfs/dbraw/zinc/02/81/31/1125028131.db2.gz DIDDBUZYLLXXRU-HXUWFJFHSA-N 2 0 359.539 4.105 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285053 1125062414 /nfs/dbraw/zinc/06/24/14/1125062414.db2.gz VOIZYOACUCSSJW-LJQANCHMSA-N 2 0 370.368 4.062 20 0 FIADRP Fc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000091343529 1125066991 /nfs/dbraw/zinc/06/69/91/1125066991.db2.gz GPQFBWPNINIGDL-VGSWGCGISA-N 2 0 360.517 4.148 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)Nc1ccccc1 ZINC000615314850 1125237604 /nfs/dbraw/zinc/23/76/04/1125237604.db2.gz JAUCWYQIEPJIPO-MOPGFXCFSA-N 2 0 365.521 4.178 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000602565034 567995504 /nfs/dbraw/zinc/99/55/04/567995504.db2.gz OJAQVGHIWCHJAY-YQFXHGLYSA-N 2 0 374.594 4.024 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccc3)nc2)CC1 ZINC000603937851 568184320 /nfs/dbraw/zinc/18/43/20/568184320.db2.gz IXVXELFZWREWBN-UHFFFAOYSA-N 2 0 352.526 4.088 20 0 FIADRP c1cc2cc(CC[NH2+][C@@H]3CCN(Cc4ccccc4)C4(CC4)C3)ccc2[nH]1 ZINC000563121646 568222643 /nfs/dbraw/zinc/22/26/43/568222643.db2.gz ADBKZOKJAPOGPV-JOCHJYFZSA-N 2 0 359.517 4.497 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)cc1 ZINC000563154069 568305149 /nfs/dbraw/zinc/30/51/49/568305149.db2.gz JEMDBOWZQMQTHV-KRWDZBQOSA-N 2 0 365.702 4.338 20 0 FIADRP CC(C)COC1CC[NH+](CC[C@H](C)[NH+]2CCC(OCC(C)C)CC2)CC1 ZINC000431603375 568383007 /nfs/dbraw/zinc/38/30/07/568383007.db2.gz ITLLMRKWOHGKJO-FQEVSTJZSA-N 2 0 368.606 4.039 20 0 FIADRP Cc1nc(C[N@@H+]2CCCC23CCN(c2ccc(C)c(C)[nH+]2)CC3)cs1 ZINC001164693838 719807479 /nfs/dbraw/zinc/80/74/79/719807479.db2.gz RMTLENSGMDIUME-UHFFFAOYSA-N 2 0 356.539 4.098 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+](C3CCCC3)CC2)nc1 ZINC001165033364 721862003 /nfs/dbraw/zinc/86/20/03/721862003.db2.gz LBHSWMKRMCXELE-OAQYLSRUSA-N 2 0 356.558 4.083 20 0 FIADRP CC[NH+](CC)C1CCN(c2[nH+]ccc3c2ccn3Cc2ccccc2)CC1 ZINC001165053124 722003475 /nfs/dbraw/zinc/00/34/75/722003475.db2.gz JXGWYTOLWLZVJB-UHFFFAOYSA-N 2 0 362.521 4.395 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccc3c2OCO3)ccc1OC ZINC000182539286 1125555782 /nfs/dbraw/zinc/55/57/82/1125555782.db2.gz GKAYVEKAHAUGNO-INIZCTEOSA-N 2 0 370.493 4.117 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(CO)c2)cc1C[NH+]1CCCCC1 ZINC000182851903 1125656622 /nfs/dbraw/zinc/65/66/22/1125656622.db2.gz DZDJFYFGCUZVDB-GOSISDBHSA-N 2 0 368.521 4.024 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)Cc2c(C)noc2C)ccc1OC ZINC000182998537 1125714454 /nfs/dbraw/zinc/71/44/54/1125714454.db2.gz LEFFIMZILKWXRF-CVEARBPZSA-N 2 0 373.541 4.424 20 0 FIADRP COc1ccc(C(C)(C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000153157010 1125748718 /nfs/dbraw/zinc/74/87/18/1125748718.db2.gz FNUSUBIBLOCQBC-UHFFFAOYSA-N 2 0 374.569 4.368 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H]2CSCCS2)ccc1OC ZINC000183093642 1125750002 /nfs/dbraw/zinc/75/00/02/1125750002.db2.gz WXNKWBOJXIGAMH-QAPCUYQASA-N 2 0 368.612 4.036 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546896 1079671641 /nfs/dbraw/zinc/67/16/41/1079671641.db2.gz WMJZWRFBSIFUSZ-UNMCSNQZSA-N 2 0 368.496 4.382 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000544833165 1079753366 /nfs/dbraw/zinc/75/33/66/1079753366.db2.gz QCUZNTITENIMDK-OAQYLSRUSA-N 2 0 357.929 4.340 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)ccc1F ZINC000153402283 1125789355 /nfs/dbraw/zinc/78/93/55/1125789355.db2.gz GCZBTSDAOUPPEL-OAHLLOKOSA-N 2 0 362.514 4.459 20 0 FIADRP C[C@@H](C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1)OCc1ccccc1 ZINC001208702183 1080091541 /nfs/dbraw/zinc/09/15/41/1080091541.db2.gz IOQJWMMMEOLCLU-NRFANRHFSA-N 2 0 364.533 4.190 20 0 FIADRP CC(C)[C@@H](CN[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC001648791880 1080495346 /nfs/dbraw/zinc/49/53/46/1080495346.db2.gz CQSHYYJQVCOPJW-ACIOBRDBSA-N 2 0 357.586 4.168 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)CC3 ZINC000180808736 1080549964 /nfs/dbraw/zinc/54/99/64/1080549964.db2.gz SFEKCWBYIIILJW-LJQANCHMSA-N 2 0 374.532 4.235 20 0 FIADRP Cc1cccc2c(C)cc(N3Cc4ccccc4C4(CC[NH2+]CC4)C3)nc12 ZINC001167159489 1080766629 /nfs/dbraw/zinc/76/66/29/1080766629.db2.gz IGOLLFVLNFBJCV-UHFFFAOYSA-N 2 0 357.501 4.493 20 0 FIADRP CCOc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC ZINC000312519856 1080965311 /nfs/dbraw/zinc/96/53/11/1080965311.db2.gz OIRGYUJSQYDGPM-WIYYLYMNSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cn4ccnc4s3)cc2)C1 ZINC001648808200 1081111825 /nfs/dbraw/zinc/11/18/25/1081111825.db2.gz DWEGYHAEONEBSH-IRXDYDNUSA-N 2 0 368.550 4.164 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000655686758 1081114024 /nfs/dbraw/zinc/11/40/24/1081114024.db2.gz CFMJUXAEBVRHJW-KRWDZBQOSA-N 2 0 360.505 4.364 20 0 FIADRP C[C@H](C[NH2+]C1CCN(C[C@H]2CCCO2)CC1)c1c(Cl)cccc1Cl ZINC000655705176 1081125754 /nfs/dbraw/zinc/12/57/54/1081125754.db2.gz YIKWJUZFMPQBLT-GDBMZVCRSA-N 2 0 371.352 4.330 20 0 FIADRP CCC1(C[NH2+][C@H]2CCCn3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000655738883 1081157171 /nfs/dbraw/zinc/15/71/71/1081157171.db2.gz ZAOBNUOOCJXJNY-FQEVSTJZSA-N 2 0 352.526 4.000 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3C[C@@H]([NH+](C)C)C3)s2)cc1 ZINC000655806441 1081214821 /nfs/dbraw/zinc/21/48/21/1081214821.db2.gz VYFVMDWTEAEKDW-JLJPHGGASA-N 2 0 359.539 4.118 20 0 FIADRP FC(F)(F)Oc1cccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000655820808 1081232104 /nfs/dbraw/zinc/23/21/04/1081232104.db2.gz LYBTVNYICCQRNX-SJORKVTESA-N 2 0 368.443 4.223 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc(Oc3ccccn3)c2)C1 ZINC001648816583 1081237362 /nfs/dbraw/zinc/23/73/62/1081237362.db2.gz APADOGLXEPPCHM-IBGZPJMESA-N 2 0 353.510 4.476 20 0 FIADRP Cc1nn(-c2ccccc2F)cc1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC001648817036 1081239549 /nfs/dbraw/zinc/23/95/49/1081239549.db2.gz RMDLWOMVWFEBDL-QGZVFWFLSA-N 2 0 358.505 4.064 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000121777848 1081252368 /nfs/dbraw/zinc/25/23/68/1081252368.db2.gz IVHTXDGTXJUWKK-QGZVFWFLSA-N 2 0 369.553 4.483 20 0 FIADRP C[NH+](C)CCOc1ccc(CNc2ccc(N3CCCCC3)cc2)cc1 ZINC001648857133 1081311637 /nfs/dbraw/zinc/31/16/37/1081311637.db2.gz NQCZNWSBWZIJIC-UHFFFAOYSA-N 2 0 353.510 4.229 20 0 FIADRP CC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000397710767 1081451595 /nfs/dbraw/zinc/45/15/95/1081451595.db2.gz YTHOSBCTXDQPPM-NRFANRHFSA-N 2 0 372.940 4.408 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H](OCc2ccccc2)c2ccc(Cl)cc2)C1 ZINC000580095124 1081589594 /nfs/dbraw/zinc/58/95/94/1081589594.db2.gz IXNWSZLXPVXFGV-HKBOAZHASA-N 2 0 358.913 4.457 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)c2ccccc21 ZINC000580218712 1081758082 /nfs/dbraw/zinc/75/80/82/1081758082.db2.gz UOSXUTKFOHCQBA-YADHBBJMSA-N 2 0 370.537 4.165 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312782665 1081841705 /nfs/dbraw/zinc/84/17/05/1081841705.db2.gz ASJLKICJBLSYOD-NQIIRXRSSA-N 2 0 368.521 4.094 20 0 FIADRP Cc1cc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)ccc1Oc1cccnc1 ZINC000580483654 1081970851 /nfs/dbraw/zinc/97/08/51/1081970851.db2.gz OPBCYJSMHOUWQX-TZIWHRDSSA-N 2 0 351.494 4.098 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccc5ccccc5n4)C[C@@H]3C2)cc1 ZINC000312889948 1081993535 /nfs/dbraw/zinc/99/35/35/1081993535.db2.gz HZIJYRRZICEWCR-VXKWHMMOSA-N 2 0 357.501 4.189 20 0 FIADRP CCC[C@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471611263 1082094181 /nfs/dbraw/zinc/09/41/81/1082094181.db2.gz BRPNZCZRWSLEDF-KXBFYZLASA-N 2 0 372.384 4.450 20 0 FIADRP CSC1(C[NH2+][C@H]2CCCc3c4cc(C)ccc4[nH]c32)CC[NH+](C)CC1 ZINC000580862749 1082196407 /nfs/dbraw/zinc/19/64/07/1082196407.db2.gz JHPLDZMROBQIEA-IBGZPJMESA-N 2 0 357.567 4.271 20 0 FIADRP FC(F)(F)[C@@H]1CC([NH2+]C2CCN(C3CC3)CC2)C[C@@H](C(F)(F)F)C1 ZINC000656472382 1082455395 /nfs/dbraw/zinc/45/53/95/1082455395.db2.gz DRLJOPOHKOBQHX-QWRGUYRKSA-N 2 0 358.370 4.112 20 0 FIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000581518264 1082634431 /nfs/dbraw/zinc/63/44/31/1082634431.db2.gz UBHVRGQQHIUSCS-CQSZACIVSA-N 2 0 356.963 4.217 20 0 FIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)c1ccccc1Cl ZINC000581544903 1082652981 /nfs/dbraw/zinc/65/29/81/1082652981.db2.gz KGQGYDMSHKJKPM-FOIQADDNSA-N 2 0 373.928 4.173 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000581558888 1082662204 /nfs/dbraw/zinc/66/22/04/1082662204.db2.gz DXBBFTRJGWDQJG-QZTJIDSGSA-N 2 0 355.482 4.022 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)C[C@H](C)c2cccc(Br)c2)CC1 ZINC000510434806 1082702089 /nfs/dbraw/zinc/70/20/89/1082702089.db2.gz GWBVXVIDUOJPEA-HNNXBMFYSA-N 2 0 353.348 4.359 20 0 FIADRP COc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)cc1 ZINC000656785102 1082769902 /nfs/dbraw/zinc/76/99/02/1082769902.db2.gz IKGDDYIPFQWUAX-GOSISDBHSA-N 2 0 371.550 4.030 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CCC2 ZINC000684420957 1082896336 /nfs/dbraw/zinc/89/63/36/1082896336.db2.gz YWLPIWZHSHTHBU-HSZRJFAPSA-N 2 0 368.496 4.468 20 0 FIADRP COc1cc(F)c(F)cc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001143400187 1082948373 /nfs/dbraw/zinc/94/83/73/1082948373.db2.gz RCBPUNLUJHYRPC-UHFFFAOYSA-N 2 0 374.475 4.317 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)CC1 ZINC000430745831 1083145345 /nfs/dbraw/zinc/14/53/45/1083145345.db2.gz FOLQJQCIBNDLAJ-KOMQPUFPSA-N 2 0 369.322 4.298 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000430758103 1083146602 /nfs/dbraw/zinc/14/66/02/1083146602.db2.gz YZBXQAQJWXFOCM-RHRATHSCSA-N 2 0 369.322 4.153 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000430922874 1083237234 /nfs/dbraw/zinc/23/72/34/1083237234.db2.gz CREZHEZBEFXFAT-IRXDYDNUSA-N 2 0 351.494 4.059 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000430949514 1083250089 /nfs/dbraw/zinc/25/00/89/1083250089.db2.gz CVLSFQKWLFBKJQ-GFCCVEGCSA-N 2 0 369.456 4.388 20 0 FIADRP CO[C@]1(C)C[C@@H]([N@H+](C)CCC[NH+]2CCC(Cc3ccccc3)CC2)C1(C)C ZINC001167493447 1083269322 /nfs/dbraw/zinc/26/93/22/1083269322.db2.gz YUYHXTVSDICIIE-ISKFKSNPSA-N 2 0 372.597 4.467 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC000510748413 1083292539 /nfs/dbraw/zinc/29/25/39/1083292539.db2.gz IEUDDIOAANQOLM-IBGZPJMESA-N 2 0 363.343 4.433 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C/C(C)=C\c2ccccc2COC)c1 ZINC000510871669 1083349650 /nfs/dbraw/zinc/34/96/50/1083349650.db2.gz IUTQTEQYAKDLJH-UYRXBGFRSA-N 2 0 352.522 4.478 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccccc3)o2)CC1 ZINC000101726829 1083378500 /nfs/dbraw/zinc/37/85/00/1083378500.db2.gz KNOJECYIVDYQSJ-KRWDZBQOSA-N 2 0 356.514 4.242 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCOCC1 ZINC000658319911 1083405889 /nfs/dbraw/zinc/40/58/89/1083405889.db2.gz JSEDNDRBDVPYFL-FCHUYYIVSA-N 2 0 356.554 4.084 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCC4)C[C@H]2C1 ZINC000658318867 1083406395 /nfs/dbraw/zinc/40/63/95/1083406395.db2.gz TVRUZLWZWVEGDR-MFKCLSPESA-N 2 0 368.565 4.082 20 0 FIADRP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658318608 1083406754 /nfs/dbraw/zinc/40/67/54/1083406754.db2.gz QQQXTHFNBGCCGN-IEBWSBKVSA-N 2 0 365.546 4.339 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCC4)C[C@H]2C1 ZINC000658318864 1083406765 /nfs/dbraw/zinc/40/67/65/1083406765.db2.gz TVRUZLWZWVEGDR-JFDBCFPISA-N 2 0 368.565 4.082 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1OC(F)F ZINC000658353109 1083424116 /nfs/dbraw/zinc/42/41/16/1083424116.db2.gz BSGLWXDRTVKUSC-ZDUSSCGKSA-N 2 0 356.432 4.200 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000658358040 1083428022 /nfs/dbraw/zinc/42/80/22/1083428022.db2.gz XWIGLZJFAIIJEO-HZPDHXFCSA-N 2 0 357.567 4.500 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000658358042 1083428108 /nfs/dbraw/zinc/42/81/08/1083428108.db2.gz XWIGLZJFAIIJEO-JKSUJKDBSA-N 2 0 357.567 4.500 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000092566791 1083435144 /nfs/dbraw/zinc/43/51/44/1083435144.db2.gz MNDHAZRMDCFWGZ-UHFFFAOYSA-N 2 0 364.574 4.274 20 0 FIADRP C[C@H](CCc1ccc(Br)cc1)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000132527234 1083436564 /nfs/dbraw/zinc/43/65/64/1083436564.db2.gz XXWXOEUGSKVUJS-CABCVRRESA-N 2 0 353.348 4.090 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000548483605 1083466158 /nfs/dbraw/zinc/46/61/58/1083466158.db2.gz VLXBSXCSTKXHLL-YLJYHZDGSA-N 2 0 356.485 4.225 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000510952623 1083529259 /nfs/dbraw/zinc/52/92/59/1083529259.db2.gz RXRCXPFDJBRLLG-OAQYLSRUSA-N 2 0 357.586 4.140 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3Cl)C2)[C@H](C)C1 ZINC000510979876 1083554671 /nfs/dbraw/zinc/55/46/71/1083554671.db2.gz FSHYRVLFJBIYCQ-FRVUEHSBSA-N 2 0 364.961 4.313 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)CCO1 ZINC000181272933 1083850714 /nfs/dbraw/zinc/85/07/14/1083850714.db2.gz JXXSDKJJJJQIHW-WEYGHZABSA-N 2 0 362.558 4.261 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC000215636596 1083907608 /nfs/dbraw/zinc/90/76/08/1083907608.db2.gz SWIFNNVVBPMHBR-CQSZACIVSA-N 2 0 365.949 4.264 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc4c(c3)OCO4)CCCCC2)CC1(C)C ZINC001648924662 1083933688 /nfs/dbraw/zinc/93/36/88/1083933688.db2.gz MAVIIYYKFCHCBL-SFHVURJKSA-N 2 0 358.526 4.080 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CC[NH+](C)CC1 ZINC000133421250 1084117165 /nfs/dbraw/zinc/11/71/65/1084117165.db2.gz CKTZDVUZAUEOEC-IBGZPJMESA-N 3 0 365.565 4.235 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]Cc3ccccc3OCC[NH+](C)C)cc2c1C ZINC000472040438 1084143805 /nfs/dbraw/zinc/14/38/05/1084143805.db2.gz DKWJTGNDBSLAQS-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP CCn1nc(CNCc2ccccc2C[N@H+](C)C(C)C)c2ccccc21 ZINC000472072172 1084238850 /nfs/dbraw/zinc/23/88/50/1084238850.db2.gz CZTRTCPJPAUWPM-UHFFFAOYSA-N 2 0 350.510 4.186 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000657300827 1084324414 /nfs/dbraw/zinc/32/44/14/1084324414.db2.gz VCACQTQVPPGWLM-UHFFFAOYSA-N 2 0 351.519 4.470 20 0 FIADRP CC(C)n1ccnc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000657304336 1084349411 /nfs/dbraw/zinc/34/94/11/1084349411.db2.gz YSMNAWAAHSLWLT-UHFFFAOYSA-N 2 0 362.521 4.482 20 0 FIADRP C[C@@H](NCc1ccc(C[NH+]2CCCCCC2)cc1)c1cc2n(n1)CCC2 ZINC000414079123 1084467051 /nfs/dbraw/zinc/46/70/51/1084467051.db2.gz RLXUOPRVPPSSHU-GOSISDBHSA-N 2 0 352.526 4.056 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1)C[NH+]1CCCC1 ZINC000613263109 1084520632 /nfs/dbraw/zinc/52/06/32/1084520632.db2.gz CFWNSIQILQOWMV-SFHVURJKSA-N 2 0 356.485 4.226 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000613274012 1084532877 /nfs/dbraw/zinc/53/28/77/1084532877.db2.gz SOSCXDCFJNSSNL-HXUWFJFHSA-N 2 0 356.510 4.332 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657338071 1084631969 /nfs/dbraw/zinc/63/19/69/1084631969.db2.gz IAIAKQKAGGOATI-LJQANCHMSA-N 2 0 370.403 4.036 20 0 FIADRP COc1ccsc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000472165656 1084636436 /nfs/dbraw/zinc/63/64/36/1084636436.db2.gz QTRJNELAMIOJTQ-MRXNPFEDSA-N 2 0 360.523 4.082 20 0 FIADRP CC[C@@H]([NH2+]C1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@@H]1CC1(C)C ZINC000414143271 1084687369 /nfs/dbraw/zinc/68/73/69/1084687369.db2.gz IQESQNYGSMERGJ-LEWJYISDSA-N 2 0 357.542 4.024 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582141543 1084697189 /nfs/dbraw/zinc/69/71/89/1084697189.db2.gz QXTUKTBSKSVRKX-GIWBLDEGSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cccc(Br)c21 ZINC000414145979 1084698113 /nfs/dbraw/zinc/69/81/13/1084698113.db2.gz BNWMMFITUWBTSY-PXAZEXFGSA-N 2 0 356.267 4.435 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414181547 1084752457 /nfs/dbraw/zinc/75/24/57/1084752457.db2.gz MMPTYFPHZBNBLK-VQIMIIECSA-N 2 0 357.567 4.425 20 0 FIADRP Brc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414183798 1084760733 /nfs/dbraw/zinc/76/07/33/1084760733.db2.gz NNQVVTQZRNRONT-KRWDZBQOSA-N 2 0 372.266 4.100 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000414184553 1084761781 /nfs/dbraw/zinc/76/17/81/1084761781.db2.gz NZDMNHRDGNXDMQ-UTKZUKDTSA-N 2 0 357.929 4.340 20 0 FIADRP Brc1ccc([C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)s1 ZINC000414187432 1084773078 /nfs/dbraw/zinc/77/30/78/1084773078.db2.gz PVLWBLLHVYHDNS-INIZCTEOSA-N 2 0 362.296 4.399 20 0 FIADRP CC1(C)CCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559891162 1084907394 /nfs/dbraw/zinc/90/73/94/1084907394.db2.gz SZODSNZOIKUYCN-LEWJYISDSA-N 2 0 356.554 4.084 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(-c3cccc(F)c3)nc2C)c1 ZINC000414322713 1085058107 /nfs/dbraw/zinc/05/81/07/1085058107.db2.gz FYTBWZBRLYASED-UHFFFAOYSA-N 2 0 366.484 4.061 20 0 FIADRP c1cc(Oc2ccccc2)oc1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000657535345 1085444276 /nfs/dbraw/zinc/44/42/76/1085444276.db2.gz KNBYIXMNVBHOFK-UHFFFAOYSA-N 2 0 370.493 4.053 20 0 FIADRP Cc1ccccc1-c1noc([C@@H](C)[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)n1 ZINC000074990225 1085509677 /nfs/dbraw/zinc/50/96/77/1085509677.db2.gz DEPGCMVIIMQKNU-QGZVFWFLSA-N 2 0 356.514 4.158 20 0 FIADRP C[C@@H](COc1c(F)cccc1F)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000657628196 1085722502 /nfs/dbraw/zinc/72/25/02/1085722502.db2.gz GIEKXUYUQBOONA-HNNXBMFYSA-N 2 0 352.469 4.119 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)cc1 ZINC000652187148 1085748955 /nfs/dbraw/zinc/74/89/55/1085748955.db2.gz DCDDUHMIZZHTFS-DHIUTWEWSA-N 2 0 370.512 4.269 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cccc2ccsc21 ZINC000652219471 1085754636 /nfs/dbraw/zinc/75/46/36/1085754636.db2.gz AODVGVRTKHRASY-JXFKEZNVSA-N 2 0 351.519 4.297 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582844803 1085822416 /nfs/dbraw/zinc/82/24/16/1085822416.db2.gz NQBXNGREMGYUAW-RBBKRZOGSA-N 3 0 357.586 4.284 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000500438315 1085990150 /nfs/dbraw/zinc/99/01/50/1085990150.db2.gz GKDGHHUPYMPVOX-UHFFFAOYSA-N 2 0 371.903 4.007 20 0 FIADRP Cc1cnn(CCCCC[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000246990316 1086146096 /nfs/dbraw/zinc/14/60/96/1086146096.db2.gz HXFMWMOBUHTCNT-GMAHTHKFSA-N 2 0 368.569 4.347 20 0 FIADRP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Cl)c(Cl)c1 ZINC000583107292 1086197750 /nfs/dbraw/zinc/19/77/50/1086197750.db2.gz PUHSTYQEMZMGBR-CYBMUJFWSA-N 2 0 368.308 4.180 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cnc2ccsc2c1 ZINC000162518277 1086235190 /nfs/dbraw/zinc/23/51/90/1086235190.db2.gz ILDVXCOMQRMXKJ-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000662252123 1086378829 /nfs/dbraw/zinc/37/88/29/1086378829.db2.gz MDLWMARRIQDLMC-UHFFFAOYSA-N 2 0 368.908 4.081 20 0 FIADRP Clc1ccccc1OC1CC[NH+](Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000662276994 1086389146 /nfs/dbraw/zinc/38/91/46/1086389146.db2.gz MXFQZGOILWHPEX-UHFFFAOYSA-N 2 0 356.897 4.029 20 0 FIADRP Fc1ccccc1-c1nc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cs1 ZINC000662292926 1086399193 /nfs/dbraw/zinc/39/91/93/1086399193.db2.gz POBIPMUAONTSFC-MRXNPFEDSA-N 2 0 359.514 4.161 20 0 FIADRP C[C@@H]1CCC[N@H+](CCC(=O)Nc2cccc3ccccc32)[C@@H]1CCC[NH3+] ZINC000662314542 1086410197 /nfs/dbraw/zinc/41/01/97/1086410197.db2.gz NDKKAWMEKFTUMH-DYESRHJHSA-N 2 0 353.510 4.008 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(OCc3ccncc3)cc2)[C@@H]1CCC[NH3+] ZINC000662316786 1086412060 /nfs/dbraw/zinc/41/20/60/1086412060.db2.gz NVJJUNKDAAEHHT-XMSQKQJNSA-N 2 0 353.510 4.000 20 0 FIADRP C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662328004 1086418108 /nfs/dbraw/zinc/41/81/08/1086418108.db2.gz XOPYXSLRPDQKTG-HNNXBMFYSA-N 2 0 372.944 4.471 20 0 FIADRP C[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1sccc1Br ZINC000663468938 1086570373 /nfs/dbraw/zinc/57/03/73/1086570373.db2.gz NOIAPLAPBRNZQX-OCCSQVGLSA-N 2 0 357.361 4.283 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC000511993392 1086599567 /nfs/dbraw/zinc/59/95/67/1086599567.db2.gz XIMQYFAOZPKLHL-WMUCXUQKSA-N 2 0 356.460 4.478 20 0 FIADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000663500476 1086612279 /nfs/dbraw/zinc/61/22/79/1086612279.db2.gz SXKMJLUTHWOFLW-OAHLLOKOSA-N 2 0 368.344 4.036 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2ccc(C(=O)OC)cc2)CC1 ZINC001167826903 1086619666 /nfs/dbraw/zinc/61/96/66/1086619666.db2.gz RTGRHSVBYODLEF-SFHVURJKSA-N 2 0 360.542 4.163 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+][C@H]3CCC34CCOCC4)cc2)C1 ZINC000548794518 1086672203 /nfs/dbraw/zinc/67/22/03/1086672203.db2.gz KDZKWXYFWDUTLN-KNKQGSTJSA-N 2 0 356.554 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167834825 1086690167 /nfs/dbraw/zinc/69/01/67/1086690167.db2.gz NAYQAPAUOKBXST-RBUKOAKNSA-N 2 0 369.594 4.217 20 0 FIADRP Cc1ccc(CCC[NH2+][C@H]2CCN(Cc3ccccc3)CC2(C)C)cn1 ZINC000583453749 1086696860 /nfs/dbraw/zinc/69/68/60/1086696860.db2.gz FGJSGKLGTDHGJB-QFIPXVFZSA-N 2 0 351.538 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2nc3ccccc3n2C)CC1 ZINC001167838376 1086711410 /nfs/dbraw/zinc/71/14/10/1086711410.db2.gz UDBDHYXIOUYMME-GOSISDBHSA-N 2 0 356.558 4.263 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(COc2cccc(OC)c2)CC1 ZINC001167837892 1086712368 /nfs/dbraw/zinc/71/23/68/1086712368.db2.gz NHWDPXIOTDLFSC-IBGZPJMESA-N 2 0 362.558 4.297 20 0 FIADRP CC[N@H+](Cc1ccc(Br)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000583467751 1086714069 /nfs/dbraw/zinc/71/40/69/1086714069.db2.gz QWDONDSNZKSFHZ-UHFFFAOYSA-N 2 0 351.288 4.126 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@@H](Sc2ccccc2OC)C1 ZINC001167839646 1086715606 /nfs/dbraw/zinc/71/56/06/1086715606.db2.gz AZMVNJBAIZKXLK-QZTJIDSGSA-N 2 0 350.572 4.372 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 ZINC001167841612 1086737812 /nfs/dbraw/zinc/73/78/12/1086737812.db2.gz NCHWNZDSRYBIRU-FHWLQOOXSA-N 2 0 369.594 4.265 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc4occc4c3)CC2)cc1 ZINC000512099707 1086764623 /nfs/dbraw/zinc/76/46/23/1086764623.db2.gz OVIOHSQQUITFLV-UHFFFAOYSA-N 2 0 364.489 4.443 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CCC2(C[NH3+])CC2)c(-c2ccccc2Cl)n1 ZINC000650713417 1086786970 /nfs/dbraw/zinc/78/69/70/1086786970.db2.gz RZCXXDSELPEMQW-UHFFFAOYSA-N 2 0 360.933 4.177 20 0 FIADRP c1c2cnccc2oc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657772133 1086814978 /nfs/dbraw/zinc/81/49/78/1086814978.db2.gz KBXGAALNMIRDLT-FQEVSTJZSA-N 2 0 361.489 4.220 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+]CC3CCC(c4ccccc4)CC3)CC2)CC1 ZINC000583660571 1086903745 /nfs/dbraw/zinc/90/37/45/1086903745.db2.gz DARBKPOSOANQJV-UHFFFAOYSA-N 2 0 369.597 4.109 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)c(F)c1 ZINC000650754652 1086962420 /nfs/dbraw/zinc/96/24/20/1086962420.db2.gz NVBHROSSOVBBOQ-NRFANRHFSA-N 2 0 354.469 4.167 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(OC)c(OC)c2)CC1)CC1CC1 ZINC000536142714 1086988876 /nfs/dbraw/zinc/98/88/76/1086988876.db2.gz ZWTPZUXYIKXKHR-UHFFFAOYSA-N 2 0 360.542 4.038 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000584173222 1087201559 /nfs/dbraw/zinc/20/15/59/1087201559.db2.gz ZVXKTDOBRPKQHA-FDDCHVKYSA-N 2 0 363.505 4.075 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2COC3(CCC3)C2)cc1 ZINC000657833206 1087205664 /nfs/dbraw/zinc/20/56/64/1087205664.db2.gz PSMFLFYKIQYMSM-NRFANRHFSA-N 2 0 350.506 4.216 20 0 FIADRP Fc1cccc(OCc2ccc(C[NH2+]C3CCN(C4CC4)CC3)cc2)c1 ZINC000647325342 1087220274 /nfs/dbraw/zinc/22/02/74/1087220274.db2.gz CNJQKMAJOMVXIR-UHFFFAOYSA-N 2 0 354.469 4.121 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2cc3cnccc3o2)cc1 ZINC000657839682 1087263226 /nfs/dbraw/zinc/26/32/26/1087263226.db2.gz YRRGLILZYPGHLZ-QGZVFWFLSA-N 2 0 367.493 4.399 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3cc(OC)c(OC)cc3c2)C1 ZINC000657845362 1087291653 /nfs/dbraw/zinc/29/16/53/1087291653.db2.gz NJAPFPCXTFDFPG-IRXDYDNUSA-N 2 0 356.510 4.240 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657870368 1087475424 /nfs/dbraw/zinc/47/54/24/1087475424.db2.gz CXHRDNZMRYKDGC-INIZCTEOSA-N 2 0 369.534 4.130 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000657886877 1087536283 /nfs/dbraw/zinc/53/62/83/1087536283.db2.gz CEFGKXXSJYCFAW-SJBKTWHCSA-N 2 0 372.597 4.468 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CCO)c2ccccc2F)CC1 ZINC000647345988 1087541807 /nfs/dbraw/zinc/54/18/07/1087541807.db2.gz PWNDOPWGEABHCE-YABDQXBESA-N 2 0 370.512 4.282 20 0 FIADRP Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1ccc(OCC[NH+](C)C)cc1 ZINC000685463627 1087575346 /nfs/dbraw/zinc/57/53/46/1087575346.db2.gz RKLONEQZHPFMCP-OAQYLSRUSA-N 2 0 370.541 4.084 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000708567393 1087586996 /nfs/dbraw/zinc/58/69/96/1087586996.db2.gz AYRDENNWAUIKEL-SXWKCWPCSA-N 2 0 366.549 4.374 20 0 FIADRP Cc1cn[nH]c1C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000685612748 1087641758 /nfs/dbraw/zinc/64/17/58/1087641758.db2.gz LCCNXYYXRYRWKP-UHFFFAOYSA-N 2 0 360.505 4.271 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C3CC[NH+](C(C)C)CC3)c2C1 ZINC000081342952 1087677043 /nfs/dbraw/zinc/67/70/43/1087677043.db2.gz PZTXBLMAXDQSPC-UHFFFAOYSA-N 2 0 357.542 4.107 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CC1CC[NH+](C3CCOCC3)CC1)CCS2 ZINC000658068966 1087710277 /nfs/dbraw/zinc/71/02/77/1087710277.db2.gz BSZXXOUVEQJTPG-OAQYLSRUSA-N 2 0 374.594 4.321 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)cc1Cl ZINC000658069374 1087710896 /nfs/dbraw/zinc/71/08/96/1087710896.db2.gz PAPSHIJGOZIOFN-CQSZACIVSA-N 2 0 354.897 4.021 20 0 FIADRP Cc1ccc2cc([C@@H](C)[NH2+]CC3CC[NH+](C4CCOCC4)CC3)oc2c1 ZINC000658070794 1087710929 /nfs/dbraw/zinc/71/09/29/1087710929.db2.gz QRJGNFOEZDKDIS-QGZVFWFLSA-N 2 0 356.510 4.283 20 0 FIADRP CC1(C)[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C[C@H]1c1ccccc1 ZINC000658070145 1087711538 /nfs/dbraw/zinc/71/15/38/1087711538.db2.gz MVNXOSAGITXHAU-VXKWHMMOSA-N 2 0 356.554 4.049 20 0 FIADRP C[C@H]([NH2+]CCc1ccnc2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000658128783 1087732109 /nfs/dbraw/zinc/73/21/09/1087732109.db2.gz YOEYHLOZZHNPRC-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccnc4ccccc34)CC2)C1 ZINC000658125362 1087732530 /nfs/dbraw/zinc/73/25/30/1087732530.db2.gz BFJJAIOGLJLVSH-RXVVDRJESA-N 2 0 351.538 4.410 20 0 FIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658143217 1087735541 /nfs/dbraw/zinc/73/55/41/1087735541.db2.gz XSORSJHFQDGXHX-XLIONFOSSA-N 2 0 370.562 4.216 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](c3ccc(Cl)cc3)C3CC3)cc2)C1 ZINC000658137306 1087741404 /nfs/dbraw/zinc/74/14/04/1087741404.db2.gz GLCRBVPOYFJVAR-FGZHOGPDSA-N 2 0 370.924 4.148 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]C3c4ccccc4-c4ccccc43)cc2)C1 ZINC000658138385 1087743822 /nfs/dbraw/zinc/74/38/22/1087743822.db2.gz MRFJWKSSRJURMO-HXUWFJFHSA-N 2 0 370.496 4.113 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C(C)(C)c1ccccc1 ZINC000658166141 1087761682 /nfs/dbraw/zinc/76/16/82/1087761682.db2.gz MTOPJXNTJGFWIR-IBGZPJMESA-N 2 0 351.538 4.250 20 0 FIADRP CCOc1ccccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168132 1087764352 /nfs/dbraw/zinc/76/43/52/1087764352.db2.gz VVVSQRXXPZKTAL-GOSISDBHSA-N 2 0 353.510 4.043 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658206283 1087794547 /nfs/dbraw/zinc/79/45/47/1087794547.db2.gz IJJUEBKCPZCTPM-JFTIXFDTSA-N 2 0 364.533 4.059 20 0 FIADRP COCc1csc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000658209634 1087796439 /nfs/dbraw/zinc/79/64/39/1087796439.db2.gz IOGLQZBVELVBLF-ACDBMABISA-N 2 0 356.535 4.180 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000504900424 1087956386 /nfs/dbraw/zinc/95/63/86/1087956386.db2.gz XUJYDDZBNVXPAC-CTNGQTDRSA-N 2 0 355.570 4.083 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OCC(C)C ZINC000414813840 1088215941 /nfs/dbraw/zinc/21/59/41/1088215941.db2.gz UQNCIQVQIPCZCG-QGZVFWFLSA-N 2 0 356.510 4.430 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)cc2)cs1 ZINC000414812306 1088221843 /nfs/dbraw/zinc/22/18/43/1088221843.db2.gz QZXZZXGONDWKSW-HNNXBMFYSA-N 2 0 367.518 4.340 20 0 FIADRP FC(F)(F)c1ccc(-c2nc(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)cs2)cc1 ZINC000414827338 1088350698 /nfs/dbraw/zinc/35/06/98/1088350698.db2.gz KKALROSQKHCFFW-YIONKMFJSA-N 2 0 367.440 4.202 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000467314250 1088364884 /nfs/dbraw/zinc/36/48/84/1088364884.db2.gz JXWLXQRZHVCTLL-OAQYLSRUSA-N 2 0 356.485 4.453 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000311427433 1088376088 /nfs/dbraw/zinc/37/60/88/1088376088.db2.gz GFMNDPZIAUVGNT-PKOBYXMFSA-N 2 0 356.485 4.397 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCc4c3cccc4F)CC2)cc1 ZINC000513872336 1088477830 /nfs/dbraw/zinc/47/78/30/1088477830.db2.gz GVUGSANRKABKQX-QHCPKHFHSA-N 2 0 368.496 4.323 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311514044 1088708162 /nfs/dbraw/zinc/70/81/62/1088708162.db2.gz OEUDNMIWEYKUFT-UYAOXDASSA-N 2 0 350.506 4.184 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2Cc3ccccc3O2)CC1 ZINC000514084811 1088724407 /nfs/dbraw/zinc/72/44/07/1088724407.db2.gz RMHDYABZYXWDGG-LZBANZJXSA-N 2 0 350.506 4.023 20 0 FIADRP C[NH+](C/C=C/C[N@@H+](C)Cc1ccc(F)c(F)c1)Cc1ccc(F)c(F)c1 ZINC000613592052 1088749787 /nfs/dbraw/zinc/74/97/87/1088749787.db2.gz ZGQQQZXHYHJLFL-ONEGZZNKSA-N 2 0 366.402 4.363 20 0 FIADRP CCOCOc1ccc(C[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000782960920 1088751443 /nfs/dbraw/zinc/75/14/43/1088751443.db2.gz VTGPSCFDUKEVJM-LJQANCHMSA-N 2 0 368.521 4.375 20 0 FIADRP CCOCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000782969812 1088772362 /nfs/dbraw/zinc/77/23/62/1088772362.db2.gz XNPOGKFTAGYDJF-SIKLNZKXSA-N 2 0 368.521 4.060 20 0 FIADRP CO[C@@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000514146328 1088795923 /nfs/dbraw/zinc/79/59/23/1088795923.db2.gz WVKIABNBLQBMGE-NRFANRHFSA-N 2 0 373.928 4.271 20 0 FIADRP CC(C)[C@@H]1[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC12CCC2 ZINC000430107802 1088997464 /nfs/dbraw/zinc/99/74/64/1088997464.db2.gz YMWLOFAKJSLLCW-QFIPXVFZSA-N 2 0 355.570 4.228 20 0 FIADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000434777263 1089030820 /nfs/dbraw/zinc/03/08/20/1089030820.db2.gz PFGXKTYQVMNCIA-XMSQKQJNSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000434777261 1089031540 /nfs/dbraw/zinc/03/15/40/1089031540.db2.gz PFGXKTYQVMNCIA-GCJKJVERSA-N 2 0 374.569 4.091 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)o1 ZINC000415014072 1089050449 /nfs/dbraw/zinc/05/04/49/1089050449.db2.gz ZGFIYVSQRNJVOW-PKOBYXMFSA-N 2 0 364.493 4.048 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c(-c2ccccc2Cl)n1 ZINC000415029512 1089059524 /nfs/dbraw/zinc/05/95/24/1089059524.db2.gz DPOGLMIKYKAREG-HOCLYGCPSA-N 2 0 360.933 4.176 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415032693 1089069767 /nfs/dbraw/zinc/06/97/67/1089069767.db2.gz IDOCVIFOGYUVKS-OFNKIYASSA-N 2 0 374.532 4.124 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415033660 1089071881 /nfs/dbraw/zinc/07/18/81/1089071881.db2.gz JCTAPKNMWFXJNG-QUCCMNQESA-N 2 0 360.505 4.065 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 ZINC000415053354 1089088708 /nfs/dbraw/zinc/08/87/08/1089088708.db2.gz MNNSALUTZKGAPT-QGZVFWFLSA-N 2 0 370.390 4.337 20 0 FIADRP Cc1cccc(NC(=O)C[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1C ZINC000415055387 1089099819 /nfs/dbraw/zinc/09/98/19/1089099819.db2.gz ORDRDRBNUXOTKQ-UWJYYQICSA-N 2 0 353.510 4.090 20 0 FIADRP COc1ccc(Br)cc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415056641 1089101362 /nfs/dbraw/zinc/10/13/62/1089101362.db2.gz QARLIRMHKRWUJN-QGZVFWFLSA-N 2 0 363.299 4.028 20 0 FIADRP CCOc1cc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc(Cl)c1OC ZINC000415063186 1089113211 /nfs/dbraw/zinc/11/32/11/1089113211.db2.gz HAMDVCOZXODFGS-GOSISDBHSA-N 2 0 362.901 4.317 20 0 FIADRP C[C@@H]1C[C@@H](C[NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[NH2+]1 ZINC000415087251 1089147483 /nfs/dbraw/zinc/14/74/83/1089147483.db2.gz KTATWNNAQQQQLQ-CABCVRRESA-N 2 0 371.352 4.019 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000415101390 1089159997 /nfs/dbraw/zinc/15/99/97/1089159997.db2.gz BITOOXXZUMJLIO-CTNGQTDRSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000415101396 1089160717 /nfs/dbraw/zinc/16/07/17/1089160717.db2.gz BITOOXXZUMJLIO-PZJWPPBQSA-N 2 0 374.525 4.273 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C)C[C@H]3CCC[NH2+]3)s2)cc1 ZINC000415113006 1089172874 /nfs/dbraw/zinc/17/28/74/1089172874.db2.gz SECQYNBGRKEYIH-JKIFEVAISA-N 2 0 359.539 4.308 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)c1 ZINC000415117144 1089176488 /nfs/dbraw/zinc/17/64/88/1089176488.db2.gz BTNFINSPIUISRM-ISKFKSNPSA-N 2 0 364.533 4.380 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC([C@@H]4C[C@@H]([NH3+])CCO4)CC3)s2)cc1 ZINC000415127312 1089179921 /nfs/dbraw/zinc/17/99/21/1089179921.db2.gz QXJOAKCAPGGWQE-FPOVZHCZSA-N 2 0 370.562 4.442 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](CC3CCC(c4ccccc4)CC3)CC2)C1 ZINC000415121250 1089182987 /nfs/dbraw/zinc/18/29/87/1089182987.db2.gz HVRWTORUPAWDFC-MGRZCVLQSA-N 2 0 356.554 4.179 20 0 FIADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549237096 1089318152 /nfs/dbraw/zinc/31/81/52/1089318152.db2.gz JTVCHWFGUAHTKX-NLGAHDLLSA-N 2 0 350.934 4.267 20 0 FIADRP FC(F)(F)c1ccc(CN(Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1 ZINC000435373261 1089567296 /nfs/dbraw/zinc/56/72/96/1089567296.db2.gz UPHZRLDNWMBELT-LJQANCHMSA-N 2 0 363.427 4.245 20 0 FIADRP c1cc(C[N@H+](Cc2ccc3ncccc3c2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000435425096 1089642221 /nfs/dbraw/zinc/64/22/21/1089642221.db2.gz BTSHDNZLXSUHST-OAQYLSRUSA-N 2 0 363.530 4.441 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H]1C(=O)Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC001625891371 1089758105 /nfs/dbraw/zinc/75/81/05/1089758105.db2.gz HGGKQQIHKCNGEN-NQIIRXRSSA-N 2 0 357.542 4.120 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C)Oc1cccc(C(F)(F)F)c1 ZINC000469282784 1089914814 /nfs/dbraw/zinc/91/48/14/1089914814.db2.gz RXLNCEFAQUINLO-KYJSFNMBSA-N 2 0 358.448 4.183 20 0 FIADRP CC[NH2+]Cc1cccc(NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)c1 ZINC000415905861 1089987560 /nfs/dbraw/zinc/98/75/60/1089987560.db2.gz JBNLRAHXVVHCMS-KRWDZBQOSA-N 2 0 368.525 4.047 20 0 FIADRP CC(C)C[C@H](CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000415968595 1090049776 /nfs/dbraw/zinc/04/97/76/1090049776.db2.gz CPHPYCKSNUWDLJ-LAUBAEHRSA-N 2 0 368.525 4.032 20 0 FIADRP FC(F)(F)[C@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)C[C@@H](C(F)(F)F)C1 ZINC000925527635 1090270382 /nfs/dbraw/zinc/27/03/82/1090270382.db2.gz WAKSJMKUYJUCGV-LOWDOPEQSA-N 2 0 358.370 4.160 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cccs1 ZINC000163947942 1090285200 /nfs/dbraw/zinc/28/52/00/1090285200.db2.gz RMFMPFYOSOYWII-KRWDZBQOSA-N 2 0 374.550 4.089 20 0 FIADRP Fc1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000363863364 1090418014 /nfs/dbraw/zinc/41/80/14/1090418014.db2.gz KQVDCPTWPUDMDJ-UNMCSNQZSA-N 2 0 360.517 4.433 20 0 FIADRP COCC[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000651453559 1090989862 /nfs/dbraw/zinc/98/98/62/1090989862.db2.gz NCMNXGUJLHONFQ-RDTXWAMCSA-N 2 0 358.448 4.103 20 0 FIADRP Cc1cc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)n(C)n1 ZINC000418035821 1091033168 /nfs/dbraw/zinc/03/31/68/1091033168.db2.gz BGXDAGWGXQUZBZ-VZKPYBMVSA-N 2 0 372.944 4.086 20 0 FIADRP C[C@@H](C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500124448 1091052744 /nfs/dbraw/zinc/05/27/44/1091052744.db2.gz NSNYGCLCRVTKBK-DOTOQJQBSA-N 2 0 354.460 4.473 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2c(c1)ncn2[C@@H]1CCC[NH2+]CC1 ZINC001167752157 1091159839 /nfs/dbraw/zinc/15/98/39/1091159839.db2.gz QKDVRLZJWULBAV-UYAOXDASSA-N 2 0 369.557 4.027 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000390525826 1091182988 /nfs/dbraw/zinc/18/29/88/1091182988.db2.gz IYXDJGQIIOCBCY-URXFXBBRSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000388464733 1091370178 /nfs/dbraw/zinc/37/01/78/1091370178.db2.gz CYJZDMFTAFOJMX-FUHWJXTLSA-N 2 0 360.448 4.461 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388542616 1091509583 /nfs/dbraw/zinc/50/95/83/1091509583.db2.gz RSXFTXKBFWWFQN-KNQAVFIVSA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)c1cc(OCc2ccccc2)ccc1NC(=[NH2+])NCCCC[NH3+] ZINC001167883971 1091960090 /nfs/dbraw/zinc/96/00/90/1091960090.db2.gz OVGCJELOXSVWDX-UHFFFAOYSA-N 2 0 354.498 4.064 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312340 1092032062 /nfs/dbraw/zinc/03/20/62/1092032062.db2.gz CYTYUBXJWBYOPY-LZLYRXPVSA-N 2 0 369.553 4.220 20 0 FIADRP CCN1CCC([NH2+][C@@H](C)C[C@H]2CCCCCN2C(=O)OC(C)(C)C)CC1 ZINC000236859039 1092070044 /nfs/dbraw/zinc/07/00/44/1092070044.db2.gz PORMDSNBODFSPR-PKOBYXMFSA-N 2 0 367.578 4.019 20 0 FIADRP COc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1OCc1ccccc1 ZINC000093088568 1092226520 /nfs/dbraw/zinc/22/65/20/1092226520.db2.gz KLSWDLZRQLTZRV-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)c1 ZINC000509533707 1092342342 /nfs/dbraw/zinc/34/23/42/1092342342.db2.gz SXRSWLWLZVNOEX-UHFFFAOYSA-N 2 0 368.550 4.280 20 0 FIADRP C[C@@H]1CC([NH2+]CC2CCC3(COC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012827 1092378057 /nfs/dbraw/zinc/37/80/57/1092378057.db2.gz FOWGVZDJIPYLLS-RTBURBONSA-N 2 0 356.554 4.224 20 0 FIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000665271634 1092421086 /nfs/dbraw/zinc/42/10/86/1092421086.db2.gz PMMPUFPVFVSJGG-GOUWZUTHSA-N 2 0 361.533 4.146 20 0 FIADRP COc1cc([C@@H](C)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000521016649 1092424977 /nfs/dbraw/zinc/42/49/77/1092424977.db2.gz QGBCDIFIFFXLHY-IEBWSBKVSA-N 2 0 371.500 4.182 20 0 FIADRP Oc1cccc2c1CC[C@@H]2[NH2+]CCCCC[NH2+][C@H]1CCc2c1cccc2O ZINC000451179991 1092643889 /nfs/dbraw/zinc/64/38/89/1092643889.db2.gz SFXYOZXEOILGJT-SFTDATJTSA-N 2 0 366.505 4.122 20 0 FIADRP C[C@@H]1C[C@@H](NC[C@H](c2ccccc2)[NH+](C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014111 1092674953 /nfs/dbraw/zinc/67/49/53/1092674953.db2.gz KABPCMNFRVRFFP-WNXIRNOKSA-N 2 0 365.565 4.321 20 0 FIADRP c1cc2cc(CC[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)ccc2[nH]1 ZINC000442806909 1092765488 /nfs/dbraw/zinc/76/54/88/1092765488.db2.gz CVZYTKQKBWXWRO-NUNAXRQHSA-N 2 0 359.517 4.496 20 0 FIADRP COc1ccccc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001203439686 1092902397 /nfs/dbraw/zinc/90/23/97/1092902397.db2.gz UPBJJTIKDQYSTD-LEWJYISDSA-N 2 0 350.506 4.039 20 0 FIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1OC(C)C ZINC000521817500 1092935908 /nfs/dbraw/zinc/93/59/08/1092935908.db2.gz DWSVLKPMOXHVHN-RTBURBONSA-N 2 0 362.558 4.330 20 0 FIADRP COc1cc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1OC(C)C ZINC000521817495 1092936153 /nfs/dbraw/zinc/93/61/53/1092936153.db2.gz DWSVLKPMOXHVHN-KDURUIRLSA-N 2 0 362.558 4.330 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@@H](C)C1 ZINC000443099757 1092949895 /nfs/dbraw/zinc/94/98/95/1092949895.db2.gz UZWKNXUJISYUOL-SUMWQHHRSA-N 2 0 358.423 4.196 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@H]1C ZINC000512673414 1093120919 /nfs/dbraw/zinc/12/09/19/1093120919.db2.gz QMTNXSCQHGAOBH-SELNLUPBSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CC(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168017514 1093151390 /nfs/dbraw/zinc/15/13/90/1093151390.db2.gz AVOOOVGUTFYMBP-UDMCKFQASA-N 2 0 355.570 4.033 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000474053382 1093153357 /nfs/dbraw/zinc/15/33/57/1093153357.db2.gz DLNHPEXIFYAQAU-PKOBYXMFSA-N 2 0 350.497 4.355 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3[C@@H]3CCOC3)CC2)cc1 ZINC000474055850 1093160679 /nfs/dbraw/zinc/16/06/79/1093160679.db2.gz UAULLWJLDFENQF-DNVJHFABSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]1CC([NH2+]CCCOc2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168018830 1093173653 /nfs/dbraw/zinc/17/36/53/1093173653.db2.gz FKQAJDHXUBTAJU-PMACEKPBSA-N 2 0 352.522 4.487 20 0 FIADRP CCOC(=O)CCCCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168021513 1093241824 /nfs/dbraw/zinc/24/18/24/1093241824.db2.gz PFQULMFBUMJQAZ-RTBURBONSA-N 2 0 360.542 4.141 20 0 FIADRP [NH3+]C1CC[NH+](CCCC(=O)N[C@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000433113406 1093264659 /nfs/dbraw/zinc/26/46/59/1093264659.db2.gz DOEYONRPSCSMCX-JOCHJYFZSA-N 2 0 371.569 4.018 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000443602766 1093313370 /nfs/dbraw/zinc/31/33/70/1093313370.db2.gz KPKJNINUQMKENR-HXUWFJFHSA-N 2 0 350.934 4.150 20 0 FIADRP C[C@@H]1CC(NC(=[NH2+])c2cccnc2Cl)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168028551 1093537698 /nfs/dbraw/zinc/53/76/98/1093537698.db2.gz PHCRNWGKBSGWQS-HUUCEWRRSA-N 2 0 356.901 4.092 20 0 FIADRP FC(F)(F)c1cnc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000433306720 1093559276 /nfs/dbraw/zinc/55/92/76/1093559276.db2.gz SUNOTSUZNDXOOP-UHFFFAOYSA-N 2 0 369.456 4.164 20 0 FIADRP C[C@@H](Cc1cccc(O)c1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168031390 1093624927 /nfs/dbraw/zinc/62/49/27/1093624927.db2.gz YVXHRYACVWMSIA-VWNVYAMZSA-N 2 0 352.522 4.354 20 0 FIADRP C[C@@H]1CC(N[C@H]2CC[N@H+](CC(C)(C)C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032289 1093652272 /nfs/dbraw/zinc/65/22/72/1093652272.db2.gz HHHDHVJVLRNGLS-SBHAEUEKSA-N 2 0 357.586 4.138 20 0 FIADRP COc1ccc2nc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)sc2c1 ZINC000474355860 1093707661 /nfs/dbraw/zinc/70/76/61/1093707661.db2.gz TYRXGJVEVMDLSI-UHFFFAOYSA-N 2 0 367.518 4.191 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(OC)c(OC)cc2-c2ccccc2)C1 ZINC000067222652 1093718632 /nfs/dbraw/zinc/71/86/32/1093718632.db2.gz CFQKCAVGVOHYDK-GOSISDBHSA-N 2 0 368.521 4.192 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccco1 ZINC000513073786 1093776605 /nfs/dbraw/zinc/77/66/05/1093776605.db2.gz FTWYJEJJIBTFSP-HLAWJBBLSA-N 2 0 361.574 4.295 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000474474547 1093819600 /nfs/dbraw/zinc/81/96/00/1093819600.db2.gz HFRCMLJDVXUSSZ-IPMKNSEASA-N 2 0 362.558 4.298 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)C2CCSCC2)cc1 ZINC000474487903 1093834044 /nfs/dbraw/zinc/83/40/44/1093834044.db2.gz LJOJWRSFHAHCAD-KRWDZBQOSA-N 2 0 350.572 4.029 20 0 FIADRP Clc1ccccc1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000513099100 1093845943 /nfs/dbraw/zinc/84/59/43/1093845943.db2.gz QBIYIYITHVHMCL-UHFFFAOYSA-N 2 0 357.929 4.032 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000237111753 1093987749 /nfs/dbraw/zinc/98/77/49/1093987749.db2.gz RJWDJBQATUJAEG-UHFFFAOYSA-N 2 0 368.521 4.020 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000513337686 1094064464 /nfs/dbraw/zinc/06/44/64/1094064464.db2.gz JMDUIDIDWBMCCU-FBHQFGEZSA-N 2 0 364.533 4.348 20 0 FIADRP COCc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513487683 1094158139 /nfs/dbraw/zinc/15/81/39/1094158139.db2.gz IQOZTGBOZOPEIT-SIKLNZKXSA-N 2 0 352.522 4.223 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1OC ZINC000513499809 1094172738 /nfs/dbraw/zinc/17/27/38/1094172738.db2.gz IXZCODLMEVSWNO-NQIIRXRSSA-N 2 0 368.521 4.094 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc(OC)c1 ZINC000513501494 1094175298 /nfs/dbraw/zinc/17/52/98/1094175298.db2.gz SXWIVGYXQSOPIV-QUCCMNQESA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(Sc3ccccn3)o2)C1 ZINC000509928035 1094190021 /nfs/dbraw/zinc/19/00/21/1094190021.db2.gz QGFCJRGFOKBPFB-KRWDZBQOSA-N 2 0 359.539 4.428 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000513544602 1094205892 /nfs/dbraw/zinc/20/58/92/1094205892.db2.gz KGZMOPXIEYPHOE-MJGOQNOKSA-N 2 0 354.542 4.098 20 0 FIADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000513679421 1094264169 /nfs/dbraw/zinc/26/41/69/1094264169.db2.gz WZYLSPHOLSKMCZ-DODNOZFWSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@H](CCc1ccc(F)cc1F)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000513691256 1094312950 /nfs/dbraw/zinc/31/29/50/1094312950.db2.gz SUPSFQCBIIBNEM-MRXNPFEDSA-N 2 0 355.432 4.321 20 0 FIADRP C[N@@H+](Cc1cccc(OC(C)(C)C)n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501029610 1094427440 /nfs/dbraw/zinc/42/74/40/1094427440.db2.gz SRAWZXKFTMDSBJ-UHFFFAOYSA-N 2 0 368.525 4.002 20 0 FIADRP C[C@@H]1CC(N2CCC([NH+]3CCCCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039010 1094439591 /nfs/dbraw/zinc/43/95/91/1094439591.db2.gz AVPLUEQLBQFJNB-NHCUHLMSSA-N 2 0 369.597 4.378 20 0 FIADRP CC[C@@H](C)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501055090 1094466691 /nfs/dbraw/zinc/46/66/91/1094466691.db2.gz PZWPCXBCPGFBBL-NQIIRXRSSA-N 2 0 365.993 4.433 20 0 FIADRP CCOP(=O)(CCC[NH2+]C1CCC(C)([NH+]2CCCC2)CC1)OCC ZINC000896392703 1094547968 /nfs/dbraw/zinc/54/79/68/1094547968.db2.gz RFFHGFJNWTWEGW-UHFFFAOYSA-N 2 0 360.479 4.029 20 0 FIADRP C[C@@H]([C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)C1CCCCC1 ZINC000474798623 1094616834 /nfs/dbraw/zinc/61/68/34/1094616834.db2.gz DJZCNHQQUKCDTK-OALUTQOASA-N 2 0 358.570 4.338 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1OC ZINC000474818611 1094665351 /nfs/dbraw/zinc/66/53/51/1094665351.db2.gz UFSRATKZVORNJL-CVEARBPZSA-N 2 0 374.500 4.186 20 0 FIADRP Fc1ccc(C(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccc(F)cc2)cc1 ZINC000501404006 1094696555 /nfs/dbraw/zinc/69/65/55/1094696555.db2.gz FDRAPBHRRPYMRL-LEWJYISDSA-N 2 0 356.460 4.313 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501423268 1094702104 /nfs/dbraw/zinc/70/21/04/1094702104.db2.gz MWUNDAVKBLLCOI-KRWDZBQOSA-N 2 0 358.476 4.418 20 0 FIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCc2ccc(F)cc21 ZINC000501538886 1094764774 /nfs/dbraw/zinc/76/47/74/1094764774.db2.gz LJGURYUDFYJOMI-QFIPXVFZSA-N 2 0 353.485 4.447 20 0 FIADRP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420316157 1094878744 /nfs/dbraw/zinc/87/87/44/1094878744.db2.gz XZETYZARHDLIOK-IKICRFKJSA-N 2 0 359.901 4.424 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420386592 1094906719 /nfs/dbraw/zinc/90/67/19/1094906719.db2.gz VEJFNXIEBBODRF-OCBCSQNSSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](CCCSc3ccccc3Cl)CC2)C1 ZINC000420383126 1094906765 /nfs/dbraw/zinc/90/67/65/1094906765.db2.gz FDCUYIIJKXPWCV-AEFFLSMTSA-N 2 0 368.974 4.041 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000420382944 1094907407 /nfs/dbraw/zinc/90/74/07/1094907407.db2.gz PZSGATSBQDECBN-DNVCBOLYSA-N 2 0 364.942 4.273 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000502277584 1095297216 /nfs/dbraw/zinc/29/72/16/1095297216.db2.gz BIPWEYMVFHKNQH-SIKLNZKXSA-N 2 0 356.554 4.500 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCC23CCOCC3)C1 ZINC000502279877 1095299535 /nfs/dbraw/zinc/29/95/35/1095299535.db2.gz FRMJMRAICJBJIV-SIKLNZKXSA-N 2 0 356.554 4.357 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCO[C@@]3(CCSC3)C2)CC1 ZINC000280953147 1095462018 /nfs/dbraw/zinc/46/20/18/1095462018.db2.gz IWLADRHVKYSOJF-XLCOUGHXSA-N 2 0 374.594 4.074 20 0 FIADRP CCC[C@@H](C[N@@H+]1CCCN(C2CC[NH+](CC)CC2)CC1)c1ccccc1 ZINC000421380482 1095580890 /nfs/dbraw/zinc/58/08/90/1095580890.db2.gz VUZUUEXCPVRAGP-QFIPXVFZSA-N 2 0 357.586 4.062 20 0 FIADRP CC[N@H+](CCCCn1ccnc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000502693895 1095716744 /nfs/dbraw/zinc/71/67/44/1095716744.db2.gz LXRFROCERYZJBB-KNQAVFIVSA-N 2 0 354.542 4.129 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421821990 1095934538 /nfs/dbraw/zinc/93/45/38/1095934538.db2.gz VEWAXZXXRVHYNI-QFIPXVFZSA-N 2 0 372.484 4.016 20 0 FIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000414662594 1096372968 /nfs/dbraw/zinc/37/29/68/1096372968.db2.gz ZBZKLKLBBHEATD-UHFFFAOYSA-N 2 0 351.313 4.101 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422710854 1096460146 /nfs/dbraw/zinc/46/01/46/1096460146.db2.gz GGPSXIGDVIRGDC-QPPBQGQZSA-N 2 0 374.532 4.206 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C2CCC(C[NH3+])CC2)ccc1OCc1ccccc1 ZINC000422716301 1096469028 /nfs/dbraw/zinc/46/90/28/1096469028.db2.gz JXXMEJXBRUVNDH-MPQSDHOMSA-N 2 0 368.521 4.442 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000422715846 1096469316 /nfs/dbraw/zinc/46/93/16/1096469316.db2.gz MUSVDZGCJOFMBK-OXJNMPFZSA-N 2 0 354.473 4.024 20 0 FIADRP COc1cccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c1OC1CCCC1 ZINC000422727075 1096474257 /nfs/dbraw/zinc/47/42/57/1096474257.db2.gz GIHCMCHDVJHCJP-OAHLLOKOSA-N 2 0 369.509 4.030 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(-c2ccncc2)cc1 ZINC000422754796 1096484077 /nfs/dbraw/zinc/48/40/77/1096484077.db2.gz ATTZZNFQFNTTNW-VWNXMTODSA-N 2 0 371.484 4.094 20 0 FIADRP C[C@@H]([NH2+]C[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl)C1C[NH2+]C1 ZINC000422765556 1096485662 /nfs/dbraw/zinc/48/56/62/1096485662.db2.gz QKOBTRQJQFELAT-KDOFPFPSSA-N 2 0 353.897 4.151 20 0 FIADRP CC[C@@H]1C[C@@H](C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000503591390 1096487810 /nfs/dbraw/zinc/48/78/10/1096487810.db2.gz HRQVRWZBSCYLIL-GHTZIAJQSA-N 2 0 356.510 4.206 20 0 FIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784640 1096489778 /nfs/dbraw/zinc/48/97/78/1096489778.db2.gz PZPNAWXPFUUQDD-OAOOKAIFSA-N 2 0 366.505 4.034 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784242 1096489803 /nfs/dbraw/zinc/48/98/03/1096489803.db2.gz PKCISXYXRLDGBO-NZQKXSOJSA-N 2 0 350.506 4.330 20 0 FIADRP COc1ccc([C@H](C)CC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784636 1096490214 /nfs/dbraw/zinc/49/02/14/1096490214.db2.gz PZPNAWXPFUUQDD-FHZYATBESA-N 2 0 366.505 4.034 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000422786570 1096491035 /nfs/dbraw/zinc/49/10/35/1096491035.db2.gz SPJYTJWPGSIQOZ-GFCCVEGCSA-N 2 0 368.308 4.275 20 0 FIADRP Brc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)cc1 ZINC000422764390 1096492210 /nfs/dbraw/zinc/49/22/10/1096492210.db2.gz OKSBTYDUOVXTAA-JWTNVVGKSA-N 2 0 363.343 4.134 20 0 FIADRP CSc1cccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000422796280 1096493324 /nfs/dbraw/zinc/49/33/24/1096493324.db2.gz YBGHFIGGZZJXGQ-BFUOFWGJSA-N 2 0 350.478 4.493 20 0 FIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422791245 1096498199 /nfs/dbraw/zinc/49/81/99/1096498199.db2.gz PZAMDDABFCEMGN-QWHCGFSZSA-N 2 0 353.388 4.108 20 0 FIADRP COc1ccc2ccccc2c1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422813546 1096498302 /nfs/dbraw/zinc/49/83/02/1096498302.db2.gz ZNPNXIVIPIJCSO-QPPBQGQZSA-N 2 0 374.484 4.194 20 0 FIADRP COc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)s2)cc1 ZINC000422822648 1096499396 /nfs/dbraw/zinc/49/93/96/1096499396.db2.gz KJXHMQSFJMZFBI-CQSZACIVSA-N 2 0 367.518 4.437 20 0 FIADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422880090 1096511071 /nfs/dbraw/zinc/51/10/71/1096511071.db2.gz NEGURYPXOUQIQW-KSSFIOAISA-N 2 0 371.352 4.019 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422883982 1096511939 /nfs/dbraw/zinc/51/19/39/1096511939.db2.gz WDTYBXVIRFCHSV-MSOLQXFVSA-N 2 0 371.352 4.291 20 0 FIADRP CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422882276 1096511981 /nfs/dbraw/zinc/51/19/81/1096511981.db2.gz ZVJZEAUITYSYGW-WIYYLYMNSA-N 2 0 354.519 4.062 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422892306 1096516363 /nfs/dbraw/zinc/51/63/63/1096516363.db2.gz MPZQDXJVZYRABA-GJZGRUSLSA-N 2 0 357.498 4.058 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(OC(C)C)c1 ZINC000422872334 1096517423 /nfs/dbraw/zinc/51/74/23/1096517423.db2.gz GQYOIQGMPLYMFM-NFBKMPQASA-N 2 0 366.505 4.128 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422897365 1096518197 /nfs/dbraw/zinc/51/81/97/1096518197.db2.gz ZTGMLPXVTALCOD-GGAORHGYSA-N 2 0 366.505 4.211 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cn(-c2ccccc2)nc1C(C)C ZINC000422874633 1096518553 /nfs/dbraw/zinc/51/85/53/1096518553.db2.gz NYKUEWLJTDBSHM-MRXNPFEDSA-N 2 0 363.509 4.009 20 0 FIADRP c1ccc2c(c1)cccc2OCC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422933987 1096529148 /nfs/dbraw/zinc/52/91/48/1096529148.db2.gz BWKKJCWPGBZTIE-URXFXBBRSA-N 2 0 374.484 4.064 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000422965061 1096533290 /nfs/dbraw/zinc/53/32/90/1096533290.db2.gz NLPFZXKTWJLEMI-LJQANCHMSA-N 3 0 351.538 4.166 20 0 FIADRP Clc1cccc(C2([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000422948581 1096537059 /nfs/dbraw/zinc/53/70/59/1096537059.db2.gz SNORQNICOFHRJP-QUCCMNQESA-N 2 0 354.881 4.175 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422976111 1096544121 /nfs/dbraw/zinc/54/41/21/1096544121.db2.gz UQUDTAKQQKOGKP-REWPJTCUSA-N 2 0 360.457 4.292 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000423019424 1096550489 /nfs/dbraw/zinc/55/04/89/1096550489.db2.gz VNOOEKVDOPIYOM-XJKSGUPXSA-N 2 0 364.839 4.153 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423035614 1096556250 /nfs/dbraw/zinc/55/62/50/1096556250.db2.gz SADHWNIFUKZMTA-KXBFYZLASA-N 2 0 370.368 4.065 20 0 FIADRP C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CC[NH2+]C1 ZINC000423060775 1096560507 /nfs/dbraw/zinc/56/05/07/1096560507.db2.gz IWKSTLCEKACMIJ-ZKYQVNSYSA-N 2 0 354.338 4.287 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423058676 1096560597 /nfs/dbraw/zinc/56/05/97/1096560597.db2.gz KCIOTGAQECNSAQ-CHWSQXEVSA-N 2 0 351.416 4.322 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Br)s1 ZINC000423060133 1096561270 /nfs/dbraw/zinc/56/12/70/1096561270.db2.gz NSJNHAGBFXFHPB-MWLCHTKSSA-N 2 0 354.317 4.085 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423099520 1096573919 /nfs/dbraw/zinc/57/39/19/1096573919.db2.gz FIUGPTGSVZWQTG-GFCCVEGCSA-N 2 0 372.925 4.476 20 0 FIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423100686 1096575821 /nfs/dbraw/zinc/57/58/21/1096575821.db2.gz VLVNKWTVBHWDBX-JXYHXMIBSA-N 2 0 368.908 4.432 20 0 FIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)C2)c1 ZINC000423105673 1096583840 /nfs/dbraw/zinc/58/38/40/1096583840.db2.gz ZGGWNSBYTGZQCW-RXABAKJHSA-N 2 0 352.444 4.462 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112048 1096585626 /nfs/dbraw/zinc/58/56/26/1096585626.db2.gz XGZVPQVDHFNTRE-JJXUHFIVSA-N 2 0 354.519 4.315 20 0 FIADRP Fc1ccc(C2CC2)cc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423147289 1096587193 /nfs/dbraw/zinc/58/71/93/1096587193.db2.gz RPYOYVKZHFAVTR-IFMALSPDSA-N 2 0 352.453 4.049 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000423139895 1096595244 /nfs/dbraw/zinc/59/52/44/1096595244.db2.gz WUECVEIMAVVRAA-ACJLOTCBSA-N 2 0 351.416 4.236 20 0 FIADRP COc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1C ZINC000414720329 1096600581 /nfs/dbraw/zinc/60/05/81/1096600581.db2.gz BRZHWOMHINJLFW-HXUWFJFHSA-N 2 0 356.535 4.209 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)NCC2([NH3+])CCCCCC2)cc1 ZINC000423202813 1096615202 /nfs/dbraw/zinc/61/52/02/1096615202.db2.gz RFIKJBPPSDAEGX-NRFANRHFSA-N 2 0 353.510 4.015 20 0 FIADRP CC[C@H](C[N@H+](Cc1nccs1)[C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000414723836 1096615337 /nfs/dbraw/zinc/61/53/37/1096615337.db2.gz QNLWZIAEXPSEMJ-IEBWSBKVSA-N 2 0 355.551 4.281 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423220621 1096620398 /nfs/dbraw/zinc/62/03/98/1096620398.db2.gz YNCPBKVCNXVMTH-GHMZBOCLSA-N 2 0 354.338 4.374 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423228995 1096624567 /nfs/dbraw/zinc/62/45/67/1096624567.db2.gz GGBZQPXLDDFPLY-OIKLOGQESA-N 2 0 365.237 4.388 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)cc1OCC ZINC000414727681 1096628835 /nfs/dbraw/zinc/62/88/35/1096628835.db2.gz AUDRSBRSCWAKBL-INIZCTEOSA-N 2 0 354.922 4.101 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)c(Br)c2)cc1 ZINC000423291524 1096636083 /nfs/dbraw/zinc/63/60/83/1096636083.db2.gz ISGPRSVNYFXKHU-RYUDHWBXSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Br)cc1F ZINC000423293996 1096642998 /nfs/dbraw/zinc/64/29/98/1096642998.db2.gz SUOYGRVBYXUYKC-NWDGAFQWSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(Br)cc2F)cc1 ZINC000423293998 1096643501 /nfs/dbraw/zinc/64/35/01/1096643501.db2.gz SUOYGRVBYXUYKC-VXGBXAGGSA-N 2 0 351.263 4.459 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000423319967 1096643519 /nfs/dbraw/zinc/64/35/19/1096643519.db2.gz FUXILNRVIMJBQT-QGZVFWFLSA-N 2 0 351.263 4.006 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000423294530 1096643693 /nfs/dbraw/zinc/64/36/93/1096643693.db2.gz UQMHCAGTXVKGDF-UONOGXRCSA-N 2 0 352.400 4.498 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296173 1096644483 /nfs/dbraw/zinc/64/44/83/1096644483.db2.gz YNWNWOZDHINKDT-HZPDHXFCSA-N 2 0 354.498 4.087 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423300350 1096645478 /nfs/dbraw/zinc/64/54/78/1096645478.db2.gz RJARRCIXGBXMJK-WDEREUQCSA-N 2 0 368.344 4.126 20 0 FIADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423330427 1096648959 /nfs/dbraw/zinc/64/89/59/1096648959.db2.gz BXFHBOWJYYMFGV-JTQLQIEISA-N 2 0 352.322 4.295 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1ccc(Br)cc1)c1ccccc1F ZINC000423331326 1096648982 /nfs/dbraw/zinc/64/89/82/1096648982.db2.gz PWEMYUHYPBHGMC-KRWDZBQOSA-N 2 0 351.263 4.006 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423333998 1096649798 /nfs/dbraw/zinc/64/97/98/1096649798.db2.gz FLLAHNCPWYWTRM-IBGZPJMESA-N 2 0 357.295 4.048 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)CCC3)cc1 ZINC000423343809 1096651993 /nfs/dbraw/zinc/65/19/93/1096651993.db2.gz XGAUHSQKVMMLOZ-KRWDZBQOSA-N 2 0 371.550 4.175 20 0 FIADRP FC(F)(F)Oc1cccc([C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)c1 ZINC000423384295 1096661899 /nfs/dbraw/zinc/66/18/99/1096661899.db2.gz KSWOAUYLHAUBSE-IBGZPJMESA-N 2 0 362.395 4.429 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccco1)c1ccc(Br)cc1 ZINC000423445568 1096677799 /nfs/dbraw/zinc/67/77/99/1096677799.db2.gz YDJUVNPRWVDOBZ-CXAGYDPISA-N 2 0 351.288 4.239 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccco1)c1ccc(Br)cc1 ZINC000423445575 1096678069 /nfs/dbraw/zinc/67/80/69/1096678069.db2.gz YDJUVNPRWVDOBZ-DYVFJYSZSA-N 2 0 351.288 4.239 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000423429777 1096683258 /nfs/dbraw/zinc/68/32/58/1096683258.db2.gz KOUVXEAOOWBLRV-SJCJKPOMSA-N 2 0 369.278 4.378 20 0 FIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000423458923 1096689438 /nfs/dbraw/zinc/68/94/38/1096689438.db2.gz KTLYQUYYCZYMOK-CBYVUKHWSA-N 2 0 367.356 4.092 20 0 FIADRP Brc1ccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccco2)cc1 ZINC000423470848 1096693184 /nfs/dbraw/zinc/69/31/84/1096693184.db2.gz DMKGCVHBEAZBEA-WMZOPIPTSA-N 2 0 363.299 4.253 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)CCC3)cc1 ZINC000423472144 1096694665 /nfs/dbraw/zinc/69/46/65/1096694665.db2.gz MQNZYRYYOPQCEJ-YXJHDRRASA-N 2 0 371.550 4.303 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c2ccc(OC)cc2)cc1 ZINC000423479175 1096697955 /nfs/dbraw/zinc/69/79/55/1096697955.db2.gz UMMLOAPFFAHKQL-RFWXGWTQSA-N 2 0 368.521 4.095 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423503729 1096701010 /nfs/dbraw/zinc/70/10/10/1096701010.db2.gz FYTKVJDSYJZDKT-MBOZVWFJSA-N 2 0 356.510 4.266 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423483118 1096703165 /nfs/dbraw/zinc/70/31/65/1096703165.db2.gz PYMUUJKFJKSYBC-AZUAARDMSA-N 2 0 360.448 4.499 20 0 FIADRP CCc1ccccc1[C@H]([NH3+])CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423495038 1096707034 /nfs/dbraw/zinc/70/70/34/1096707034.db2.gz BLIWTZSOCJKAGQ-JTOYRKQZSA-N 2 0 363.549 4.034 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423524375 1096713320 /nfs/dbraw/zinc/71/33/20/1096713320.db2.gz WYXILDGHXOHNGY-FSSWDIPSSA-N 2 0 366.505 4.238 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCC3=CC[NH2+]CC3)s2)cc1 ZINC000423535375 1096715852 /nfs/dbraw/zinc/71/58/52/1096715852.db2.gz CVONVCPQEUOTFV-AWEZNQCLSA-N 2 0 357.523 4.088 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423541367 1096716306 /nfs/dbraw/zinc/71/63/06/1096716306.db2.gz KRFHSQUIUBWGHC-QCEMKRCNSA-N 2 0 358.473 4.380 20 0 FIADRP COc1ccccc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1Cl ZINC000423554577 1096721150 /nfs/dbraw/zinc/72/11/50/1096721150.db2.gz WWOAWLSFXQQAEY-PEOGOYOCSA-N 2 0 370.924 4.416 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436301831 1098915863 /nfs/dbraw/zinc/91/58/63/1098915863.db2.gz OTIHAPJGTIOWBH-HRAATJIYSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]1OCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000533362464 1098980899 /nfs/dbraw/zinc/98/08/99/1098980899.db2.gz XDUKHRVGQRRYRX-MBSDFSHPSA-N 2 0 350.506 4.216 20 0 FIADRP CC(C)N(C)c1ccccc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437075836 1099579502 /nfs/dbraw/zinc/57/95/02/1099579502.db2.gz MOIDASDFOGTJKC-LJQANCHMSA-N 2 0 369.553 4.322 20 0 FIADRP Cc1ccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)cn(C)c2c1 ZINC000437107600 1099614156 /nfs/dbraw/zinc/61/41/56/1099614156.db2.gz ZLKFLHILXFPKBE-UHFFFAOYSA-N 2 0 353.554 4.416 20 0 FIADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000162279262 1099673511 /nfs/dbraw/zinc/67/35/11/1099673511.db2.gz AVYZYVGBGHQCQE-LJQANCHMSA-N 2 0 353.510 4.187 20 0 FIADRP CC[N@H+](Cc1ccc(-c2nc(-c3ccc(C[NH3+])cc3)no2)cc1)C(C)C ZINC000262087791 1099692953 /nfs/dbraw/zinc/69/29/53/1099692953.db2.gz UNYQJWRTZZFZMN-UHFFFAOYSA-N 2 0 350.466 4.093 20 0 FIADRP Cc1ccc([C@@H]([NH3+])C(=O)Nc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000262629013 1099725879 /nfs/dbraw/zinc/72/58/79/1099725879.db2.gz GPUSRTCGZZSDQK-DYESRHJHSA-N 2 0 351.494 4.008 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000162500013 1099811101 /nfs/dbraw/zinc/81/11/01/1099811101.db2.gz VPMBJVOFKIEXDM-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccccc1F ZINC000508692884 1099827750 /nfs/dbraw/zinc/82/77/50/1099827750.db2.gz BPZUNCCJIVRRJS-GGPKGHCWSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@H](NCCC[N@H+](C)Cc1ccccc1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508701307 1099842219 /nfs/dbraw/zinc/84/22/19/1099842219.db2.gz WNIYKKAQWZLLAT-XUZZJYLKSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2cccnc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508700779 1099855630 /nfs/dbraw/zinc/85/56/30/1099855630.db2.gz RJNFXKMFCMUMDV-AUSIDOKSSA-N 2 0 359.517 4.278 20 0 FIADRP Cc1ccc([C@H](CN[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000508709538 1099876857 /nfs/dbraw/zinc/87/68/57/1099876857.db2.gz HSMJTJIAJZXKGI-ZTCOLXNVSA-N 2 0 365.565 4.098 20 0 FIADRP C[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508719422 1099909480 /nfs/dbraw/zinc/90/94/80/1099909480.db2.gz PMBGZVHOMMMZBP-MJGOQNOKSA-N 2 0 371.594 4.483 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722916 1099942988 /nfs/dbraw/zinc/94/29/88/1099942988.db2.gz YXOWVJJDWMAJFH-ZJSXRUAMSA-N 3 0 371.613 4.245 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OCc2ccncc2)CC1 ZINC000536652973 1100107314 /nfs/dbraw/zinc/10/73/14/1100107314.db2.gz FREYRGRITZOEOA-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP CC(C)Oc1ccc(C[NH2+]C2CCN(C3CC3)CC2)c(C(F)(F)F)c1 ZINC000459406318 1100115156 /nfs/dbraw/zinc/11/51/56/1100115156.db2.gz JQAHPVQKKQGIMO-UHFFFAOYSA-N 2 0 356.432 4.209 20 0 FIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1c(F)cccc1Cl ZINC000459422779 1100153351 /nfs/dbraw/zinc/15/33/51/1100153351.db2.gz JCLQHUTUXQJHOU-UHFFFAOYSA-N 2 0 361.892 4.410 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2cn(C3CCCC3)nc2-c2ccccn2)C1 ZINC000459427032 1100164718 /nfs/dbraw/zinc/16/47/18/1100164718.db2.gz OBLHRMUEBMNHRW-AZUAARDMSA-N 2 0 367.541 4.023 20 0 FIADRP Brc1cccc2c1CC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434803 1100172915 /nfs/dbraw/zinc/17/29/15/1100172915.db2.gz UXSNLKANYYPAPM-IBGZPJMESA-N 2 0 372.310 4.090 20 0 FIADRP COc1ccccc1[C@@H](CC(C)C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434320 1100173453 /nfs/dbraw/zinc/17/34/53/1100173453.db2.gz UJEBLKRZVJOOBD-OAQYLSRUSA-N 2 0 353.510 4.436 20 0 FIADRP CCn1c2ccccc2nc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000536697207 1100201907 /nfs/dbraw/zinc/20/19/07/1100201907.db2.gz MOPRNNUSNNZYRA-UHFFFAOYSA-N 2 0 354.542 4.144 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)ccc1O ZINC000459462971 1100209096 /nfs/dbraw/zinc/20/90/96/1100209096.db2.gz KPNZABBCPZPOHE-UHFFFAOYSA-N 2 0 368.521 4.313 20 0 FIADRP Cc1ccc2ncc(C[NH+]3CCC(CC[N@H+]4CCCC[C@H]4C)CC3)n2c1 ZINC000536711574 1100229412 /nfs/dbraw/zinc/22/94/12/1100229412.db2.gz ZBGDIXHTWJHNNY-LJQANCHMSA-N 2 0 354.542 4.119 20 0 FIADRP CCOc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc(Cl)c1O ZINC000459509927 1100263613 /nfs/dbraw/zinc/26/36/13/1100263613.db2.gz WKJVILMRYDCJLS-QGZVFWFLSA-N 2 0 374.912 4.056 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(OC)c1 ZINC000536828181 1100326962 /nfs/dbraw/zinc/32/69/62/1100326962.db2.gz RDVJRZSITUROTI-LMDPOFIKSA-N 2 0 360.542 4.398 20 0 FIADRP C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000536853078 1100367193 /nfs/dbraw/zinc/36/71/93/1100367193.db2.gz PTQGAGZMGXCRAE-KUHUBIRLSA-N 2 0 360.885 4.065 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000459663752 1100411402 /nfs/dbraw/zinc/41/14/02/1100411402.db2.gz GAXMVEQEADDTQO-CRAIPNDOSA-N 2 0 356.832 4.014 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OCC ZINC000459663360 1100412034 /nfs/dbraw/zinc/41/20/34/1100412034.db2.gz XBWKBYQUFIYYPT-UHFFFAOYSA-N 2 0 373.884 4.465 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2-c2ccsc2)CC1)CC1CC1 ZINC000438084786 1100412315 /nfs/dbraw/zinc/41/23/15/1100412315.db2.gz KAKVALWTEUTEAQ-UHFFFAOYSA-N 2 0 372.582 4.472 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc3nc(C)ccc3c2)CC1 ZINC000438107164 1100433352 /nfs/dbraw/zinc/43/33/52/1100433352.db2.gz VTFGSCDCJMKZPK-UHFFFAOYSA-N 2 0 369.553 4.114 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)[C@@H](C)C1 ZINC000438189450 1100501443 /nfs/dbraw/zinc/50/14/43/1100501443.db2.gz KPGMLAPJYHKYJU-MALNDZBISA-N 2 0 358.570 4.223 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@H]1CCCC[C@H]1[NH3+])C1CCCCC1 ZINC000517571617 1100506422 /nfs/dbraw/zinc/50/64/22/1100506422.db2.gz ZDMOUPQDAGUYSO-YLJYHZDGSA-N 2 0 357.542 4.297 20 0 FIADRP COc1cccc(C2(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CC2)c1 ZINC000517629923 1100572046 /nfs/dbraw/zinc/57/20/46/1100572046.db2.gz BLGIRFPIEPKVSA-AUSIDOKSSA-N 2 0 364.533 4.227 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426031407 1100682984 /nfs/dbraw/zinc/68/29/84/1100682984.db2.gz RSTBAUQQBMLUJQ-PWRODBHTSA-N 2 0 357.929 4.481 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000438771452 1100907465 /nfs/dbraw/zinc/90/74/65/1100907465.db2.gz KYCRZRMWJQZRFS-OAQYLSRUSA-N 2 0 355.526 4.018 20 0 FIADRP CC[N@H+](Cc1ccccc1N1CC[NH+](CC)CC1)[C@@H](C)c1cccc(O)c1 ZINC000509546883 1100934241 /nfs/dbraw/zinc/93/42/41/1100934241.db2.gz WVWGGDBOIKOAPL-IBGZPJMESA-N 2 0 367.537 4.117 20 0 FIADRP C[C@@H](CCCO)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000438836868 1100955399 /nfs/dbraw/zinc/95/53/99/1100955399.db2.gz ORXWCCUVLFKORH-GHTZIAJQSA-N 2 0 350.522 4.130 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000518267970 1101051614 /nfs/dbraw/zinc/05/16/14/1101051614.db2.gz YWCNUUXMEPKTRK-INIZCTEOSA-N 2 0 368.949 4.349 20 0 FIADRP CC1(C)Cc2c(cccc2Br)[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000426331141 1101292173 /nfs/dbraw/zinc/29/21/73/1101292173.db2.gz NHACVWOOGJIICH-IYOUNJFTSA-N 2 0 363.343 4.289 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)[C@@H]1OCCc2sccc21 ZINC000426342646 1101315307 /nfs/dbraw/zinc/31/53/07/1101315307.db2.gz MUULIVRPXLEGQR-MRUHUIDDSA-N 2 0 374.550 4.042 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000459740220 1101367386 /nfs/dbraw/zinc/36/73/86/1101367386.db2.gz TYYKXSIIQIDOCL-LJQANCHMSA-N 2 0 366.553 4.047 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000537013862 1101392994 /nfs/dbraw/zinc/39/29/94/1101392994.db2.gz UHWQVYQOXMNDCI-GOSISDBHSA-N 2 0 351.332 4.363 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Br)s2)C1 ZINC000518763543 1101518570 /nfs/dbraw/zinc/51/85/70/1101518570.db2.gz UZPMMSNDPXTWSO-KBPBESRZSA-N 2 0 359.377 4.358 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(Br)ccc1F ZINC000518765570 1101523118 /nfs/dbraw/zinc/52/31/18/1101523118.db2.gz NCSOIKXJYZAILS-AWEZNQCLSA-N 2 0 357.311 4.332 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190270 1101524261 /nfs/dbraw/zinc/52/42/61/1101524261.db2.gz YVYNWLTWZUIEAF-FHZYATBESA-N 2 0 362.517 4.498 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000518778195 1101543205 /nfs/dbraw/zinc/54/32/05/1101543205.db2.gz FDONLIIXCFJADW-UHFFFAOYSA-N 2 0 374.960 4.354 20 0 FIADRP C[NH+]1CCC(N2CC[C@H]([NH2+][C@H]3CC=C(c4ccc(Cl)cc4)CC3)C2)CC1 ZINC000648450469 1101718681 /nfs/dbraw/zinc/71/86/81/1101718681.db2.gz NJXYQCCGHPEASS-SFTDATJTSA-N 2 0 373.972 4.034 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168165528 1101759562 /nfs/dbraw/zinc/75/95/62/1101759562.db2.gz DOYGEXFXNBRVOH-LRQRDZAKSA-N 2 0 357.929 4.438 20 0 FIADRP C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506736287 1101965333 /nfs/dbraw/zinc/96/53/33/1101965333.db2.gz PJPHSFQLPRHNHB-QGZVFWFLSA-N 2 0 369.578 4.398 20 0 FIADRP C[NH+](C)CCC1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)CC1 ZINC000519223077 1102019968 /nfs/dbraw/zinc/01/99/68/1102019968.db2.gz PYZMOIMOGOBGSP-UHFFFAOYSA-N 2 0 358.448 4.138 20 0 FIADRP COc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2Cl)cc1OC ZINC000643465565 1102131950 /nfs/dbraw/zinc/13/19/50/1102131950.db2.gz WFBPJWJPWJELIK-IIBYNOLFSA-N 2 0 374.912 4.178 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2OC)cc1 ZINC000120580930 1102235662 /nfs/dbraw/zinc/23/56/62/1102235662.db2.gz QJPJHXGBSRZZSL-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP c1ccc2c(c1)cccc2OCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167967558 1102281278 /nfs/dbraw/zinc/28/12/78/1102281278.db2.gz HBTFVVBVBCBJED-SEJPIABJSA-N 2 0 350.506 4.214 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(=O)OC)cc1 ZINC000550782928 1102282342 /nfs/dbraw/zinc/28/23/42/1102282342.db2.gz BSDWOKIBEAJXAY-PBEJRMEISA-N 2 0 358.526 4.167 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCS2 ZINC000187729000 1102304772 /nfs/dbraw/zinc/30/47/72/1102304772.db2.gz HXNPBQWMAWJYMB-HXUWFJFHSA-N 2 0 356.535 4.474 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(CO)c1 ZINC000121085568 1102324145 /nfs/dbraw/zinc/32/41/45/1102324145.db2.gz YGELMPGCHQYDMH-LJQANCHMSA-N 2 0 352.522 4.262 20 0 FIADRP c1csc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)n1 ZINC001167969082 1102349181 /nfs/dbraw/zinc/34/91/81/1102349181.db2.gz ZRQRPPNPFRWDKG-IHWFROFDSA-N 2 0 353.535 4.305 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cccc(CO)c1 ZINC000121239039 1102354548 /nfs/dbraw/zinc/35/45/48/1102354548.db2.gz HQXBFIHIFAUJTK-OALUTQOASA-N 2 0 352.522 4.404 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC)c(Cl)c2)[C@@H](C)C1 ZINC000532500926 1102432214 /nfs/dbraw/zinc/43/22/14/1102432214.db2.gz RMOATJYQPLOLOK-BXWFABGCSA-N 2 0 368.949 4.136 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cccc(CO)c1 ZINC000121739720 1102448306 /nfs/dbraw/zinc/44/83/06/1102448306.db2.gz GJVXVYIXQRGIGV-QGZVFWFLSA-N 2 0 372.940 4.395 20 0 FIADRP CC1CCC([NH+]2CCC3(C[C@H]([N@H+](C)Cc4ccccc4)CO3)CC2)CC1 ZINC001168214780 1102495566 /nfs/dbraw/zinc/49/55/66/1102495566.db2.gz FRUFUDOBKJLZKX-VTLFHKLASA-N 2 0 356.554 4.321 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([NH2+]CCC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168228880 1102549455 /nfs/dbraw/zinc/54/94/55/1102549455.db2.gz LRGFHHPDVKHKOL-QHCPKHFHSA-N 2 0 364.533 4.054 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2ccc(Cl)cc2)CC1 ZINC001168251918 1102649416 /nfs/dbraw/zinc/64/94/16/1102649416.db2.gz FDUBFEMHMGMYDO-QGZVFWFLSA-N 2 0 352.950 4.471 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Br)cc3Cl)CC2)CC[N@@H+]1C ZINC000550882925 1102653174 /nfs/dbraw/zinc/65/31/74/1102653174.db2.gz RTCGIYPVRHRIOI-JSGCOSHPSA-N 2 0 371.750 4.206 20 0 FIADRP CC1CC[NH+](CCC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000550885063 1102656621 /nfs/dbraw/zinc/65/66/21/1102656621.db2.gz DCNNOZVVPCIILO-UHFFFAOYSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885786 1102656660 /nfs/dbraw/zinc/65/66/60/1102656660.db2.gz JIWFAVASLGRRDV-SJBKTWHCSA-N 2 0 370.581 4.330 20 0 FIADRP COc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167975722 1102669294 /nfs/dbraw/zinc/66/92/94/1102669294.db2.gz VAKSKRIYIZEMAP-SEJPIABJSA-N 2 0 354.538 4.013 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)OCCO2 ZINC000123019543 1102746612 /nfs/dbraw/zinc/74/66/12/1102746612.db2.gz QMFCZBPSYBZIDI-OAQYLSRUSA-N 2 0 366.505 4.295 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@]1(C)CCCO1 ZINC000550999415 1102758916 /nfs/dbraw/zinc/75/89/16/1102758916.db2.gz QKGFAPCJOWRYRY-MBSDFSHPSA-N 2 0 352.522 4.462 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000551004571 1102772224 /nfs/dbraw/zinc/77/22/24/1102772224.db2.gz BZGGFRQNIAGNPE-ZEQRLZLVSA-N 2 0 365.565 4.454 20 0 FIADRP C[C@@H]1CN(C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C[C@H](C)[N@H+]1C ZINC000454233775 1102806420 /nfs/dbraw/zinc/80/64/20/1102806420.db2.gz XQWKMYLNPGXMSA-HDICACEKSA-N 2 0 372.557 4.007 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000506867852 1102917898 /nfs/dbraw/zinc/91/78/98/1102917898.db2.gz OTLPLRTVWDKKQZ-UHFFFAOYSA-N 2 0 373.928 4.088 20 0 FIADRP Clc1ccccc1-c1ccc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)o1 ZINC000506880243 1102928264 /nfs/dbraw/zinc/92/82/64/1102928264.db2.gz GUEUZQLNZAXGGT-UHFFFAOYSA-N 2 0 374.912 4.144 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000506931225 1102968538 /nfs/dbraw/zinc/96/85/38/1102968538.db2.gz XPVQMGGQTGYOMK-UHFFFAOYSA-N 2 0 368.569 4.003 20 0 FIADRP C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)o1 ZINC000551221252 1102990341 /nfs/dbraw/zinc/99/03/41/1102990341.db2.gz MGVDBCXKGFWDEU-HRAATJIYSA-N 2 0 354.494 4.166 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(Sc3ccccn3)o2)cc1 ZINC000509671973 1103128304 /nfs/dbraw/zinc/12/83/04/1103128304.db2.gz SCYJIBABHRFUCN-UHFFFAOYSA-N 2 0 353.491 4.177 20 0 FIADRP C[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551374692 1103158740 /nfs/dbraw/zinc/15/87/40/1103158740.db2.gz NSNIJUGCLJLRPY-IBGZPJMESA-N 2 0 352.522 4.271 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1OCc1ccccc1 ZINC000666996880 1103355048 /nfs/dbraw/zinc/35/50/48/1103355048.db2.gz JZPSCISUHPAUSR-HXUWFJFHSA-N 2 0 366.505 4.039 20 0 FIADRP c1c(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000666997087 1103363557 /nfs/dbraw/zinc/36/35/57/1103363557.db2.gz WJTAIEWDPZPSAR-OAQYLSRUSA-N 2 0 372.516 4.304 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CC(c4ccccc4)C3)cc2)CC1 ZINC000551563545 1103365068 /nfs/dbraw/zinc/36/50/68/1103365068.db2.gz HZLDVAIPTKVBPM-UHFFFAOYSA-N 2 0 350.506 4.195 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000551573297 1103379703 /nfs/dbraw/zinc/37/97/03/1103379703.db2.gz ZKMPKIIVWIHOMV-XMMPIXPASA-N 2 0 364.533 4.271 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000551779174 1103626171 /nfs/dbraw/zinc/62/61/71/1103626171.db2.gz RJQALZFIFKYGJI-BHLLPTRUSA-N 2 0 364.533 4.299 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000551798474 1103674949 /nfs/dbraw/zinc/67/49/49/1103674949.db2.gz YQSKJDGGFQLJPH-JVPBZIDWSA-N 2 0 352.444 4.415 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)CC2 ZINC000551812449 1103692953 /nfs/dbraw/zinc/69/29/53/1103692953.db2.gz DPVCGKCRFVFIND-HSZRJFAPSA-N 2 0 350.506 4.245 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000461085679 1104068579 /nfs/dbraw/zinc/06/85/79/1104068579.db2.gz GEBOKSOQUFIWTK-JENIJYKNSA-N 2 0 362.558 4.080 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@H]2CCCN(C)[C@@H]2c2cccs2)c1 ZINC000164939399 1104224851 /nfs/dbraw/zinc/22/48/51/1104224851.db2.gz ASWNEWYGHYDTCT-KLHJMIIUSA-N 2 0 371.550 4.440 20 0 FIADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000520343990 1104284937 /nfs/dbraw/zinc/28/49/37/1104284937.db2.gz SRLYFAANSNFWQJ-CTNGQTDRSA-N 2 0 358.570 4.330 20 0 FIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441419126 1104399483 /nfs/dbraw/zinc/39/94/83/1104399483.db2.gz JJURSYUUAFFQPX-DENIHFKCSA-N 2 0 350.506 4.167 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCOC4(CCSCC4)C3)CC2)C1 ZINC000537963318 1104448454 /nfs/dbraw/zinc/44/84/54/1104448454.db2.gz HTBSKINLGKUBDO-RLLQIKCJSA-N 2 0 366.615 4.064 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000152296277 1104509953 /nfs/dbraw/zinc/50/99/53/1104509953.db2.gz CIUJAMKDMXNHML-GIVPXCGWSA-N 2 0 359.558 4.049 20 0 FIADRP c1ccc2c(c1)cccc2OCCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441451904 1104741138 /nfs/dbraw/zinc/74/11/38/1104741138.db2.gz OIZOFPFOJJSSDR-HXUWFJFHSA-N 2 0 352.522 4.417 20 0 FIADRP CSCc1cccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000188717480 1104751201 /nfs/dbraw/zinc/75/12/01/1104751201.db2.gz VHBLJQGOXSFDKY-KRWDZBQOSA-N 2 0 358.551 4.341 20 0 FIADRP COCCC1(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)CCCCC1 ZINC000189135463 1104781995 /nfs/dbraw/zinc/78/19/95/1104781995.db2.gz DQLCYKSKFVFBMY-JOCHJYFZSA-N 2 0 358.570 4.128 20 0 FIADRP c1ccc2cc(OCCC[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441466342 1104801189 /nfs/dbraw/zinc/80/11/89/1104801189.db2.gz NFDJJLQMAFVJJN-FQEVSTJZSA-N 2 0 352.522 4.417 20 0 FIADRP COc1cccc([C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001168002131 1104969773 /nfs/dbraw/zinc/96/97/73/1104969773.db2.gz NARYMBSKLRNZMT-CCDCCJRHSA-N 2 0 354.538 4.280 20 0 FIADRP CC[C@@H]1C[C@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCO1 ZINC000507792728 1105081008 /nfs/dbraw/zinc/08/10/08/1105081008.db2.gz GAXXTPCLVXJCIS-FGZHOGPDSA-N 2 0 356.554 4.180 20 0 FIADRP COc1cccc(OCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168007393 1105132472 /nfs/dbraw/zinc/13/24/72/1105132472.db2.gz AMEKNBQKESNUFG-CEQLMSFQSA-N 2 0 368.521 4.105 20 0 FIADRP CCc1cc(C[NH+]2CCC3(CC2)CC[NH+](Cc2cccs2)CC3)on1 ZINC001203218000 1105165308 /nfs/dbraw/zinc/16/53/08/1105165308.db2.gz OBPJPLHDCZGZRM-UHFFFAOYSA-N 2 0 359.539 4.177 20 0 FIADRP Cn1nccc1-c1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000508189227 1105347194 /nfs/dbraw/zinc/34/71/94/1105347194.db2.gz COJNAEFJFSOEGX-FQEVSTJZSA-N 2 0 366.553 4.175 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(O)c2Cl)CC1 ZINC000508181691 1105350451 /nfs/dbraw/zinc/35/04/51/1105350451.db2.gz QIJRYKLRFOCNDG-UHFFFAOYSA-N 2 0 358.913 4.390 20 0 FIADRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)c(OC(F)(F)F)c3)C[C@H]2CC1 ZINC001279145918 1106947171 /nfs/dbraw/zinc/94/71/71/1106947171.db2.gz LNBIXMHRDBUKEJ-OKILXGFUSA-N 2 0 362.823 4.012 20 0 FIADRP CN(CC1CCN(c2cc[nH+]cc2)CC1)c1cc[nH+]c2cc(F)ccc21 ZINC000301861053 1107186518 /nfs/dbraw/zinc/18/65/18/1107186518.db2.gz ABBYJFACNOCFHA-UHFFFAOYSA-N 2 0 350.441 4.122 20 0 FIADRP COc1ccc([C@H](CNc2cc[nH+]c3cc(F)ccc23)[NH+](C)C)cc1OC ZINC000302570338 1107390811 /nfs/dbraw/zinc/39/08/11/1107390811.db2.gz QHMBUNMEBGNWQD-IBGZPJMESA-N 2 0 369.440 4.106 20 0 FIADRP CCCCOC(=O)[C@@H]1CC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168067980 1107522170 /nfs/dbraw/zinc/52/21/70/1107522170.db2.gz VZBLKZLPMWBVPP-IRFCIJBXSA-N 2 0 372.553 4.093 20 0 FIADRP C[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453065184 1108143126 /nfs/dbraw/zinc/14/31/26/1108143126.db2.gz SSZYWPDHFTUTAN-KRWDZBQOSA-N 2 0 351.494 4.399 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc(C[NH+](C)C)cc3)cc2)C1 ZINC000523381360 1108162876 /nfs/dbraw/zinc/16/28/76/1108162876.db2.gz JWJOQRPUWVSHPA-GOSISDBHSA-N 2 0 365.521 4.232 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccsc1 ZINC000453102388 1108170710 /nfs/dbraw/zinc/17/07/10/1108170710.db2.gz PLDHVGYOULKSPE-HNAYVOBHSA-N 2 0 361.530 4.441 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(-c3ccccc3)nn2C)c1 ZINC000453112014 1108179454 /nfs/dbraw/zinc/17/94/54/1108179454.db2.gz SJNBCNKBWMXDFE-GOSISDBHSA-N 2 0 362.521 4.390 20 0 FIADRP CC[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccncc1 ZINC000453122017 1108190158 /nfs/dbraw/zinc/19/01/58/1108190158.db2.gz DWWVKFZDUXNPTM-HSZRJFAPSA-N 2 0 367.537 4.194 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453235431 1108309803 /nfs/dbraw/zinc/30/98/03/1108309803.db2.gz ZTCVVJMWVICFGY-KRWDZBQOSA-N 2 0 351.494 4.399 20 0 FIADRP CCC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000531965239 1108460475 /nfs/dbraw/zinc/46/04/75/1108460475.db2.gz DKSJZAXDHVRPAC-XZOQPEGZSA-N 2 0 351.538 4.106 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)ccc1OC ZINC000453388512 1108474577 /nfs/dbraw/zinc/47/45/77/1108474577.db2.gz WOFFGNZOKRUJKD-GCJKJVERSA-N 2 0 360.542 4.101 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000531969860 1108477088 /nfs/dbraw/zinc/47/70/88/1108477088.db2.gz LUVOPMMAOJRKDJ-PQNGQFLHSA-N 3 0 371.613 4.040 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453369538 1108487281 /nfs/dbraw/zinc/48/72/81/1108487281.db2.gz VAYDRHBHHXPDCE-ZYJGPIPZSA-N 2 0 368.496 4.333 20 0 FIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000453375624 1108494028 /nfs/dbraw/zinc/49/40/28/1108494028.db2.gz XYUFOVXBZZLOOD-VISVQNLJSA-N 2 0 357.325 4.364 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000453438284 1108531364 /nfs/dbraw/zinc/53/13/64/1108531364.db2.gz VUHUKLPXYXDPIV-YVWKXTFCSA-N 2 0 374.550 4.259 20 0 FIADRP C[N@H+](CCCCOc1ccccc1C(F)(F)F)C[C@H]1CCC[NH+](C)C1 ZINC000524991505 1109230596 /nfs/dbraw/zinc/23/05/96/1109230596.db2.gz ZTPOTNYOBHDISW-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP C[NH+](C)CC1CC[NH+](CCOc2ccc(Oc3ccccc3)cc2)CC1 ZINC000525120398 1109269950 /nfs/dbraw/zinc/26/99/50/1109269950.db2.gz TUXMSWDKCJUITK-UHFFFAOYSA-N 2 0 354.494 4.131 20 0 FIADRP Cc1cn2c(n1)[C@H](C[NH2+]Cc1cc(Cl)ccc1Br)CCC2 ZINC000525207565 1109301369 /nfs/dbraw/zinc/30/13/69/1109301369.db2.gz HDYHYXKBKYUIEC-LBPRGKRZSA-N 2 0 368.706 4.275 20 0 FIADRP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](CC2CCC(C(C)(C)C)CC2)CC1 ZINC000525633044 1109462412 /nfs/dbraw/zinc/46/24/12/1109462412.db2.gz DSCFXDDDCDAJBJ-PHZLKFDYSA-N 2 0 363.634 4.329 20 0 FIADRP Clc1cc(Cl)cc(CC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000447315073 1109504642 /nfs/dbraw/zinc/50/46/42/1109504642.db2.gz OSXXIXNVPQOZMK-UHFFFAOYSA-N 2 0 371.352 4.113 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)o1 ZINC000447536047 1109571512 /nfs/dbraw/zinc/57/15/12/1109571512.db2.gz KQPDIQDGYPKPNS-KURKYZTESA-N 2 0 356.510 4.356 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cnn1-c1cc(C)ccc1C ZINC000447568541 1109576435 /nfs/dbraw/zinc/57/64/35/1109576435.db2.gz KHYPTGFKKJEFJX-SFHVURJKSA-N 2 0 366.553 4.323 20 0 FIADRP Brc1cccc2c1CCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447571381 1109578125 /nfs/dbraw/zinc/57/81/25/1109578125.db2.gz XXTWHLWPMPGRGV-IBGZPJMESA-N 2 0 363.343 4.291 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000447555759 1109579281 /nfs/dbraw/zinc/57/92/81/1109579281.db2.gz CYRPVAKMIAUBFW-CQSZACIVSA-N 2 0 356.432 4.153 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000447557602 1109580435 /nfs/dbraw/zinc/58/04/35/1109580435.db2.gz MLWPNXUADHIQNQ-GOSISDBHSA-N 2 0 354.416 4.037 20 0 FIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1F ZINC000447565605 1109584255 /nfs/dbraw/zinc/58/42/55/1109584255.db2.gz MIIWESJVOBWSBE-CTNGQTDRSA-N 2 0 360.517 4.325 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1Br ZINC000447582249 1109585438 /nfs/dbraw/zinc/58/54/38/1109585438.db2.gz VYIGWKCRXDGBAF-LBPRGKRZSA-N 2 0 355.295 4.113 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2c2ccccc2)CCO1 ZINC001168092322 1109642525 /nfs/dbraw/zinc/64/25/25/1109642525.db2.gz GZGKFFZYAZKXGG-JFTIXFDTSA-N 2 0 364.533 4.202 20 0 FIADRP C[C@H](N[C@H]1CCOc2c(F)cccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527197743 1109717804 /nfs/dbraw/zinc/71/78/04/1109717804.db2.gz ZSDIKLDKLJXOMM-CDXJDZJCSA-N 2 0 354.469 4.150 20 0 FIADRP c1ccc(COc2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)cc1 ZINC000448549839 1109826743 /nfs/dbraw/zinc/82/67/43/1109826743.db2.gz JEOVLBMSUXEMNH-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP Cc1cc(N2CCC([NH2+][C@@H]3CCc4cc(F)c(Cl)cc43)CC2)nc(C)n1 ZINC000527870838 1109845008 /nfs/dbraw/zinc/84/50/08/1109845008.db2.gz OQYDTOKZCCYAKI-LJQANCHMSA-N 2 0 374.891 4.132 20 0 FIADRP CC(C)C[NH+]1CCC(NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000449070921 1109972427 /nfs/dbraw/zinc/97/24/27/1109972427.db2.gz FXUMZWIORMOWHH-UHFFFAOYSA-N 2 0 351.623 4.376 20 0 FIADRP Fc1cc2c(c(F)c1F)[C@H]([NH2+]Cc1ccc(Cn3ccnc3)cc1)CC2 ZINC000449078413 1109973701 /nfs/dbraw/zinc/97/37/01/1109973701.db2.gz UZILXCRLTWBRPV-QGZVFWFLSA-N 2 0 357.379 4.126 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000449081241 1109974900 /nfs/dbraw/zinc/97/49/00/1109974900.db2.gz DAQHGRLKLLLLDK-FCHUYYIVSA-N 3 0 371.613 4.326 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[NH+]2CCC(C)CC2)CC1 ZINC000449083408 1109975401 /nfs/dbraw/zinc/97/54/01/1109975401.db2.gz UALXJZWLCPYCFU-QFIPXVFZSA-N 3 0 371.613 4.184 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2-n2ccnc2)CC1 ZINC000449099770 1109975937 /nfs/dbraw/zinc/97/59/37/1109975937.db2.gz UUWMZLDSAWMOLM-FQEVSTJZSA-N 2 0 374.532 4.058 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(CCO)CCCCC2)CC1 ZINC000449175822 1109989015 /nfs/dbraw/zinc/98/90/15/1109989015.db2.gz RTFOMXXWSUWWRR-HXUWFJFHSA-N 2 0 358.570 4.005 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCO[C@@]3(CCSC3)C2)CC1 ZINC000449188020 1109990735 /nfs/dbraw/zinc/99/07/35/1109990735.db2.gz FNRPMCNEUAZUKA-RXVVDRJESA-N 2 0 368.631 4.310 20 0 FIADRP CO[C@H](C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000449168431 1109990785 /nfs/dbraw/zinc/99/07/85/1109990785.db2.gz ARGDFKAZQUPJSQ-WZONZLPQSA-N 2 0 370.512 4.198 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000449188273 1109991044 /nfs/dbraw/zinc/99/10/44/1109991044.db2.gz KAWBGHNNMACIHR-SIKLNZKXSA-N 2 0 356.554 4.163 20 0 FIADRP Cc1noc(C)c1[C@@H](C)C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449186248 1109994548 /nfs/dbraw/zinc/99/45/48/1109994548.db2.gz JCUWQISXVOUBRM-DLBZAZTESA-N 2 0 355.526 4.080 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H]2n2cccn2)CC1 ZINC000449188603 1109994971 /nfs/dbraw/zinc/99/49/71/1109994971.db2.gz SMYCPGZMJPIHBH-PTUXOGIPSA-N 2 0 366.553 4.052 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)CC1 ZINC000449216080 1109999231 /nfs/dbraw/zinc/99/92/31/1109999231.db2.gz ZZGSZAHLQKZQFQ-YJSIEXFISA-N 2 0 368.565 4.019 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC(NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000449219039 1109999727 /nfs/dbraw/zinc/99/97/27/1109999727.db2.gz MCTFMFSQFBUYTE-NQIIRXRSSA-N 2 0 371.594 4.036 20 0 FIADRP Fc1ccc2c(c1Br)CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000449284985 1110016286 /nfs/dbraw/zinc/01/62/86/1110016286.db2.gz CPJMLPFKMFSJAW-KRWDZBQOSA-N 2 0 367.306 4.040 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+]C3CCC(OC4CCCC4)CC3)C2)cc1 ZINC000449295751 1110019894 /nfs/dbraw/zinc/01/98/94/1110019894.db2.gz VBAVDKNWZDGRMG-HVIUMASTSA-N 2 0 356.554 4.369 20 0 FIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CC1 ZINC000449294031 1110025676 /nfs/dbraw/zinc/02/56/76/1110025676.db2.gz JVFCFQAAZLLAIJ-YUVSOPLDSA-N 2 0 358.570 4.267 20 0 FIADRP CC1(C)C[N@H+](CC[C@@H]2CCOC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449414240 1110055815 /nfs/dbraw/zinc/05/58/15/1110055815.db2.gz LRRNHBRZZNUNIZ-IFMALSPDSA-N 2 0 356.554 4.036 20 0 FIADRP CC(C)c1nnc(CN2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)s1 ZINC000450494000 1110306269 /nfs/dbraw/zinc/30/62/69/1110306269.db2.gz IBGKSBKASOYFKN-INIZCTEOSA-N 2 0 350.576 4.138 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H](Nc2cccc(C[NH+]3CCCCC3)c2)[C@@H](C)C1 ZINC000538498324 1111160273 /nfs/dbraw/zinc/16/02/73/1111160273.db2.gz WKUNCNNHBHQQJH-NZQKXSOJSA-N 2 0 373.585 4.221 20 0 FIADRP Cc1cccc2ncc(C[NH+]3CCC(CC[N@H+]4CCCC[C@@H]4C)CC3)n21 ZINC000538724279 1111263524 /nfs/dbraw/zinc/26/35/24/1111263524.db2.gz AWWDYJNQBPXPOE-SFHVURJKSA-N 2 0 354.542 4.119 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1sc(CCOC)nc1C ZINC000538869208 1111328134 /nfs/dbraw/zinc/32/81/34/1111328134.db2.gz IMVOTAZWICYZTF-RYQLBKOJSA-N 2 0 367.603 4.192 20 0 FIADRP COCCOc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000539039410 1111394317 /nfs/dbraw/zinc/39/43/17/1111394317.db2.gz AKJUZZLPEQKFDP-JSRJAPPDSA-N 2 0 374.569 4.406 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1cccc(-c2ccccc2)c1 ZINC000539062263 1111408058 /nfs/dbraw/zinc/40/80/58/1111408058.db2.gz VQBMQUPHQBNXLY-GLYQVZKVSA-N 2 0 364.533 4.382 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1O2 ZINC000539370364 1111533219 /nfs/dbraw/zinc/53/32/19/1111533219.db2.gz SSGUCMZYODDNIZ-HXUWFJFHSA-N 2 0 370.924 4.460 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC000552062043 1111563015 /nfs/dbraw/zinc/56/30/15/1111563015.db2.gz JGCRZYSWOQBXFY-BBHUYCHWSA-N 2 0 352.522 4.441 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CCO[C@@H]3c3ccccc3)CC2)C1 ZINC000477927759 1111604486 /nfs/dbraw/zinc/60/44/86/1111604486.db2.gz BIMMNVMREMGHJA-VOFXCDAESA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477935226 1111606264 /nfs/dbraw/zinc/60/62/64/1111606264.db2.gz WJDXRPJSEZTMPV-JMUQELJHSA-N 2 0 368.521 4.055 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1 ZINC000552224172 1111624098 /nfs/dbraw/zinc/62/40/98/1111624098.db2.gz LVYRVQNTIGRCPE-WMZHIEFXSA-N 2 0 367.537 4.086 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000552224315 1111624123 /nfs/dbraw/zinc/62/41/23/1111624123.db2.gz SPQWFENRFPKGPB-FZKQIMNGSA-N 2 0 354.416 4.110 20 0 FIADRP CSC1(C[NH2+]CC(c2ccccc2)c2ccccc2)CC[NH+](C)CC1 ZINC000552257722 1111638324 /nfs/dbraw/zinc/63/83/24/1111638324.db2.gz TUCWRATWVLQBIF-UHFFFAOYSA-N 2 0 354.563 4.236 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H]2CCC[C@H]21 ZINC000552259549 1111639051 /nfs/dbraw/zinc/63/90/51/1111639051.db2.gz KSQCGVLKMKLHLB-OKZBNKHCSA-N 2 0 361.942 4.426 20 0 FIADRP COCc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000552273934 1111654207 /nfs/dbraw/zinc/65/42/07/1111654207.db2.gz XBQZPGQAFRHPRT-UHFFFAOYSA-N 2 0 364.533 4.321 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000552281686 1111658714 /nfs/dbraw/zinc/65/87/14/1111658714.db2.gz GLMOTNNRPVZVEJ-XGXHKWSGSA-N 2 0 354.460 4.465 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)C1 ZINC000479358113 1111998024 /nfs/dbraw/zinc/99/80/24/1111998024.db2.gz ITJOBOOUQXSMCA-CXAGYDPISA-N 2 0 351.332 4.103 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479392544 1112011126 /nfs/dbraw/zinc/01/11/26/1112011126.db2.gz OVNONGHGCDPHGR-SFHVURJKSA-N 2 0 351.332 4.289 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCCc3nn(C)cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000479394575 1112011678 /nfs/dbraw/zinc/01/16/78/1112011678.db2.gz RUCUXBVHLSKLTN-OAQYLSRUSA-N 2 0 366.553 4.080 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466325 1112041407 /nfs/dbraw/zinc/04/14/07/1112041407.db2.gz RNJXXHOVNAUDEW-RBBKRZOGSA-N 2 0 350.506 4.320 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1F ZINC000479550382 1112066272 /nfs/dbraw/zinc/06/62/72/1112066272.db2.gz CGSUOECHLFZJNV-KWOGNLBTSA-N 2 0 360.517 4.467 20 0 FIADRP Cc1ccc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)c(C[NH+](C)C)c1 ZINC000553850624 1112112027 /nfs/dbraw/zinc/11/20/27/1112112027.db2.gz QDFJZNUHISIONM-UHFFFAOYSA-N 2 0 365.521 4.295 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000553875973 1112118393 /nfs/dbraw/zinc/11/83/93/1112118393.db2.gz HPGXWOFIGSWRBY-MJGOQNOKSA-N 2 0 358.555 4.195 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1nnn(-c2ccc(C)cc2)c1C ZINC000479764506 1112135272 /nfs/dbraw/zinc/13/52/72/1112135272.db2.gz GWMLICSZNQWQBS-ROUUACIJSA-N 2 0 357.546 4.045 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000480012154 1112236606 /nfs/dbraw/zinc/23/66/06/1112236606.db2.gz HMNLIWLNGNMBAV-HNNXBMFYSA-N 2 0 360.546 4.176 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cc(F)cc(F)c1 ZINC000480229364 1112340565 /nfs/dbraw/zinc/34/05/65/1112340565.db2.gz PXPPJKWEGHDLHZ-ZACQAIPSSA-N 2 0 374.475 4.425 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2nccn2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000480306441 1112379718 /nfs/dbraw/zinc/37/97/18/1112379718.db2.gz HYIYWLDHEZHDID-RBBKRZOGSA-N 2 0 374.532 4.263 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1)N1CC[NH+](C)CC1 ZINC000480534668 1112464630 /nfs/dbraw/zinc/46/46/30/1112464630.db2.gz DSEGDZOGYACDCQ-GBXCKJPGSA-N 2 0 365.565 4.276 20 0 FIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(-c2ccccc2)c1 ZINC000480535522 1112465666 /nfs/dbraw/zinc/46/56/66/1112465666.db2.gz IYELEUMJGNVLJA-IBGZPJMESA-N 2 0 351.538 4.030 20 0 FIADRP COCc1csc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000667688632 1112469833 /nfs/dbraw/zinc/46/98/33/1112469833.db2.gz YMALSGIGCUXFFT-UHFFFAOYSA-N 2 0 370.562 4.383 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(N2CCCC2=O)c1 ZINC000480613861 1112501552 /nfs/dbraw/zinc/50/15/52/1112501552.db2.gz TZDRISUJPLPEOY-HSALFYBXSA-N 2 0 371.569 4.222 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1OC ZINC000480603355 1112505051 /nfs/dbraw/zinc/50/50/51/1112505051.db2.gz RUTLECPFLHFQDZ-ZACQAIPSSA-N 2 0 366.521 4.252 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000480617503 1112511207 /nfs/dbraw/zinc/51/12/07/1112511207.db2.gz RJILBOWXMQLJBG-MOPGFXCFSA-N 2 0 374.573 4.379 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480636189 1112524754 /nfs/dbraw/zinc/52/47/54/1112524754.db2.gz CZKZLUPZGJAURZ-KURKYZTESA-N 2 0 371.569 4.325 20 0 FIADRP CCC(CC)(CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@H](C)c1ccccc1 ZINC000667727984 1112544901 /nfs/dbraw/zinc/54/49/01/1112544901.db2.gz LXMRKRWIWZUAGA-QGZVFWFLSA-N 2 0 368.525 4.176 20 0 FIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(-c4ccncc4)cc3F)C2)CC1 ZINC000554879020 1112549859 /nfs/dbraw/zinc/54/98/59/1112549859.db2.gz KKBAFBGHRFXDEQ-FQEVSTJZSA-N 2 0 353.485 4.051 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2CN2CC[NH+](CC)CC2)s1 ZINC000480719403 1112562022 /nfs/dbraw/zinc/56/20/22/1112562022.db2.gz XUHABVOZLZUKFB-GOSISDBHSA-N 2 0 371.594 4.299 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](CC)CC3)cc2)s1 ZINC000480733483 1112569322 /nfs/dbraw/zinc/56/93/22/1112569322.db2.gz UKFPCSUFZADXLO-GOSISDBHSA-N 2 0 371.594 4.299 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccc(F)cc1 ZINC000480733666 1112569457 /nfs/dbraw/zinc/56/94/57/1112569457.db2.gz USLFSESKXIZJJY-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cc(C)sc2C)CC1 ZINC000480738189 1112571630 /nfs/dbraw/zinc/57/16/30/1112571630.db2.gz QRKXIJWFDRQDAO-SFHVURJKSA-N 2 0 371.594 4.353 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000480751128 1112577981 /nfs/dbraw/zinc/57/79/81/1112577981.db2.gz UYKMPLCWHJMWAH-JCTONOIOSA-N 2 0 363.549 4.013 20 0 FIADRP CSC1(C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)CC[NH+](C)CC1 ZINC000555003374 1112613218 /nfs/dbraw/zinc/61/32/18/1112613218.db2.gz VTFNIESVAJOOQP-CQSZACIVSA-N 2 0 360.489 4.053 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000481309999 1112884770 /nfs/dbraw/zinc/88/47/70/1112884770.db2.gz STBPYJMMWUQHBP-OPAMFIHVSA-N 2 0 356.485 4.179 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CCCO2 ZINC000481320857 1112892116 /nfs/dbraw/zinc/89/21/16/1112892116.db2.gz NMCLQKRZTSVPLT-JOCHJYFZSA-N 2 0 368.521 4.247 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000481333331 1112903869 /nfs/dbraw/zinc/90/38/69/1112903869.db2.gz SKHUQKFBBCQUAQ-PKOBYXMFSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)COC2 ZINC000481552647 1112975467 /nfs/dbraw/zinc/97/54/67/1112975467.db2.gz OLOYGWKKWXDWRM-SFHVURJKSA-N 2 0 350.506 4.280 20 0 FIADRP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877869 1113041087 /nfs/dbraw/zinc/04/10/87/1113041087.db2.gz KGCNLWXUFBEUKJ-SUMWQHHRSA-N 2 0 365.399 4.054 20 0 FIADRP CC1([NH+]2CCC2)CCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)CC1 ZINC000899878874 1113043060 /nfs/dbraw/zinc/04/30/60/1113043060.db2.gz YQVGACADOKLCDI-UHFFFAOYSA-N 2 0 365.399 4.198 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481711074 1113050118 /nfs/dbraw/zinc/05/01/18/1113050118.db2.gz DEJVGALNOCWKTC-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H](c3cccnc3)C3CCC3)CC2)c1 ZINC000481917399 1113131993 /nfs/dbraw/zinc/13/19/93/1113131993.db2.gz FYYSWJGEAGPJHP-NRFANRHFSA-N 2 0 355.551 4.486 20 0 FIADRP c1cc(C[NH+]2CCCC2)ccc1CNC1CC[NH+](C2CCCCC2)CC1 ZINC000162898990 1113172739 /nfs/dbraw/zinc/17/27/39/1113172739.db2.gz CKQIQGIQQTYJOD-UHFFFAOYSA-N 2 0 355.570 4.169 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCCc2cccc3ccccc32)[C@H](C)C1 ZINC000482137656 1113179668 /nfs/dbraw/zinc/17/96/68/1113179668.db2.gz MZJZHNIEVFQSDI-HYBUGGRVSA-N 2 0 368.565 4.499 20 0 FIADRP C[C@H]1CCC[C@H](C)C1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482258553 1113208527 /nfs/dbraw/zinc/20/85/27/1113208527.db2.gz FMWUOGBUBKYXTQ-OALUTQOASA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482258554 1113208656 /nfs/dbraw/zinc/20/86/56/1113208656.db2.gz FMWUOGBUBKYXTQ-RTBURBONSA-N 2 0 374.569 4.091 20 0 FIADRP COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000162904311 1113211330 /nfs/dbraw/zinc/21/13/30/1113211330.db2.gz MFVVIHSJUKFQEQ-GOSISDBHSA-N 2 0 368.521 4.459 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000482441437 1113257509 /nfs/dbraw/zinc/25/75/09/1113257509.db2.gz VBGJVNANOBGTBG-UNMCSNQZSA-N 2 0 374.532 4.088 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000482454236 1113265744 /nfs/dbraw/zinc/26/57/44/1113265744.db2.gz WZHJONFODZVXLX-FPOVZHCZSA-N 2 0 352.547 4.378 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000482490115 1113272724 /nfs/dbraw/zinc/27/27/24/1113272724.db2.gz WVUXXEATCIEWMO-NHCUHLMSSA-N 2 0 365.565 4.278 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000482494438 1113278340 /nfs/dbraw/zinc/27/83/40/1113278340.db2.gz CQPOAMJNMXIYHO-SFTDATJTSA-N 2 0 365.565 4.278 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc(Cl)c(OC)cc2OC)CC1 ZINC000482521181 1113283784 /nfs/dbraw/zinc/28/37/84/1113283784.db2.gz XGVAGESKGIREID-CQSZACIVSA-N 2 0 354.922 4.130 20 0 FIADRP CC(C)CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482548244 1113291313 /nfs/dbraw/zinc/29/13/13/1113291313.db2.gz FDUFLAOHEQHQRV-PXNSSMCTSA-N 2 0 351.966 4.043 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000482630795 1113315103 /nfs/dbraw/zinc/31/51/03/1113315103.db2.gz MUDJHUYPNNFTKD-UHFFFAOYSA-N 2 0 365.521 4.295 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486708707 1113627326 /nfs/dbraw/zinc/62/73/26/1113627326.db2.gz KDCLBLUVLKJJPN-VQIMIIECSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 ZINC000488107720 1113855823 /nfs/dbraw/zinc/85/58/23/1113855823.db2.gz GZIBMBSDYPZAJW-CIQXWFTPSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]C(c2ccccc2)c2ccccc2)C[C@H](C)O1 ZINC000490119563 1114220032 /nfs/dbraw/zinc/22/00/32/1114220032.db2.gz PPKATMZVIMIVIF-BGYRXZFFSA-N 2 0 352.522 4.255 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](CN[C@@H](c3ccccc3)c3ccccn3)C2)cc1 ZINC000491019705 1114361804 /nfs/dbraw/zinc/36/18/04/1114361804.db2.gz LGESSCDMXFYBPT-RDGATRHJSA-N 2 0 371.528 4.325 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](CN[C@@H](c3ccccc3)c3ccccn3)C2)cc1 ZINC000491019701 1114362021 /nfs/dbraw/zinc/36/20/21/1114362021.db2.gz LGESSCDMXFYBPT-DHLKQENFSA-N 2 0 371.528 4.325 20 0 FIADRP c1ccc(CCOCCC[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491059834 1114369015 /nfs/dbraw/zinc/36/90/15/1114369015.db2.gz JLTQSXRSUBAZCM-HSZRJFAPSA-N 2 0 358.570 4.224 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000571210996 1114452939 /nfs/dbraw/zinc/45/29/39/1114452939.db2.gz UYCFFHFZZUFVNH-DKUWSORSSA-N 2 0 363.549 4.453 20 0 FIADRP Cn1nc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000589646881 1114821458 /nfs/dbraw/zinc/82/14/58/1114821458.db2.gz FKFATYYDLKGTNE-UHFFFAOYSA-N 2 0 362.521 4.239 20 0 FIADRP c1c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2n1Cc1ccccc1 ZINC000590612029 1114952866 /nfs/dbraw/zinc/95/28/66/1114952866.db2.gz UZZLBNNHPILMQW-VXKWHMMOSA-N 2 0 359.517 4.406 20 0 FIADRP c1c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2n1Cc1ccccc1 ZINC000590612030 1114952893 /nfs/dbraw/zinc/95/28/93/1114952893.db2.gz UZZLBNNHPILMQW-YADHBBJMSA-N 2 0 359.517 4.406 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]13)C2 ZINC001168400290 1115037199 /nfs/dbraw/zinc/03/71/99/1115037199.db2.gz LOBYWYBKIJHKFM-GNLZIIPMSA-N 2 0 364.508 4.183 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)C2 ZINC001168400291 1115037492 /nfs/dbraw/zinc/03/74/92/1115037492.db2.gz LOBYWYBKIJHKFM-IQFVJIFQSA-N 2 0 364.508 4.183 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)C2 ZINC001168400292 1115037615 /nfs/dbraw/zinc/03/76/15/1115037615.db2.gz LOBYWYBKIJHKFM-TWDDROGUSA-N 2 0 364.508 4.183 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)C2)c1 ZINC000573366142 1115093946 /nfs/dbraw/zinc/09/39/46/1115093946.db2.gz FXRXYYGBBHQEFO-TWEIKEKHSA-N 2 0 370.487 4.365 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(C)c(F)c3)CC2)cc1 ZINC000596657629 1115604401 /nfs/dbraw/zinc/60/44/01/1115604401.db2.gz FCMQWAILWXJSBF-UHFFFAOYSA-N 2 0 356.485 4.145 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3F)CC1)C2 ZINC001168414628 1115777837 /nfs/dbraw/zinc/77/78/37/1115777837.db2.gz HKDVBRRYMMRYLP-QFIPXVFZSA-N 2 0 370.487 4.324 20 0 FIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc(C[NH+](CC)CC)cc2)C1 ZINC000599333840 1115808514 /nfs/dbraw/zinc/80/85/14/1115808514.db2.gz ZYJQRMNMBAWOGS-LJQANCHMSA-N 2 0 373.585 4.159 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC[N@@H+]1C ZINC000608061487 1116079710 /nfs/dbraw/zinc/07/97/10/1116079710.db2.gz FMQIQWJMYVKTHX-VQIMIIECSA-N 2 0 358.913 4.491 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC[N@@H+]1C ZINC000608061485 1116079971 /nfs/dbraw/zinc/07/99/71/1116079971.db2.gz FMQIQWJMYVKTHX-QFBILLFUSA-N 2 0 358.913 4.491 20 0 FIADRP C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)ccc21 ZINC000456309143 1116177996 /nfs/dbraw/zinc/17/79/96/1116177996.db2.gz JLKKGWVCRXHMKW-JOCHJYFZSA-N 2 0 363.505 4.084 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509439 1116313902 /nfs/dbraw/zinc/31/39/02/1116313902.db2.gz SHXQKIBYBULFRR-BZNIZROVSA-N 2 0 357.723 4.021 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000539546089 1116341681 /nfs/dbraw/zinc/34/16/81/1116341681.db2.gz DWHAYVHATXIVTC-UHFFFAOYSA-N 2 0 361.283 4.061 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Br)c2)C[C@@H]1C ZINC000539821446 1116385325 /nfs/dbraw/zinc/38/53/25/1116385325.db2.gz UKZVOTMMSLJZBD-VKJFTORMSA-N 2 0 353.348 4.357 20 0 FIADRP C[NH+](C)CC1CC[NH+]([C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000539842365 1116389577 /nfs/dbraw/zinc/38/95/77/1116389577.db2.gz UGVKUCSOXBJYQG-SFHVURJKSA-N 2 0 351.332 4.100 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000462788552 1117772619 /nfs/dbraw/zinc/77/26/19/1117772619.db2.gz OYBSJWCGVHJTPV-KRWDZBQOSA-N 2 0 356.485 4.356 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000462802750 1117785826 /nfs/dbraw/zinc/78/58/26/1117785826.db2.gz ADSQYGJYRYGIMR-IKICRFKJSA-N 2 0 351.332 4.015 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000462803684 1117786887 /nfs/dbraw/zinc/78/68/87/1117786887.db2.gz CDYRIXNRZRDHLD-DENIHFKCSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000462804596 1117787031 /nfs/dbraw/zinc/78/70/31/1117787031.db2.gz DTQWPDGFNANMAF-MOPGFXCFSA-N 2 0 371.569 4.051 20 0 FIADRP CO[C@@H](C)CC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462806283 1117788544 /nfs/dbraw/zinc/78/85/44/1117788544.db2.gz JIZYHLFIGXHOKS-RXVVDRJESA-N 2 0 350.522 4.394 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)CC1 ZINC000462814835 1117792585 /nfs/dbraw/zinc/79/25/85/1117792585.db2.gz GMUSUNKIKMCZRF-RZDIXWSQSA-N 2 0 351.332 4.159 20 0 FIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000540137819 1117901016 /nfs/dbraw/zinc/90/10/16/1117901016.db2.gz RZQVCYCQDQDRKJ-QFIPXVFZSA-N 2 0 365.521 4.418 20 0 FIADRP CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540175338 1117915805 /nfs/dbraw/zinc/91/58/05/1117915805.db2.gz UFNZYOQEANTBRL-JTSKRJEESA-N 2 0 368.521 4.364 20 0 FIADRP C[C@H](C[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C[NH+]1CCCCC1 ZINC000463071345 1117956123 /nfs/dbraw/zinc/95/61/23/1117956123.db2.gz LMPNHFYSCLWSFW-GOSISDBHSA-N 2 0 363.977 4.016 20 0 FIADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCCCn2c(C)nc3ccccc32)C1 ZINC000463095693 1117964151 /nfs/dbraw/zinc/96/41/51/1117964151.db2.gz FRYSAOOWNQBWKB-HXUWFJFHSA-N 2 0 356.558 4.179 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463136517 1117984723 /nfs/dbraw/zinc/98/47/23/1117984723.db2.gz KKLSOFYAZZKSBP-KHUIQGCPSA-N 2 0 371.613 4.387 20 0 FIADRP Cc1sc(CC[NH2+]C2CC[NH+](CC3CC3)CC2)nc1-c1ccccc1 ZINC000540393189 1118026934 /nfs/dbraw/zinc/02/69/34/1118026934.db2.gz HISLUDMSGAVKKS-UHFFFAOYSA-N 2 0 355.551 4.125 20 0 FIADRP COC[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)c(F)c1 ZINC000540395179 1118029106 /nfs/dbraw/zinc/02/91/06/1118029106.db2.gz PZZPUGVNEJIJEN-WIXQSORDSA-N 2 0 366.496 4.285 20 0 FIADRP Cc1ccc(CC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c(C)c1 ZINC000540475533 1118077789 /nfs/dbraw/zinc/07/77/89/1118077789.db2.gz XUAUWYGJOHKGOB-JOCHJYFZSA-N 2 0 364.533 4.424 20 0 FIADRP Cc1ccccc1CC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540495264 1118091875 /nfs/dbraw/zinc/09/18/75/1118091875.db2.gz SIZMGKVXARUZRG-OAQYLSRUSA-N 2 0 350.506 4.115 20 0 FIADRP Cc1ccsc1CC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540507752 1118098764 /nfs/dbraw/zinc/09/87/64/1118098764.db2.gz NOWDZHGSGDIHOZ-SFHVURJKSA-N 2 0 356.535 4.177 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)[C@@H](C)C1 ZINC000540551852 1118122803 /nfs/dbraw/zinc/12/28/03/1118122803.db2.gz VORAGIPJXIHYBE-UGKGYDQZSA-N 2 0 374.569 4.044 20 0 FIADRP Cc1cccc(COc2ccc([C@H](C)[NH2+]CC3=CC[N@H+](C)CC3)cc2)c1 ZINC000540608808 1118148590 /nfs/dbraw/zinc/14/85/90/1118148590.db2.gz UHNUNVFFDYEIOP-IBGZPJMESA-N 2 0 350.506 4.487 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000540708156 1118195730 /nfs/dbraw/zinc/19/57/30/1118195730.db2.gz MSJJAKRYPUVTDX-UNMCSNQZSA-N 2 0 356.510 4.205 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000540748026 1118231801 /nfs/dbraw/zinc/23/18/01/1118231801.db2.gz NWCVFWRBRLCMEX-AUSIDOKSSA-N 2 0 351.538 4.379 20 0 FIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000540992651 1118341903 /nfs/dbraw/zinc/34/19/03/1118341903.db2.gz YIULYTOEUVHGRV-XLIONFOSSA-N 2 0 370.562 4.216 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Br)[C@@H](C)C1 ZINC000541281475 1118462283 /nfs/dbraw/zinc/46/22/83/1118462283.db2.gz HUCZHWNKDOUKRQ-MAUKXSAKSA-N 2 0 353.348 4.044 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000541534449 1118552705 /nfs/dbraw/zinc/55/27/05/1118552705.db2.gz QGPDSSHRIFDJQD-MAUKXSAKSA-N 2 0 350.441 4.093 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000541557812 1118562233 /nfs/dbraw/zinc/56/22/33/1118562233.db2.gz JKLKYYJNIXYIOB-RBUKOAKNSA-N 2 0 374.573 4.475 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccn(C)n1 ZINC000541740813 1118629092 /nfs/dbraw/zinc/62/90/92/1118629092.db2.gz DWWPVEJTKJTXJC-IBGZPJMESA-N 2 0 360.933 4.026 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168439308 1118689179 /nfs/dbraw/zinc/68/91/79/1118689179.db2.gz SIOWNZKDICUELZ-QHCPKHFHSA-N 2 0 352.497 4.279 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000541914740 1118699222 /nfs/dbraw/zinc/69/92/22/1118699222.db2.gz IXBJQEQHXFUOIN-YRNRMSPPSA-N 2 0 354.485 4.141 20 0 FIADRP FC(F)(F)c1cccc(OCCC[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000303068479 1118788727 /nfs/dbraw/zinc/78/87/27/1118788727.db2.gz NZFFGHZMAWBXIF-UHFFFAOYSA-N 2 0 370.459 4.282 20 0 FIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303090223 1118796712 /nfs/dbraw/zinc/79/67/12/1118796712.db2.gz ZHNSSGWGUUBAKR-OAHLLOKOSA-N 2 0 356.432 4.454 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(SC)c(OC)c2)CC1 ZINC000303447914 1118940438 /nfs/dbraw/zinc/94/04/38/1118940438.db2.gz ZWHDLZJDYCGGCJ-UHFFFAOYSA-N 2 0 350.572 4.361 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1OC ZINC000173306414 1119031409 /nfs/dbraw/zinc/03/14/09/1119031409.db2.gz QCCUYZUHUZSLIE-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000542465094 1119287890 /nfs/dbraw/zinc/28/78/90/1119287890.db2.gz SRAQIXGOTTZZLL-BTYIYWSLSA-N 2 0 350.441 4.298 20 0 FIADRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c1 ZINC000177200096 1119316364 /nfs/dbraw/zinc/31/63/64/1119316364.db2.gz SRBNBPRDFAMYGZ-FHWLQOOXSA-N 2 0 368.521 4.155 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000178117210 1119372285 /nfs/dbraw/zinc/37/22/85/1119372285.db2.gz IVXNCBWEANWBPH-KSZLIROESA-N 2 0 354.542 4.057 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1cccc(OCc2ccccc2)c1 ZINC000311523624 1119378630 /nfs/dbraw/zinc/37/86/30/1119378630.db2.gz PVANYEVAEPVTDF-SELNLUPBSA-N 2 0 352.522 4.126 20 0 FIADRP CC(C)Oc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311704807 1119385421 /nfs/dbraw/zinc/38/54/21/1119385421.db2.gz VAQGWMPFZFZQKZ-KNQAVFIVSA-N 2 0 352.522 4.474 20 0 FIADRP c1ccc(C[N@H+]2CCCC[C@H](C[NH2+][C@@H]3CCCC34CCOCC4)C2)cc1 ZINC000311892243 1119393583 /nfs/dbraw/zinc/39/35/83/1119393583.db2.gz YPKVVOBZLJVWSK-FGZHOGPDSA-N 2 0 356.554 4.228 20 0 FIADRP COC[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000493889987 1119503622 /nfs/dbraw/zinc/50/36/22/1119503622.db2.gz ZUBYDTAOABYHFB-NRFANRHFSA-N 2 0 358.913 4.282 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000493923336 1119509729 /nfs/dbraw/zinc/50/97/29/1119509729.db2.gz AWESDVQHXWQPED-YPAWHYETSA-N 2 0 354.538 4.110 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@H](C)C1 ZINC000542470615 1119512018 /nfs/dbraw/zinc/51/20/18/1119512018.db2.gz KTWJQSGJJOYIBD-PWHSHALESA-N 2 0 374.569 4.091 20 0 FIADRP C[C@H]1CC[NH+](Cc2ccccc2C[N@@H+]2CCS[C@@H](C)CC2)CCS1 ZINC000494025220 1119526924 /nfs/dbraw/zinc/52/69/24/1119526924.db2.gz AFJRJISIOAATNG-ROUUACIJSA-N 2 0 364.624 4.341 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1ccc(C(F)F)cc1)C1CC[NH+](C)CC1 ZINC000185181713 1119646090 /nfs/dbraw/zinc/64/60/90/1119646090.db2.gz GLLMJAGGHHNWKA-UHFFFAOYSA-N 2 0 373.491 4.444 20 0 FIADRP C[NH+](C)[C@@H](CNC1CC[NH+](C(C)(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000186569660 1119737246 /nfs/dbraw/zinc/73/72/46/1119737246.db2.gz PFKQSOBCAHENAI-SFHVURJKSA-N 2 0 371.491 4.161 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000186584046 1119737654 /nfs/dbraw/zinc/73/76/54/1119737654.db2.gz FQXGDBKWDOPQJY-UXHICEINSA-N 2 0 351.538 4.030 20 0 FIADRP C[C@H](O)[C@@](C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1 ZINC000188917571 1119805909 /nfs/dbraw/zinc/80/59/09/1119805909.db2.gz BKGZANILNHFYET-WMZHIEFXSA-N 2 0 358.570 4.003 20 0 FIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)[C@H]3CCC[NH+]3C3CCCC3)c2C1 ZINC000494504870 1119872197 /nfs/dbraw/zinc/87/21/97/1119872197.db2.gz CZFOQEYWAHXNDJ-OAQYLSRUSA-N 2 0 355.526 4.004 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)cn1 ZINC000190720598 1119946377 /nfs/dbraw/zinc/94/63/77/1119946377.db2.gz RYZVOELHWMEJBT-UHFFFAOYSA-N 2 0 366.553 4.059 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCSc3ccc(OC)cc32)c1 ZINC000191510491 1119981119 /nfs/dbraw/zinc/98/11/19/1119981119.db2.gz WYVHJMZTPPAOGQ-FQEVSTJZSA-N 2 0 356.535 4.474 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)ccc1O ZINC000494678079 1120026881 /nfs/dbraw/zinc/02/68/81/1120026881.db2.gz CPGNASZBZYAPIO-UHFFFAOYSA-N 2 0 368.521 4.313 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](Cc2ccccc2)c2cccs2)CC1 ZINC000192795639 1120084427 /nfs/dbraw/zinc/08/44/27/1120084427.db2.gz RSXFJLRMGQQENN-NRFANRHFSA-N 2 0 371.594 4.038 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000192918009 1120090308 /nfs/dbraw/zinc/09/03/08/1120090308.db2.gz LOGYDZLGZSKIOM-IBGZPJMESA-N 2 0 356.535 4.029 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000193980527 1120224040 /nfs/dbraw/zinc/22/40/40/1120224040.db2.gz MZHNWBJXTGZLLS-INIZCTEOSA-N 2 0 372.475 4.117 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3sccc3Cl)CC2)C[C@H](C)O1 ZINC000494985582 1120412118 /nfs/dbraw/zinc/41/21/18/1120412118.db2.gz LGEZONBEELVOLY-GJZGRUSLSA-N 2 0 356.963 4.113 20 0 FIADRP Cc1ccccc1[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)C1CCCC1 ZINC000495034020 1120439849 /nfs/dbraw/zinc/43/98/49/1120439849.db2.gz ZPZFPGJTPIFBHW-QHCPKHFHSA-N 2 0 367.537 4.352 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495105402 1120477242 /nfs/dbraw/zinc/47/72/42/1120477242.db2.gz BRMCMPBXMWGHLH-DYESRHJHSA-N 2 0 368.569 4.255 20 0 FIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495410138 1120787814 /nfs/dbraw/zinc/78/78/14/1120787814.db2.gz TYPRIYGSCDIKHJ-RBBKRZOGSA-N 3 0 369.597 4.284 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc(Br)ncc1F ZINC000762729463 1120955979 /nfs/dbraw/zinc/95/59/79/1120955979.db2.gz KGWWMSVQXMUUJO-OLZOCXBDSA-N 2 0 360.315 4.144 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)o2)cc1 ZINC000237206687 1120974753 /nfs/dbraw/zinc/97/47/53/1120974753.db2.gz UKTKVYRHFNANBE-UHFFFAOYSA-N 2 0 364.489 4.485 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4cc[nH]c43)cc2)C[C@H](C)O1 ZINC000237781276 1120984196 /nfs/dbraw/zinc/98/41/96/1120984196.db2.gz XTXOIJPLMXXBCI-HDICACEKSA-N 2 0 363.505 4.067 20 0 FIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3cccc(OC)c3OC)CC2)CC1 ZINC001203452660 1120995736 /nfs/dbraw/zinc/99/57/36/1120995736.db2.gz OIKMPNGKRWJHES-UHFFFAOYSA-N 2 0 360.542 4.038 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2CC(F)(F)F)[C@H](C)C1 ZINC000624307316 1121152518 /nfs/dbraw/zinc/15/25/18/1121152518.db2.gz GXOQQTMDQNXYKJ-VQIMIIECSA-N 2 0 372.475 4.018 20 0 FIADRP CC[NH+]1CCC(NC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000043391364 1121196722 /nfs/dbraw/zinc/19/67/22/1121196722.db2.gz YTYIBRVIPLSSKG-UHFFFAOYSA-N 2 0 372.557 4.057 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2cccc(C[NH+]3CCCC3)c2)c1 ZINC000059949308 1121455077 /nfs/dbraw/zinc/45/50/77/1121455077.db2.gz QUZZDJDMZHOPNT-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000671739914 1121636438 /nfs/dbraw/zinc/63/64/38/1121636438.db2.gz DIJUQRGZHLRPHG-MRXNPFEDSA-N 2 0 365.477 4.370 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc2c(c1)OCCO2 ZINC000123923560 1121646178 /nfs/dbraw/zinc/64/61/78/1121646178.db2.gz JPPZNHJZUYXFQP-HXUWFJFHSA-N 2 0 354.494 4.150 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CCC2 ZINC000125500229 1121785567 /nfs/dbraw/zinc/78/55/67/1121785567.db2.gz HJLABSUJFQYCGY-QGZVFWFLSA-N 2 0 361.580 4.392 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(OC)c1 ZINC000125512548 1121786613 /nfs/dbraw/zinc/78/66/13/1121786613.db2.gz ZMLFONLGUUFNDM-INIZCTEOSA-N 2 0 374.550 4.328 20 0 FIADRP CC(C)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccnn1C ZINC000671762009 1121794872 /nfs/dbraw/zinc/79/48/72/1121794872.db2.gz QSHWXAWDWMDGOS-LZBANZJXSA-N 2 0 368.569 4.193 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125730713 1121818412 /nfs/dbraw/zinc/81/84/12/1121818412.db2.gz YLZNBVBGADXAEW-RTBURBONSA-N 2 0 374.573 4.331 20 0 FIADRP Fc1cccc(Br)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC001649106442 1121835707 /nfs/dbraw/zinc/83/57/07/1121835707.db2.gz GAVJVELATCUTDY-UHFFFAOYSA-N 2 0 357.311 4.334 20 0 FIADRP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc2[nH]cc(CC[NH+]3CCCC3)c2c1 ZINC001168601092 1121855410 /nfs/dbraw/zinc/85/54/10/1121855410.db2.gz HPUQCKCVXMKSPM-VXKWHMMOSA-N 2 0 354.542 4.091 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccs1 ZINC000126697384 1121977828 /nfs/dbraw/zinc/97/78/28/1121977828.db2.gz NNCITXPPZHQSSR-YJBOKZPZSA-N 2 0 361.530 4.441 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3c(F)cccc3F)cc2)CC1 ZINC000917000837 1121996213 /nfs/dbraw/zinc/99/62/13/1121996213.db2.gz YIBVQBSGUGHGBH-NRFANRHFSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccccc3F)cc2)C1 ZINC000917006697 1121999142 /nfs/dbraw/zinc/99/91/42/1121999142.db2.gz UQXFLZGXLSOVHN-PMAPCBKXSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3)cc2)C1 ZINC000917006688 1121999513 /nfs/dbraw/zinc/99/95/13/1121999513.db2.gz UMMWCNVMQCAUPH-IXFSTUDKSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccccc3F)cc2)C1 ZINC000917006696 1121999544 /nfs/dbraw/zinc/99/95/44/1121999544.db2.gz UQXFLZGXLSOVHN-IXFSTUDKSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc(F)cc2F)cc1 ZINC000917008230 1122000201 /nfs/dbraw/zinc/00/02/01/1122000201.db2.gz HKXZEZNXUSBREA-ZHRRBRCNSA-N 2 0 374.475 4.162 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168613678 1122020526 /nfs/dbraw/zinc/02/05/26/1122020526.db2.gz JYCIXDXMBLTLHU-PZJWPPBQSA-N 2 0 360.542 4.015 20 0 FIADRP CCCc1ccc(CNc2ccc(C[NH+]3CCC(C[NH3+])CC3)cc2)cc1 ZINC001168635647 1122257697 /nfs/dbraw/zinc/25/76/97/1122257697.db2.gz OVSQYCMYGIFZNO-UHFFFAOYSA-N 2 0 351.538 4.422 20 0 FIADRP C[C@H]([NH2+]C1(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000497593057 1122301665 /nfs/dbraw/zinc/30/16/65/1122301665.db2.gz WNPKVYUKGWPVLX-PZJWPPBQSA-N 2 0 371.569 4.031 20 0 FIADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]CCc2nccn2Cc2ccccc2)C1 ZINC000129246905 1122559635 /nfs/dbraw/zinc/55/96/35/1122559635.db2.gz DBIQWXQUNCUVLJ-DLBZAZTESA-N 2 0 351.416 4.185 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1c1ccccc1 ZINC000556053497 1122625540 /nfs/dbraw/zinc/62/55/40/1122625540.db2.gz TVUPZEYJAALGKY-VXNXHJTFSA-N 2 0 363.549 4.249 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)cn1 ZINC000556057361 1122627919 /nfs/dbraw/zinc/62/79/19/1122627919.db2.gz BPIQMZOAGZZAHH-UHFFFAOYSA-N 2 0 360.505 4.201 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)C1 ZINC000556059634 1122628984 /nfs/dbraw/zinc/62/89/84/1122628984.db2.gz UMBYBLSCYIMBPV-MQFRRQCYSA-N 2 0 357.586 4.170 20 0 FIADRP C[C@H]1CC[N@H+](C)CCN1C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000556089803 1122643496 /nfs/dbraw/zinc/64/34/96/1122643496.db2.gz MKWVMGISOCEJHT-SFHVURJKSA-N 2 0 372.557 4.009 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000556233991 1122750772 /nfs/dbraw/zinc/75/07/72/1122750772.db2.gz UJYVMEQNCIFCKZ-UGKGYDQZSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCC34CCCC4)C3(C2)CCOCC3)cc1 ZINC000556234331 1122751567 /nfs/dbraw/zinc/75/15/67/1122751567.db2.gz WRGZNKUTMNQGIG-FGZHOGPDSA-N 2 0 368.565 4.228 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000556239199 1122756464 /nfs/dbraw/zinc/75/64/64/1122756464.db2.gz BBJPJCHBRZKPCU-UGKGYDQZSA-N 2 0 362.533 4.395 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cn1 ZINC000498423816 1122789229 /nfs/dbraw/zinc/78/92/29/1122789229.db2.gz PVRAOYIWYSZKAD-NRFANRHFSA-N 2 0 359.489 4.038 20 0 FIADRP CC(C)Oc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cn1 ZINC000556857990 1123144257 /nfs/dbraw/zinc/14/42/57/1123144257.db2.gz FRAGASMSKZMKIG-UHFFFAOYSA-N 2 0 367.537 4.402 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000556868737 1123149734 /nfs/dbraw/zinc/14/97/34/1123149734.db2.gz BTXXJEGSSDPJQC-RDTXWAMCSA-N 2 0 356.432 4.358 20 0 FIADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556868725 1123149837 /nfs/dbraw/zinc/14/98/37/1123149837.db2.gz BMLHNFLWICWXPQ-SLFFLAALSA-N 2 0 355.551 4.232 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)nc1-c1ccccc1 ZINC000556887166 1123164956 /nfs/dbraw/zinc/16/49/56/1123164956.db2.gz RXDDFFCFEUTNPK-OTWHNJEPSA-N 2 0 355.551 4.123 20 0 FIADRP CC(C)OCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556891908 1123179642 /nfs/dbraw/zinc/17/96/42/1123179642.db2.gz HHVRNECLRFAXGC-YTFSRNRJSA-N 2 0 358.570 4.472 20 0 FIADRP COc1cccc(C2([NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000556912144 1123203837 /nfs/dbraw/zinc/20/38/37/1123203837.db2.gz QVZYXTVQDPAKMQ-AZUAARDMSA-N 2 0 350.506 4.185 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)CC[N@@H+]1C ZINC000556914518 1123222435 /nfs/dbraw/zinc/22/24/35/1123222435.db2.gz JILBKYHSFUCFQH-CHWSQXEVSA-N 2 0 357.361 4.005 20 0 FIADRP C[C@@H]1CCC[N@@H+](C(C)(C)CN[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499145497 1123286467 /nfs/dbraw/zinc/28/64/67/1123286467.db2.gz HDYNTLWATNIGCA-XBYSBRQOSA-N 2 0 369.597 4.282 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCOc2ccccc2)C3)cc1 ZINC000499145307 1123287126 /nfs/dbraw/zinc/28/71/26/1123287126.db2.gz FXXUMCINPJSLIS-DKUWSORSSA-N 2 0 350.506 4.241 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499159598 1123299389 /nfs/dbraw/zinc/29/93/89/1123299389.db2.gz VRKNKJOJRZMVDW-HLRQEUIKSA-N 2 0 368.496 4.378 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499159597 1123299664 /nfs/dbraw/zinc/29/96/64/1123299664.db2.gz VRKNKJOJRZMVDW-CIQXWFTPSA-N 2 0 368.496 4.378 20 0 FIADRP CC[C@H]1CCCC[N@@H+]1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499214778 1123331067 /nfs/dbraw/zinc/33/10/67/1123331067.db2.gz CUZVSYPRKASBPL-CWBXHPNXSA-N 2 0 355.570 4.036 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000132752449 1123356185 /nfs/dbraw/zinc/35/61/85/1123356185.db2.gz RYHSKKOQXRFNAY-MHECFPHRSA-N 2 0 364.533 4.372 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCOC1 ZINC000133413382 1123485520 /nfs/dbraw/zinc/48/55/20/1123485520.db2.gz GRRQWVOXZNZKRB-JTHBVZDNSA-N 2 0 352.522 4.320 20 0 FIADRP c1csc([C@H](CNC2CC[NH+](C3CCCCC3)CC2)[NH+]2CCCC2)c1 ZINC000134130995 1123595082 /nfs/dbraw/zinc/59/50/82/1123595082.db2.gz HNDMHQUAUVQOOR-FQEVSTJZSA-N 2 0 361.599 4.272 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(CC[NH+](C)C)CC3)cs2)cc1 ZINC000056523407 1124158060 /nfs/dbraw/zinc/15/80/60/1124158060.db2.gz HINPJKWZAFGNGN-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C3)cc1 ZINC000245695171 1124204266 /nfs/dbraw/zinc/20/42/66/1124204266.db2.gz KZMSUWADBAYTKX-BKFWDETESA-N 3 0 369.597 4.428 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245724511 1124220940 /nfs/dbraw/zinc/22/09/40/1124220940.db2.gz PGNWBGPJQALPEF-CIQXWFTPSA-N 2 0 350.506 4.108 20 0 FIADRP c1cnn([C@H]2CCCC[C@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245777220 1124247131 /nfs/dbraw/zinc/24/71/31/1124247131.db2.gz YINVJLKHYSORAP-KCSJKLDESA-N 2 0 364.537 4.152 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCc2nc4ccccc4[nH]2)C3)cc1 ZINC000245776917 1124247494 /nfs/dbraw/zinc/24/74/94/1124247494.db2.gz YFALWBOBFUUFKC-WKCHPHFGSA-N 2 0 374.532 4.281 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)[C@@H](C)C1 ZINC000246564042 1124534430 /nfs/dbraw/zinc/53/44/30/1124534430.db2.gz FFCKNVLHHXJKEK-MGPUTAFESA-N 2 0 372.944 4.268 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3Cl)[C@@H](C)C1 ZINC000246983882 1124578213 /nfs/dbraw/zinc/57/82/13/1124578213.db2.gz KGNBUTFWEFAJSQ-RYGJVYDSSA-N 2 0 350.934 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3Cl)[C@@H](C)C1 ZINC000246983926 1124578298 /nfs/dbraw/zinc/57/82/98/1124578298.db2.gz KGNBUTFWEFAJSQ-YSSFQJQWSA-N 2 0 350.934 4.054 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000247059403 1124585581 /nfs/dbraw/zinc/58/55/81/1124585581.db2.gz NRXWHOAJWLGMKD-ZWKOTPCHSA-N 2 0 372.557 4.276 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1nc(-c2ccccc2)cs1 ZINC000247051039 1124586124 /nfs/dbraw/zinc/58/61/24/1124586124.db2.gz OUTUAUHMLNJRGU-FGTMMUONSA-N 2 0 373.566 4.350 20 0 FIADRP CC(C)n1cc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000247194346 1124597791 /nfs/dbraw/zinc/59/77/91/1124597791.db2.gz UPNZHEWABIMSLW-MOXWOTFGSA-N 2 0 354.542 4.271 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnn(Cc2ccccc2)c1 ZINC000247233884 1124603691 /nfs/dbraw/zinc/60/36/91/1124603691.db2.gz YLRGIQDUCOUXKQ-WOJBJXKFSA-N 2 0 354.542 4.094 20 0 FIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168678342 1124769403 /nfs/dbraw/zinc/76/94/03/1124769403.db2.gz VOIGMRFGKOYVKD-IRLDBZIGSA-N 2 0 360.542 4.112 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000248444577 1124769591 /nfs/dbraw/zinc/76/95/91/1124769591.db2.gz MCUJVEFVEGGJNU-MBSDFSHPSA-N 2 0 352.522 4.057 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCCc2ccccc21 ZINC000248449842 1124770720 /nfs/dbraw/zinc/77/07/20/1124770720.db2.gz OQWAVMKLSZQMEQ-UPVQGACJSA-N 2 0 364.533 4.201 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CCC2 ZINC000248456386 1124773489 /nfs/dbraw/zinc/77/34/89/1124773489.db2.gz SFTQVWOJHJWXRA-UPVQGACJSA-N 2 0 364.533 4.119 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]13)C2 ZINC001168683856 1124801606 /nfs/dbraw/zinc/80/16/06/1124801606.db2.gz APMNAHDMRXGOHS-AMEVOLBXSA-N 2 0 366.936 4.307 20 0 FIADRP Clc1cccc2c1C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168686005 1124824502 /nfs/dbraw/zinc/82/45/02/1124824502.db2.gz VLHCVJMGQBIHAN-ICSRJNTNSA-N 2 0 354.925 4.309 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)CC1 ZINC000521917909 1124827572 /nfs/dbraw/zinc/82/75/72/1124827572.db2.gz LKBQGEKZKMENIQ-KTKPDYKZSA-N 2 0 369.597 4.455 20 0 FIADRP COc1cccc(-c2nc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000649417754 1124841638 /nfs/dbraw/zinc/84/16/38/1124841638.db2.gz DIRWBZARQDDIPJ-ROUUACIJSA-N 2 0 371.550 4.030 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000249087085 1124842923 /nfs/dbraw/zinc/84/29/23/1124842923.db2.gz JHHSCCURISSMBP-KIFXHHALSA-N 2 0 369.597 4.141 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000542941996 1124934278 /nfs/dbraw/zinc/93/42/78/1124934278.db2.gz IPJWFTDMQDZTBW-UHFFFAOYSA-N 2 0 373.585 4.384 20 0 FIADRP CC(C)(C)OC1CC([N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000451061330 1124969950 /nfs/dbraw/zinc/96/99/50/1124969950.db2.gz HVARJRWQZZVHAW-UHFFFAOYSA-N 2 0 356.554 4.321 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000090027659 1124976645 /nfs/dbraw/zinc/97/66/45/1124976645.db2.gz CTDQBOLRKVJKIQ-GOSISDBHSA-N 2 0 368.521 4.409 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000090525015 1125001172 /nfs/dbraw/zinc/00/11/72/1125001172.db2.gz YWNAJUNHVYGPBI-AGRHKRQWSA-N 2 0 371.352 4.412 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000090525010 1125001565 /nfs/dbraw/zinc/00/15/65/1125001565.db2.gz YWNAJUNHVYGPBI-BKTGTZMESA-N 2 0 371.352 4.412 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1nc2ccc(Cl)cc2n1C ZINC000091261384 1125059484 /nfs/dbraw/zinc/05/94/84/1125059484.db2.gz PEACFWLREHVLCI-HUUCEWRRSA-N 2 0 350.938 4.388 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091333639 1125066251 /nfs/dbraw/zinc/06/62/51/1125066251.db2.gz YWMKFMGGTCUNAF-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2)cc1C[NH+]1CCCCC1 ZINC000182202438 1125287629 /nfs/dbraw/zinc/28/76/29/1125287629.db2.gz ZISFSSTZXPVSPW-PGRDOPGGSA-N 2 0 368.521 4.065 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccc(OC)c2)ccc1OC ZINC000182227309 1125301242 /nfs/dbraw/zinc/30/12/42/1125301242.db2.gz JBJOUIYKUZSBBS-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(C)ccc1OC ZINC000093399078 1125319286 /nfs/dbraw/zinc/31/92/86/1125319286.db2.gz DTQKZWFTWKVCKH-NRFANRHFSA-N 2 0 356.510 4.185 20 0 FIADRP CCCCC/C(=C/c1ccccc1)C[NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000602278675 567962712 /nfs/dbraw/zinc/96/27/12/567962712.db2.gz YDFYQMURUWZTKU-MUGAAPJKSA-N 2 0 369.597 4.408 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000602564763 567995490 /nfs/dbraw/zinc/99/54/90/567995490.db2.gz OJAQVGHIWCHJAY-QJMKCXJCSA-N 2 0 374.594 4.024 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)c2nc(-c3ccccc3)no2)CC1 ZINC000066960842 568072344 /nfs/dbraw/zinc/07/23/44/568072344.db2.gz IDKWCPFRISYKGO-QGZVFWFLSA-N 2 0 356.514 4.242 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCC([NH+](CC)CC)CC2)nc1 ZINC001165054692 722007312 /nfs/dbraw/zinc/00/73/12/722007312.db2.gz YFIGXFDCYZJKLV-NRFANRHFSA-N 2 0 358.574 4.329 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2c(C)noc2C)ccc1OC ZINC000182892379 1125668536 /nfs/dbraw/zinc/66/85/36/1125668536.db2.gz CIRGNYAOZHKZFJ-OAHLLOKOSA-N 2 0 359.514 4.035 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)ccc1OC ZINC000182998480 1125714529 /nfs/dbraw/zinc/71/45/29/1125714529.db2.gz LEFFIMZILKWXRF-JKSUJKDBSA-N 2 0 373.541 4.424 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)cc1C[NH+]1CCCCC1 ZINC000183129422 1125755121 /nfs/dbraw/zinc/75/51/21/1125755121.db2.gz LWJRRHHQIMPWBO-UOAUAQBLSA-N 2 0 372.553 4.289 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)CC1 ZINC000154536618 1080231911 /nfs/dbraw/zinc/23/19/11/1080231911.db2.gz HXTXFYVPGLNUKO-INIZCTEOSA-N 2 0 371.541 4.070 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000180460134 1080501689 /nfs/dbraw/zinc/50/16/89/1080501689.db2.gz XQTBPIHLCTWRSL-HXUWFJFHSA-N 2 0 360.448 4.309 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1Cl ZINC000180460174 1080502148 /nfs/dbraw/zinc/50/21/48/1080502148.db2.gz KALRWPVLELFHFG-NRFANRHFSA-N 2 0 358.913 4.369 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CCCO1 ZINC000683344008 1080684153 /nfs/dbraw/zinc/68/41/53/1080684153.db2.gz HUSHQSQKCBPJBB-HXUWFJFHSA-N 2 0 367.537 4.045 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000109787464 1080753115 /nfs/dbraw/zinc/75/31/15/1080753115.db2.gz YGSPVEFKKVDBGX-UHFFFAOYSA-N 2 0 372.340 4.128 20 0 FIADRP COc1ccc(OCCC[N@H+](C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000510219696 1080797749 /nfs/dbraw/zinc/79/77/49/1080797749.db2.gz HIOQGAKWCJNQCP-UHFFFAOYSA-N 2 0 368.521 4.061 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312496253 1080878538 /nfs/dbraw/zinc/87/85/38/1080878538.db2.gz KUCQSJVCRDSFNF-WFXMLNOXSA-N 2 0 368.521 4.265 20 0 FIADRP c1ccc([C@H]2C[C@H]2C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000236654096 1080885033 /nfs/dbraw/zinc/88/50/33/1080885033.db2.gz DGGPFUWEAJDUKC-JTHBVZDNSA-N 2 0 350.506 4.055 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(-c2ccnn2C)c1 ZINC001648810957 1081122444 /nfs/dbraw/zinc/12/24/44/1081122444.db2.gz AKXLYAARWDRJOI-BGYRXZFFSA-N 2 0 368.569 4.243 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+]C2CCN([C@@H]3CCOC3)CC2)cc1 ZINC000655711205 1081129039 /nfs/dbraw/zinc/12/90/39/1081129039.db2.gz GKJFRJYYLLKDER-OAQYLSRUSA-N 2 0 366.505 4.130 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1oc2ccccc2c1Br)C1CC1 ZINC000655792856 1081205185 /nfs/dbraw/zinc/20/51/85/1081205185.db2.gz ROOPIEDXINDDHV-UHFFFAOYSA-N 2 0 351.288 4.159 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CCC3)cc1 ZINC000655806659 1081211369 /nfs/dbraw/zinc/21/13/69/1081211369.db2.gz ZBLUBWCNNMBWHG-BPQIPLTHSA-N 2 0 355.551 4.426 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000655805037 1081211576 /nfs/dbraw/zinc/21/15/76/1081211576.db2.gz JIHNFJDRMSEMPB-RSAASHCRSA-N 2 0 357.723 4.020 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CCC4(CCCC4)O2)C3)cc1 ZINC000655853726 1081265850 /nfs/dbraw/zinc/26/58/50/1081265850.db2.gz YBNKJZLNIKMXEM-KJJMTIBFSA-N 2 0 354.538 4.263 20 0 FIADRP C[C@H](O)[C@H]1CCCC[N@@H+]1C[C@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167337092 1081469817 /nfs/dbraw/zinc/46/98/17/1081469817.db2.gz GZGCQRXXCLRXHP-NKKJXINNSA-N 2 0 366.549 4.138 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](N[C@@H]2CC[NH+](C)[C@H](c3ccccc3)C2)C1 ZINC000580101777 1081593697 /nfs/dbraw/zinc/59/36/97/1081593697.db2.gz IOHVVGLHWMYKDE-JFTIXFDTSA-N 2 0 363.549 4.247 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000312698448 1081595518 /nfs/dbraw/zinc/59/55/18/1081595518.db2.gz RFMYCAXVHFILTL-FPOVZHCZSA-N 2 0 368.521 4.267 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000656201938 1081910659 /nfs/dbraw/zinc/91/06/59/1081910659.db2.gz VKWZCEDLRHCINV-ZDUSSCGKSA-N 2 0 365.399 4.087 20 0 FIADRP C[C@H](C[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)COCc1ccccc1 ZINC000580587184 1082027985 /nfs/dbraw/zinc/02/79/85/1082027985.db2.gz XDXILIXRXFESQP-WTIAFYNJSA-N 2 0 352.522 4.264 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000471599098 1082036978 /nfs/dbraw/zinc/03/69/78/1082036978.db2.gz NYSROAMDLZDGDR-VQTJNVASSA-N 2 0 357.586 4.411 20 0 FIADRP C[C@@H](NC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000471601586 1082042445 /nfs/dbraw/zinc/04/24/45/1082042445.db2.gz JURLHZKSXPNEPE-PJIZGREPSA-N 2 0 357.586 4.311 20 0 FIADRP C[C@@H](NC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000471601587 1082042664 /nfs/dbraw/zinc/04/26/64/1082042664.db2.gz JURLHZKSXPNEPE-VKGYTVAMSA-N 2 0 357.586 4.311 20 0 FIADRP Cc1cnn(CCCCC[N@@H+](C)C[C@H]2CC[NH+](Cc3ccc(C)s3)C2)c1 ZINC000580718291 1082096437 /nfs/dbraw/zinc/09/64/37/1082096437.db2.gz SNIVLUAUAUFVKT-HXUWFJFHSA-N 2 0 374.598 4.186 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000581103909 1082316808 /nfs/dbraw/zinc/31/68/08/1082316808.db2.gz ZGOKMWPWQKTYJA-ARBVUSPFSA-N 2 0 350.453 4.107 20 0 FIADRP C[C@H]([NH2+]CC(C)(C)Oc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155453 1082391434 /nfs/dbraw/zinc/39/14/34/1082391434.db2.gz GJXIFIJBSRRMAA-PZJWPPBQSA-N 2 0 352.522 4.344 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1CCCCCC1 ZINC000510389889 1082477213 /nfs/dbraw/zinc/47/72/13/1082477213.db2.gz UHKABTCRXCCKQB-RTBURBONSA-N 2 0 357.542 4.264 20 0 FIADRP Brc1cccc(CCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000656499068 1082497175 /nfs/dbraw/zinc/49/71/75/1082497175.db2.gz LZYDHZFIXRPLCR-UHFFFAOYSA-N 2 0 374.326 4.035 20 0 FIADRP c1ccc2c(c1)C[NH2+][C@H]2Cc1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000656559932 1082578536 /nfs/dbraw/zinc/57/85/36/1082578536.db2.gz AWTGJWLYLULFJP-NRFANRHFSA-N 2 0 374.488 4.110 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@H]4C)CC3)CC2)c1 ZINC000581517871 1082633584 /nfs/dbraw/zinc/63/35/84/1082633584.db2.gz BLOJQRXOYSLZPN-XMSQKQJNSA-N 2 0 356.554 4.360 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000656677445 1082709703 /nfs/dbraw/zinc/70/97/03/1082709703.db2.gz OGFZOGPFGICFAH-FQEVSTJZSA-N 2 0 350.934 4.272 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCc3ccc(F)cc3F)c2)CC[N@@H+]1C ZINC000647186126 1082940398 /nfs/dbraw/zinc/94/03/98/1082940398.db2.gz CVRJZXHPDMJGKL-KXBFYZLASA-N 2 0 360.448 4.116 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000581973675 1083124344 /nfs/dbraw/zinc/12/43/44/1083124344.db2.gz YTUJUFXGJCTHRK-YSZBQJHXSA-N 2 0 368.521 4.198 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]3CCCF)CC2)cc1 ZINC000510662908 1083228993 /nfs/dbraw/zinc/22/89/93/1083228993.db2.gz ILCZTTLQFFNEFY-RBBKRZOGSA-N 2 0 362.533 4.415 20 0 FIADRP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658318610 1083406233 /nfs/dbraw/zinc/40/62/33/1083406233.db2.gz QQQXTHFNBGCCGN-MJGOQNOKSA-N 2 0 365.546 4.339 20 0 FIADRP Fc1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000658352658 1083423545 /nfs/dbraw/zinc/42/35/45/1083423545.db2.gz HPCXAKJXUBCVTB-SIKLNZKXSA-N 2 0 360.517 4.005 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000510973761 1083542984 /nfs/dbraw/zinc/54/29/84/1083542984.db2.gz AUDUBFGAENQOQK-QVKFZJNVSA-N 2 0 372.484 4.113 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCC2([NH+](C)C)CCCCCC2)cc1)C1CC1 ZINC000510964665 1083544231 /nfs/dbraw/zinc/54/42/31/1083544231.db2.gz CVXRRBCIHHZKLI-UHFFFAOYSA-N 2 0 371.569 4.055 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000535777579 1083651813 /nfs/dbraw/zinc/65/18/13/1083651813.db2.gz MWYHGGHRHLGTAW-PTUXOGIPSA-N 2 0 363.549 4.122 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccc(F)cc2)s1 ZINC000535809147 1083698104 /nfs/dbraw/zinc/69/81/04/1083698104.db2.gz IPALIYXZJKTHTM-RLLQIKCJSA-N 2 0 374.525 4.238 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000535839051 1083796344 /nfs/dbraw/zinc/79/63/44/1083796344.db2.gz LBXGCRNDPFFVNN-FYYLOGMGSA-N 2 0 352.522 4.396 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(Cc2ccccc2Br)CC1 ZINC000570035589 1083856224 /nfs/dbraw/zinc/85/62/24/1083856224.db2.gz LABKBYWBRVPUHT-AWEZNQCLSA-N 2 0 374.326 4.037 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1F ZINC000472459737 1083986560 /nfs/dbraw/zinc/98/65/60/1083986560.db2.gz PPQBHKCRUBIGKJ-HXUWFJFHSA-N 2 0 369.956 4.182 20 0 FIADRP C[C@@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177489934 1083999827 /nfs/dbraw/zinc/99/98/27/1083999827.db2.gz FHEAFNSXRZKUPE-WMZOPIPTSA-N 2 0 367.578 4.017 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000537960155 1084255851 /nfs/dbraw/zinc/25/58/51/1084255851.db2.gz KISUAMZQIMKWJK-MTNREXPMSA-N 2 0 358.570 4.403 20 0 FIADRP C[N@@H+](Cc1ncc(C(C)(C)C)s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000448339312 1084319514 /nfs/dbraw/zinc/31/95/14/1084319514.db2.gz MBJPGCYLTRKXTD-UHFFFAOYSA-N 2 0 358.555 4.184 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3c(C4CCC4)cnn3C)cc2)C1 ZINC000657309187 1084380582 /nfs/dbraw/zinc/38/05/82/1084380582.db2.gz BMHKSLZJJHZGRN-SFHVURJKSA-N 2 0 366.553 4.209 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)nc2)CC1 ZINC000657346476 1084667382 /nfs/dbraw/zinc/66/73/82/1084667382.db2.gz CRUGNZZOKPZQTK-UHFFFAOYSA-N 2 0 357.473 4.225 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1 ZINC000414163327 1084721554 /nfs/dbraw/zinc/72/15/54/1084721554.db2.gz FZPQGHPEPXXKIK-MRXNPFEDSA-N 2 0 365.481 4.059 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccc(F)cc2)cc1 ZINC000414191428 1084775579 /nfs/dbraw/zinc/77/55/79/1084775579.db2.gz RWYKEDIKKRPDBM-JTSKRJEESA-N 2 0 356.485 4.245 20 0 FIADRP COCc1csc(C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000657400357 1084908099 /nfs/dbraw/zinc/90/80/99/1084908099.db2.gz XASVASYQMOWOKW-LFUKPOHLSA-N 2 0 358.551 4.141 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc(-c3cccs3)cc2)ccn1 ZINC000657422704 1084977729 /nfs/dbraw/zinc/97/77/29/1084977729.db2.gz YGWNKCRQQAXYPY-UHFFFAOYSA-N 2 0 367.518 4.040 20 0 FIADRP Cn1cncc1CCC[N@@H+]1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000563350497 1084981239 /nfs/dbraw/zinc/98/12/39/1084981239.db2.gz OQWFWHVDINKSSV-IBGZPJMESA-N 2 0 369.900 4.233 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc4ccncc4s3)cc2)CC1 ZINC000657460241 1085119151 /nfs/dbraw/zinc/11/91/51/1085119151.db2.gz VUFCHBDWKCCRLZ-UHFFFAOYSA-N 2 0 367.518 4.059 20 0 FIADRP CC1=C[C@H](C)C[C@H](C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)C1 ZINC000582577926 1085185991 /nfs/dbraw/zinc/18/59/91/1085185991.db2.gz FKVJNRAJCMCGMQ-UGKGYDQZSA-N 2 0 361.618 4.107 20 0 FIADRP CC[NH+](CC)CCN(CC[NH+]1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC001167589327 1085242167 /nfs/dbraw/zinc/24/21/67/1085242167.db2.gz BGFXOPXESZZZCE-UHFFFAOYSA-N 2 0 372.384 4.233 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCCCNC(=O)OC(C)(C)C)C[C@H]1C ZINC001167589961 1085247289 /nfs/dbraw/zinc/24/72/89/1085247289.db2.gz KZHNGQVLPGPAHZ-RTBURBONSA-N 2 0 369.594 4.266 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(C)cc(C)c(C(C)=O)c2C)CC1 ZINC000075007588 1085509783 /nfs/dbraw/zinc/50/97/83/1085509783.db2.gz GSBYVTZSCDVIKD-UHFFFAOYSA-N 2 0 374.569 4.137 20 0 FIADRP Cc1ccccc1-c1noc([C@H](C)[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)n1 ZINC000074990226 1085510032 /nfs/dbraw/zinc/51/00/32/1085510032.db2.gz DEPGCMVIIMQKNU-KRWDZBQOSA-N 2 0 356.514 4.158 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)C1 ZINC000563460839 1085639499 /nfs/dbraw/zinc/63/94/99/1085639499.db2.gz ZBGNTIHZZYTZFX-RXVVDRJESA-N 2 0 374.912 4.318 20 0 FIADRP c1nc2ccccn2c1C[NH+]1CCC2(CC1)CC[NH+](Cc1ccccc1)CC2 ZINC001203157126 1085667851 /nfs/dbraw/zinc/66/78/51/1085667851.db2.gz LKMKJKIOHAYNMS-UHFFFAOYSA-N 2 0 374.532 4.213 20 0 FIADRP CCCCOc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000657613001 1085690694 /nfs/dbraw/zinc/69/06/94/1085690694.db2.gz TXNHTNWTMMWALK-UHFFFAOYSA-N 2 0 367.537 4.262 20 0 FIADRP Clc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1Cl ZINC000657612980 1085691599 /nfs/dbraw/zinc/69/15/99/1085691599.db2.gz SGVVZLFNCANXKY-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP c1c2ccccc2sc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613867 1085700135 /nfs/dbraw/zinc/70/01/35/1085700135.db2.gz VAFPUEYPXCDUMC-UHFFFAOYSA-N 2 0 351.519 4.298 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@@H]([NH3+])c2ccccc2)cc1 ZINC000237526747 1085710380 /nfs/dbraw/zinc/71/03/80/1085710380.db2.gz XJBCYXNBYOJVKQ-LAUBAEHRSA-N 2 0 351.494 4.090 20 0 FIADRP FCC[C@H]1CCC[N@H+](Cc2cncc(C[NH+]3CCC[C@@H](CCF)C3)c2)C1 ZINC000661690254 1085731702 /nfs/dbraw/zinc/73/17/02/1085731702.db2.gz OYJSBZIPJNDEGO-KDURUIRLSA-N 2 0 365.512 4.225 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H](C)C2CC[NH+](C)CC2)c2ccccc2OC)cc1 ZINC000090772240 1085882118 /nfs/dbraw/zinc/88/21/18/1085882118.db2.gz HERVJGPRHBBXKN-HXOBKFHXSA-N 2 0 368.521 4.113 20 0 FIADRP COc1ccccc1OC[C@H](C)C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000090937716 1085908439 /nfs/dbraw/zinc/90/84/39/1085908439.db2.gz DCDBCXZAABSXCJ-GOSISDBHSA-N 2 0 360.542 4.097 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000652348452 1085927711 /nfs/dbraw/zinc/92/77/11/1085927711.db2.gz FESKZTPOJRTARD-NUJGCVRESA-N 2 0 368.974 4.041 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H](C)C[C@H]2CCCN2C(=O)OC(C)(C)C)CC1 ZINC000236761808 1085941861 /nfs/dbraw/zinc/94/18/61/1085941861.db2.gz QCRJWRGIEKQWPV-IEBWSBKVSA-N 2 0 367.578 4.019 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2cccc(C)c2C)CC1 ZINC000543875293 1085973459 /nfs/dbraw/zinc/97/34/59/1085973459.db2.gz RXEVRURITBKUCQ-UHFFFAOYSA-N 2 0 359.558 4.076 20 0 FIADRP Cc1ccc([C@H]2CCC[C@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1 ZINC000583048076 1086089723 /nfs/dbraw/zinc/08/97/23/1086089723.db2.gz KZFLEYQOFHHZBQ-FGZHOGPDSA-N 2 0 367.537 4.146 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000245950627 1086121520 /nfs/dbraw/zinc/12/15/20/1086121520.db2.gz WJHOMNMFKILVRI-JHDGKUDLSA-N 2 0 358.570 4.267 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 ZINC000583084681 1086162315 /nfs/dbraw/zinc/16/23/15/1086162315.db2.gz KQMICFNVCGKBLN-UHFFFAOYSA-N 2 0 362.317 4.473 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658358574 1086244775 /nfs/dbraw/zinc/24/47/75/1086244775.db2.gz WNNJMLGTCUDIKL-GOSISDBHSA-N 2 0 371.569 4.239 20 0 FIADRP c1ccc2sc(C3CC[NH+](Cc4cccc5c4CC[NH2+]C5)CC3)nc2c1 ZINC000662258845 1086382954 /nfs/dbraw/zinc/38/29/54/1086382954.db2.gz MIEAATQYAAZCOC-UHFFFAOYSA-N 2 0 363.530 4.322 20 0 FIADRP COc1ccccc1-c1nc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cs1 ZINC000662290943 1086397071 /nfs/dbraw/zinc/39/70/71/1086397071.db2.gz AIVIGZZLLDDUBA-KRWDZBQOSA-N 2 0 371.550 4.030 20 0 FIADRP Fc1ccccc1-c1nc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cs1 ZINC000662292922 1086398473 /nfs/dbraw/zinc/39/84/73/1086398473.db2.gz POBIPMUAONTSFC-INIZCTEOSA-N 2 0 359.514 4.161 20 0 FIADRP C[C@@H]1CCC[N@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)[C@@H]1CCC[NH3+] ZINC000662315174 1086413066 /nfs/dbraw/zinc/41/30/66/1086413066.db2.gz RROBWFIXQXYUAI-CXAGYDPISA-N 2 0 372.340 4.161 20 0 FIADRP c1ccc2[nH]c(C3C[NH+](Cc4ccc(C[NH+]5CCCCC5)cc4)C3)nc2c1 ZINC000663342336 1086442171 /nfs/dbraw/zinc/44/21/71/1086442171.db2.gz ZUZAESNQPDJJIA-UHFFFAOYSA-N 2 0 360.505 4.148 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCC[NH+](CC3CC3)C2)CC1 ZINC000663466636 1086566756 /nfs/dbraw/zinc/56/67/56/1086566756.db2.gz WFWWBYSUXQDZDL-BOMBAVFCSA-N 3 0 369.597 4.141 20 0 FIADRP Cc1c([C@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cnn1-c1ccc(F)cc1 ZINC000663468221 1086572245 /nfs/dbraw/zinc/57/22/45/1086572245.db2.gz KLFFYSBIMDMSAO-LPHOPBHVSA-N 2 0 370.516 4.092 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000162903175 1086582442 /nfs/dbraw/zinc/58/24/42/1086582442.db2.gz FFRIJVBROARHSL-KRWDZBQOSA-N 2 0 351.494 4.092 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001167827564 1086628116 /nfs/dbraw/zinc/62/81/16/1086628116.db2.gz XLRDUMNEFRRZAH-QFIPXVFZSA-N 3 0 371.613 4.485 20 0 FIADRP C[C@@H]1C[N@H+](CCCNCc2ccc(-c3ccccc3Cl)o2)CCCO1 ZINC000432361201 1086660346 /nfs/dbraw/zinc/66/03/46/1086660346.db2.gz YPXMKUSDIBVROV-MRXNPFEDSA-N 2 0 362.901 4.191 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001167835581 1086706322 /nfs/dbraw/zinc/70/63/22/1086706322.db2.gz RRRKYDVKVODTSI-OEMFJLHTSA-N 3 0 371.613 4.341 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](Cc1cccc(OC)c1)[C@H](C)COC ZINC001167838064 1086712452 /nfs/dbraw/zinc/71/24/52/1086712452.db2.gz PFQUNHFSYJSECK-RBUKOAKNSA-N 2 0 350.547 4.043 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C ZINC001167840014 1086719806 /nfs/dbraw/zinc/71/98/06/1086719806.db2.gz DGITWYTUBMDYIA-OTWHNJEPSA-N 2 0 369.594 4.265 20 0 FIADRP c1ccc2c(c1)cccc2CCC[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000466912525 1086727976 /nfs/dbraw/zinc/72/79/76/1086727976.db2.gz LSIIAHVVAVEQRF-UHFFFAOYSA-N 2 0 366.549 4.349 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC[C@H]([NH3+])Cc1ccccc1 ZINC000635004960 1086740672 /nfs/dbraw/zinc/74/06/72/1086740672.db2.gz GOZVDCUPRDPJBH-BEFAXECRSA-N 2 0 366.534 4.124 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4)cc3)C2)C1 ZINC000650705404 1086749524 /nfs/dbraw/zinc/74/95/24/1086749524.db2.gz GFJGPMZVMVFFFL-DNVJHFABSA-N 2 0 350.506 4.072 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H](C(=O)OC)C[C@@H]1c1ccccc1 ZINC001167842551 1086753712 /nfs/dbraw/zinc/75/37/12/1086753712.db2.gz YKLNLLKBCZTUGG-CEWLAPEOSA-N 2 0 360.542 4.123 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CCCN2CCCO[C@@H](C)C2)cc1 ZINC000432430010 1086757374 /nfs/dbraw/zinc/75/73/74/1086757374.db2.gz RJRVIGFAGMOSGL-ROUUACIJSA-N 2 0 350.572 4.339 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccccc2F)c2ccccc2)CCCO1 ZINC000432427659 1086757428 /nfs/dbraw/zinc/75/74/28/1086757428.db2.gz DEAAFLUMQFXEHA-WMZHIEFXSA-N 2 0 370.512 4.200 20 0 FIADRP Clc1ccc2c(ccn2CCN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000583528303 1086770382 /nfs/dbraw/zinc/77/03/82/1086770382.db2.gz NVVLAHKOHABPDL-DYESRHJHSA-N 2 0 357.929 4.243 20 0 FIADRP CCC[N@H+](CCCc1ccsc1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000543960056 1086903048 /nfs/dbraw/zinc/90/30/48/1086903048.db2.gz PUJAGYODFRSADL-UHFFFAOYSA-N 2 0 372.582 4.469 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000650745975 1086931799 /nfs/dbraw/zinc/93/17/99/1086931799.db2.gz SMWPWAXWSYAPPE-SFHVURJKSA-N 2 0 359.311 4.257 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278410084 1086951187 /nfs/dbraw/zinc/95/11/87/1086951187.db2.gz HOTBKBUZLPFTRP-AWEZNQCLSA-N 2 0 356.539 4.039 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCC3CC[NH2+]CC3)s2)cc1 ZINC000650763754 1086993443 /nfs/dbraw/zinc/99/34/43/1086993443.db2.gz IWNNHDJDWSTIOZ-CQSZACIVSA-N 2 0 359.539 4.167 20 0 FIADRP c1coc(COCc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2)c1 ZINC000583928702 1087037250 /nfs/dbraw/zinc/03/72/50/1087037250.db2.gz ABPAVJVBVYFEBO-DNVJHFABSA-N 2 0 368.521 4.397 20 0 FIADRP FC(F)Oc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000657813773 1087088016 /nfs/dbraw/zinc/08/80/16/1087088016.db2.gz ZYYGZOPBJQNHJK-UHFFFAOYSA-N 2 0 358.860 4.153 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1cccc(-n2ccnc2)c1 ZINC000151676108 1087203713 /nfs/dbraw/zinc/20/37/13/1087203713.db2.gz ZPDGJPSYSQOGJL-HXUWFJFHSA-N 2 0 374.532 4.230 20 0 FIADRP CCC(CC)[C@@H](CNC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCC1 ZINC000525694204 1087247605 /nfs/dbraw/zinc/24/76/05/1087247605.db2.gz IBKBGYZBXJSQLL-HSZRJFAPSA-N 2 0 357.586 4.141 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2cc1OC ZINC000657839564 1087266334 /nfs/dbraw/zinc/26/63/34/1087266334.db2.gz CEOWKLFVPGAGOZ-CWFSZBLJSA-N 2 0 354.494 4.134 20 0 FIADRP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657839829 1087282521 /nfs/dbraw/zinc/28/25/21/1087282521.db2.gz HKEKBJAXYOKRPX-QRVBRYPASA-N 2 0 365.359 4.233 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cnc(C3CCCCC3)s2)C[C@@H](C)O1 ZINC000084018235 1087345306 /nfs/dbraw/zinc/34/53/06/1087345306.db2.gz JQVQJZPIVNLQHJ-IAGOWNOFSA-N 2 0 365.587 4.170 20 0 FIADRP CCOc1ccc(CNc2ccc(N3CCC(C[NH+](C)C)CC3)cc2)o1 ZINC000892381096 1087383461 /nfs/dbraw/zinc/38/34/61/1087383461.db2.gz RXIVWNXCMDJLPH-UHFFFAOYSA-N 2 0 357.498 4.068 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCc2nc3c(s2)CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000089667536 1087390134 /nfs/dbraw/zinc/39/01/34/1087390134.db2.gz LQDSVNSLCSISAY-IEBWSBKVSA-N 2 0 369.578 4.207 20 0 FIADRP FC(F)(F)Oc1ccccc1CC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000090234874 1087405263 /nfs/dbraw/zinc/40/52/63/1087405263.db2.gz OLRNCMDKPZVFAT-UHFFFAOYSA-N 2 0 356.432 4.124 20 0 FIADRP C[C@@H](NCc1ccccc1C[NH+]1CCCCC1)c1nc2ccccc2n1C ZINC000091267671 1087426492 /nfs/dbraw/zinc/42/64/92/1087426492.db2.gz DCWSNTCZYPSFQI-GOSISDBHSA-N 2 0 362.521 4.410 20 0 FIADRP CC(C)[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091367526 1087428616 /nfs/dbraw/zinc/42/86/16/1087428616.db2.gz CXFIHUAKPXJVKL-IBGZPJMESA-N 2 0 371.491 4.018 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2CCCSCC2)CC1 ZINC000657877040 1087521186 /nfs/dbraw/zinc/52/11/86/1087521186.db2.gz BGHOJWKYOZOKSD-GOSISDBHSA-N 2 0 352.975 4.427 20 0 FIADRP CC[C@@H](C)Oc1cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000685463113 1087575296 /nfs/dbraw/zinc/57/52/96/1087575296.db2.gz GRWNLPSEMQBHSN-XLIONFOSSA-N 2 0 360.542 4.036 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1O ZINC000685649174 1087656600 /nfs/dbraw/zinc/65/66/00/1087656600.db2.gz CCLYFYQHCPYIOO-DDOIHHOZSA-N 2 0 368.521 4.208 20 0 FIADRP COc1cccc(C2(C[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000685655478 1087659863 /nfs/dbraw/zinc/65/98/63/1087659863.db2.gz RBSSEGSCPUNFKV-CTNGQTDRSA-N 2 0 364.533 4.227 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000685662366 1087668126 /nfs/dbraw/zinc/66/81/26/1087668126.db2.gz FSDWPRMQGKBZJU-MBSDFSHPSA-N 2 0 352.522 4.299 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)cc2cc1OC ZINC000657970966 1087682604 /nfs/dbraw/zinc/68/26/04/1087682604.db2.gz GRLAMVFDQMQVEB-INIZCTEOSA-N 2 0 356.510 4.240 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2cc1OC ZINC000658028055 1087699073 /nfs/dbraw/zinc/69/90/73/1087699073.db2.gz GUARFJHDRQQTQB-LRLLJDFBSA-N 2 0 354.494 4.133 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658070841 1087710812 /nfs/dbraw/zinc/71/08/12/1087710812.db2.gz RUWWWDSOFKOGBW-XZOQPEGZSA-N 2 0 356.554 4.352 20 0 FIADRP C[C@@H]([NH2+]CCc1ccnc2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000658128782 1087732545 /nfs/dbraw/zinc/73/25/45/1087732545.db2.gz YOEYHLOZZHNPRC-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658143218 1087734732 /nfs/dbraw/zinc/73/47/32/1087734732.db2.gz XSORSJHFQDGXHX-YLJYHZDGSA-N 2 0 370.562 4.216 20 0 FIADRP Cc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658164483 1087759948 /nfs/dbraw/zinc/75/99/48/1087759948.db2.gz DSEXDFWISXSLRH-FQEVSTJZSA-N 2 0 351.538 4.213 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[N@@H+]3CCCC[C@@H]3C)C[C@H]2C1 ZINC000424260723 1087880785 /nfs/dbraw/zinc/88/07/85/1087880785.db2.gz DLEQASDLDJUYKF-AZCFJWIISA-N 2 0 356.554 4.354 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000424299404 1087904784 /nfs/dbraw/zinc/90/47/84/1087904784.db2.gz JCRPPWDSRJOLEJ-HNNXBMFYSA-N 2 0 359.901 4.311 20 0 FIADRP C[C@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000186615406 1087948780 /nfs/dbraw/zinc/94/87/80/1087948780.db2.gz MSEFDMXGISOIBN-HNNXBMFYSA-N 2 0 374.912 4.066 20 0 FIADRP [NH3+]C[C@H](Cc1ccccc1)[C@@H]1CCCC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000647532553 1087955032 /nfs/dbraw/zinc/95/50/32/1087955032.db2.gz BTSPCNIHRZXCJL-ICSRJNTNSA-N 2 0 355.551 4.193 20 0 FIADRP COc1ccc(F)cc1[C@H](C)[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000163359643 1088092035 /nfs/dbraw/zinc/09/20/35/1088092035.db2.gz ZHANNZMENQDGMS-INIZCTEOSA-N 2 0 371.500 4.220 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414809342 1088191008 /nfs/dbraw/zinc/19/10/08/1088191008.db2.gz MFKDYJVGITWYTH-AWEZNQCLSA-N 2 0 368.912 4.452 20 0 FIADRP COCC[N@H+](C)CCC[NH2+]Cc1ccc(-c2ccc(Cl)cc2)s1 ZINC000518762322 1088242481 /nfs/dbraw/zinc/24/24/81/1088242481.db2.gz PNGNHCOPPVEYKS-UHFFFAOYSA-N 2 0 352.931 4.126 20 0 FIADRP FC(F)(F)c1ccc(-c2nc(C[NH2+]CC[C@H]3CCC[NH2+]C3)cs2)cc1 ZINC000414831743 1088374573 /nfs/dbraw/zinc/37/45/73/1088374573.db2.gz DPDNIHWSBHISMZ-CYBMUJFWSA-N 2 0 369.456 4.308 20 0 FIADRP COc1ccccc1C[C@@H](C)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000311395647 1088619496 /nfs/dbraw/zinc/61/94/96/1088619496.db2.gz OVWADUDAWLKEAT-AUSIDOKSSA-N 2 0 352.522 4.128 20 0 FIADRP COCc1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000514081001 1088717843 /nfs/dbraw/zinc/71/78/43/1088717843.db2.gz ABQHRHNRJKDKKI-UHFFFAOYSA-N 2 0 352.522 4.177 20 0 FIADRP CCOCOc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000782969813 1088771610 /nfs/dbraw/zinc/77/16/10/1088771610.db2.gz XNPOGKFTAGYDJF-UGKGYDQZSA-N 2 0 368.521 4.060 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2cccc(Br)c2Cl)CC1 ZINC001200233228 1088930794 /nfs/dbraw/zinc/93/07/94/1088930794.db2.gz YSMOJPOUTKCUCJ-UHFFFAOYSA-N 2 0 359.739 4.314 20 0 FIADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000434777260 1089030343 /nfs/dbraw/zinc/03/03/43/1089030343.db2.gz PFGXKTYQVMNCIA-AVRDEDQJSA-N 2 0 374.569 4.091 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)C1 ZINC000415029207 1089059713 /nfs/dbraw/zinc/05/97/13/1089059713.db2.gz DOMJLBCFQQEVLV-ZYHUDNBSSA-N 2 0 356.322 4.334 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415049266 1089085793 /nfs/dbraw/zinc/08/57/93/1089085793.db2.gz XROLECQLZPREDO-NFBKMPQASA-N 2 0 374.532 4.124 20 0 FIADRP C[C@@H](CC(=O)Nc1cccc(Cl)c1)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415057612 1089093139 /nfs/dbraw/zinc/09/31/39/1089093139.db2.gz RTWUPNPNYHSRKC-KXBFYZLASA-N 2 0 359.901 4.127 20 0 FIADRP Cc1cccc(NC(=O)C[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c1C ZINC000415055384 1089099581 /nfs/dbraw/zinc/09/95/81/1089099581.db2.gz ORDRDRBNUXOTKQ-DYESRHJHSA-N 2 0 353.510 4.090 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)ccc1Oc1cccnc1 ZINC000415055579 1089101049 /nfs/dbraw/zinc/10/10/49/1089101049.db2.gz RGEATKAOHIKKAO-TZIWHRDSSA-N 2 0 351.494 4.146 20 0 FIADRP c1ccc(COCc2ccccc2C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000415077272 1089125266 /nfs/dbraw/zinc/12/52/66/1089125266.db2.gz HETNQUDPYMGCFU-KMDXXIMOSA-N 2 0 364.533 4.414 20 0 FIADRP c1ccc(COCc2ccccc2C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000415077275 1089125726 /nfs/dbraw/zinc/12/57/26/1089125726.db2.gz HETNQUDPYMGCFU-WXFUMESZSA-N 2 0 364.533 4.414 20 0 FIADRP c1ccc(COCc2ccccc2C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000415077274 1089126872 /nfs/dbraw/zinc/12/68/72/1089126872.db2.gz HETNQUDPYMGCFU-TZRRMPRUSA-N 2 0 364.533 4.414 20 0 FIADRP c1ccc(COCc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)c2)cc1 ZINC000415085979 1089144878 /nfs/dbraw/zinc/14/48/78/1089144878.db2.gz UBOZNGKRWBTMJD-KMDXXIMOSA-N 2 0 364.533 4.414 20 0 FIADRP C[C@H]1C[C@@H](C[NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[NH2+]1 ZINC000415087256 1089147554 /nfs/dbraw/zinc/14/75/54/1089147554.db2.gz KTATWNNAQQQQLQ-GJZGRUSLSA-N 2 0 371.352 4.019 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cn2)c1 ZINC000415107314 1089169217 /nfs/dbraw/zinc/16/92/17/1089169217.db2.gz NQPGKINCARXWDM-VAMGGRTRSA-N 2 0 355.457 4.023 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000415127269 1089180873 /nfs/dbraw/zinc/18/08/73/1089180873.db2.gz QRPVLSLESQHJEI-MBSDFSHPSA-N 2 0 370.537 4.494 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)cc1 ZINC000515176250 1089855231 /nfs/dbraw/zinc/85/52/31/1089855231.db2.gz FTGFLBZOGRACTQ-UHFFFAOYSA-N 2 0 373.216 4.216 20 0 FIADRP O[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccc2ccccc2c1 ZINC000515235176 1089915156 /nfs/dbraw/zinc/91/51/56/1089915156.db2.gz UHQRJXXECNBDRN-XMMPIXPASA-N 2 0 366.549 4.130 20 0 FIADRP CO[C@@H](C[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000549392954 1090017622 /nfs/dbraw/zinc/01/76/22/1090017622.db2.gz FUBBJGNKRPTJHF-JFSTXAPLSA-N 2 0 352.522 4.120 20 0 FIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000584552517 1090085113 /nfs/dbraw/zinc/08/51/13/1090085113.db2.gz GIFGFTSBNFSMCH-FQEVSTJZSA-N 2 0 356.485 4.452 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(Cl)c1 ZINC000188074242 1090160198 /nfs/dbraw/zinc/16/01/98/1090160198.db2.gz XOKQDYSCJSLLSD-KRWDZBQOSA-N 2 0 372.940 4.190 20 0 FIADRP CC[NH+](CC)CCCC1CCN(C(=O)C[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000416207612 1090255006 /nfs/dbraw/zinc/25/50/06/1090255006.db2.gz WKVSPEBSXFKSIW-JOCHJYFZSA-N 2 0 373.585 4.040 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1 ZINC001167735117 1090289631 /nfs/dbraw/zinc/28/96/31/1090289631.db2.gz YUICIRGVVBHUIB-UHFFFAOYSA-N 3 0 374.617 4.171 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000181923261 1090317392 /nfs/dbraw/zinc/31/73/92/1090317392.db2.gz CBSRGFAPHRWDIT-KRWDZBQOSA-N 2 0 351.494 4.092 20 0 FIADRP COc1ccc(C[NH+](C)C)cc1N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582029662 1090318007 /nfs/dbraw/zinc/31/80/07/1090318007.db2.gz GDWWGUANAKGSNB-RXVVDRJESA-N 2 0 367.537 4.079 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Br)cc1 ZINC000537937125 1090402335 /nfs/dbraw/zinc/40/23/35/1090402335.db2.gz XLNLPKZFHRHVPW-OAHLLOKOSA-N 2 0 374.326 4.411 20 0 FIADRP C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185687531 1090565546 /nfs/dbraw/zinc/56/55/46/1090565546.db2.gz QGFIQQJXLFCAHU-TYILLQQXSA-N 2 0 371.352 4.269 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)C[NH2+]C2CCC3(COC(C)(C)C3)CC2)C1 ZINC001648927173 1091151443 /nfs/dbraw/zinc/15/14/43/1091151443.db2.gz LJXYERASWRXUEL-HQHQBECKSA-N 2 0 350.591 4.460 20 0 FIADRP CC[N@H+]1CC=C(c2cnc(NCCC[NH+]3CCCC[C@@H]3C)c(C)c2)CC1 ZINC001167752894 1091165892 /nfs/dbraw/zinc/16/58/92/1091165892.db2.gz ZEHNWPAIYVROPH-IBGZPJMESA-N 2 0 356.558 4.175 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2[nH]cc(CC[NH+]3CCCC3)c2c1 ZINC001167753130 1091176002 /nfs/dbraw/zinc/17/60/02/1091176002.db2.gz KYKHCOIFARVYDH-LJQANCHMSA-N 2 0 368.569 4.483 20 0 FIADRP COc1ccccc1Oc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000192851579 1091208447 /nfs/dbraw/zinc/20/84/47/1091208447.db2.gz JUDLFDVNYJGUNL-YQQQUEKLSA-N 2 0 352.478 4.202 20 0 FIADRP CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(OCC[NH+](C)C)cc2)s1 ZINC000093612375 1091462762 /nfs/dbraw/zinc/46/27/62/1091462762.db2.gz KNSVONRCWHBCMF-INIZCTEOSA-N 2 0 361.555 4.147 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)C2CCC2)cc1 ZINC000187377487 1091878352 /nfs/dbraw/zinc/87/83/52/1091878352.db2.gz REHGVGJTALBYSB-RJGXRXQPSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@H](c1nc2ccccc2o1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512236292 1091945342 /nfs/dbraw/zinc/94/53/42/1091945342.db2.gz GJJOHFLJARPCAI-WZONZLPQSA-N 2 0 361.489 4.487 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512345376 1092091857 /nfs/dbraw/zinc/09/18/57/1092091857.db2.gz GJPRSEWLEJCQHF-FVZZOKADSA-N 2 0 356.554 4.479 20 0 FIADRP COc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)ccc1OCc1cccs1 ZINC000093089139 1092239116 /nfs/dbraw/zinc/23/91/16/1092239116.db2.gz MAYXOFJSAPPQGR-UHFFFAOYSA-N 2 0 374.550 4.109 20 0 FIADRP CCCc1nc(C)c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428236207 1092305837 /nfs/dbraw/zinc/30/58/37/1092305837.db2.gz GOZYFIWTOFWOEB-PXNSSMCTSA-N 2 0 355.526 4.420 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2Br)C1 ZINC000520949770 1092375879 /nfs/dbraw/zinc/37/58/79/1092375879.db2.gz PZVLOTNAJKYSPM-HOTGVXAUSA-N 2 0 353.348 4.297 20 0 FIADRP Cc1ccc(COc2ccc(C[NH2+]CCC3CC[NH+](C)CC3)cc2)cc1 ZINC000520958242 1092382884 /nfs/dbraw/zinc/38/28/84/1092382884.db2.gz PDYVPYBHJSSJBN-UHFFFAOYSA-N 2 0 352.522 4.396 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000521272301 1092615063 /nfs/dbraw/zinc/61/50/63/1092615063.db2.gz XIWRYGOYFZTGEZ-KURKYZTESA-N 2 0 356.432 4.033 20 0 FIADRP COc1c(F)cccc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001143532372 1092683071 /nfs/dbraw/zinc/68/30/71/1092683071.db2.gz FUIIBHCYCVTXND-UHFFFAOYSA-N 2 0 368.496 4.322 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC(C(F)F)CC3)cc2)C[C@@H](C)O1 ZINC000442723084 1092748011 /nfs/dbraw/zinc/74/80/11/1092748011.db2.gz WSWCAUXUTXCJSY-JZFKGDSASA-N 2 0 366.496 4.209 20 0 FIADRP C[C@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000442825130 1092780420 /nfs/dbraw/zinc/78/04/20/1092780420.db2.gz IEHPVXNOPAMFRH-DFQSSKMNSA-N 2 0 359.517 4.135 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)CC2)CC1 ZINC000442815830 1092786182 /nfs/dbraw/zinc/78/61/82/1092786182.db2.gz CWQJVNCLCBAWIA-JLAWEPINSA-N 2 0 351.538 4.268 20 0 FIADRP COCCC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000442865500 1092811740 /nfs/dbraw/zinc/81/17/40/1092811740.db2.gz UCMCIGGDJAAAAT-REWPJTCUSA-N 2 0 370.512 4.405 20 0 FIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2ccccc2)cc1 ZINC000442868477 1092815084 /nfs/dbraw/zinc/81/50/84/1092815084.db2.gz CIZYMWUVTQWTBI-IBGZPJMESA-N 2 0 351.538 4.030 20 0 FIADRP C[C@@H]1C[C@@H](N2C[C@@H](CC[NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014921 1092901545 /nfs/dbraw/zinc/90/15/45/1092901545.db2.gz NHOCLRSBQCZDSY-NPDDRXJXSA-N 2 0 363.549 4.381 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)[N@@H+]2CCC[C@H](CC[NH3+])C2)c1 ZINC000443062313 1092924137 /nfs/dbraw/zinc/92/41/37/1092924137.db2.gz UKORVFGXLCQIMZ-KNQAVFIVSA-N 2 0 365.521 4.044 20 0 FIADRP C[C@@H]1CC([NH2+][C@H]2CC[C@H](C(C)(C)O)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015144 1092956146 /nfs/dbraw/zinc/95/61/46/1092956146.db2.gz PCMHVAUQTFYKGM-VURPSTOHSA-N 2 0 358.570 4.347 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)ccc1OC ZINC000246031432 1092978533 /nfs/dbraw/zinc/97/85/33/1092978533.db2.gz MAMIWUIXBCKVFS-DQMRONCHSA-N 2 0 360.542 4.145 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)C1 ZINC000236932952 1092979913 /nfs/dbraw/zinc/97/99/13/1092979913.db2.gz ZJFMZHLPIMWZOH-HXUWFJFHSA-N 2 0 367.537 4.099 20 0 FIADRP C[C@@H](c1nc(-c2cccc(C[NH+]3CCCC3)c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443212199 1092985972 /nfs/dbraw/zinc/98/59/72/1092985972.db2.gz LVBVCOCTQQFJLW-BBWFWOEESA-N 2 0 354.498 4.266 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccnn1C1CCC1 ZINC000924864924 1093000061 /nfs/dbraw/zinc/00/00/61/1093000061.db2.gz DRMANNLYADFQEZ-INIZCTEOSA-N 2 0 358.555 4.232 20 0 FIADRP c1cn(-c2csc(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)c2)cn1 ZINC000544351860 1093035717 /nfs/dbraw/zinc/03/57/17/1093035717.db2.gz YKOOBYZTAOHWOL-SFHVURJKSA-N 2 0 358.555 4.022 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CCC[N@@H+](C(C)(C)C)CC3)c2cc1OCC ZINC000522123647 1093108381 /nfs/dbraw/zinc/10/83/81/1093108381.db2.gz WOFQGVXDHKYBPT-UHFFFAOYSA-N 2 0 371.525 4.343 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000474053381 1093153593 /nfs/dbraw/zinc/15/35/93/1093153593.db2.gz DLNHPEXIFYAQAU-MJGOQNOKSA-N 2 0 350.497 4.355 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)c1 ZINC000474053070 1093153840 /nfs/dbraw/zinc/15/38/40/1093153840.db2.gz NZOMOBUGMBNGOI-RJGXRXQPSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000474053380 1093153967 /nfs/dbraw/zinc/15/39/67/1093153967.db2.gz DLNHPEXIFYAQAU-IEBWSBKVSA-N 2 0 350.497 4.355 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3[C@@H]3CCOC3)CC2)cc1 ZINC000474055852 1093159884 /nfs/dbraw/zinc/15/98/84/1093159884.db2.gz UAULLWJLDFENQF-XPWALMASSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000248387605 1093248725 /nfs/dbraw/zinc/24/87/25/1093248725.db2.gz PPOQDKODRAACGW-MOPGFXCFSA-N 2 0 367.578 4.020 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC000443602762 1093313024 /nfs/dbraw/zinc/31/30/24/1093313024.db2.gz KPKJNINUQMKENR-FQEVSTJZSA-N 2 0 350.934 4.150 20 0 FIADRP C[C@@](O)(CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000248993155 1093323102 /nfs/dbraw/zinc/32/31/02/1093323102.db2.gz NYTLATQKESBBEC-UEQSERJNSA-N 2 0 364.533 4.069 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(Br)c2)[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918878 1093418089 /nfs/dbraw/zinc/41/80/89/1093418089.db2.gz NDBLIFCENKUOPO-SMTGMISWSA-N 2 0 363.343 4.320 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168025321 1093431752 /nfs/dbraw/zinc/43/17/52/1093431752.db2.gz JJFKGNNSVATDHC-REHUZNOOSA-N 2 0 366.549 4.275 20 0 FIADRP c1ccc(-c2nc3ccccn3c2C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000419287139 1093446481 /nfs/dbraw/zinc/44/64/81/1093446481.db2.gz GPPKCTCKMLNGHD-UHFFFAOYSA-N 2 0 360.505 4.108 20 0 FIADRP Cc1ccc(C2(C[NH2+]C3C[C@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)CC2)nc1 ZINC001168032238 1093652398 /nfs/dbraw/zinc/65/23/98/1093652398.db2.gz GVLNLSZCGAFLHG-PMACEKPBSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@H]1CC([NH2+]C2(Cc3ccc(O)cc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031821 1093656418 /nfs/dbraw/zinc/65/64/18/1093656418.db2.gz CLPBRVIPCLDAES-OALUTQOASA-N 2 0 364.533 4.499 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc4ccccc4n3)CC2)C1 ZINC000513052517 1093697855 /nfs/dbraw/zinc/69/78/55/1093697855.db2.gz RERTWTHWKWBPER-PGRDOPGGSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@@H]1CC([NH2+]C2(CC3CC3)CCOCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033386 1093714487 /nfs/dbraw/zinc/71/44/87/1093714487.db2.gz KZFUCQKWWILEJX-RTBURBONSA-N 2 0 356.554 4.367 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CCCC[C@H](CCC[NH3+])C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168033467 1093720834 /nfs/dbraw/zinc/72/08/34/1093720834.db2.gz LAJZBMGCRQMCDC-ADYITMSISA-N 3 0 357.586 4.269 20 0 FIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2sccc2NC(=O)OC(C)(C)C)CC1 ZINC000895823629 1093733568 /nfs/dbraw/zinc/73/35/68/1093733568.db2.gz SGAKXZCBGLISOF-UHFFFAOYSA-N 2 0 367.559 4.448 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC(F)F)c(OC)c2)CC1 ZINC000052209464 1093767596 /nfs/dbraw/zinc/76/75/96/1093767596.db2.gz YRIASQOHNUVWQB-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000513518779 1094178878 /nfs/dbraw/zinc/17/88/78/1094178878.db2.gz NYOJNHWFMDRHKW-DEOSSOPVSA-N 2 0 374.532 4.390 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cnn(C(C)(C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000513544978 1094205847 /nfs/dbraw/zinc/20/58/47/1094205847.db2.gz NNUDMEJHNGOFQJ-QUCCMNQESA-N 2 0 354.542 4.028 20 0 FIADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000513678615 1094269820 /nfs/dbraw/zinc/26/98/20/1094269820.db2.gz PVOGIMNQNKQHER-YPAWHYETSA-N 2 0 358.570 4.066 20 0 FIADRP CC(C)[N@@H+](C1C[C@H](C)N(Cc2ccccc2)[C@@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168037173 1094346945 /nfs/dbraw/zinc/34/69/45/1094346945.db2.gz XCRDOJRQEMMQHA-LGGPRVQUSA-N 2 0 357.586 4.408 20 0 FIADRP C[N@H+](CCc1c(F)cccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501047207 1094454242 /nfs/dbraw/zinc/45/42/42/1094454242.db2.gz NKOGHOYAHSIYOA-UHFFFAOYSA-N 2 0 361.892 4.265 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)CC1 ZINC000474624854 1094456180 /nfs/dbraw/zinc/45/61/80/1094456180.db2.gz YXQXGEBGAUSBNG-UHFFFAOYSA-N 2 0 360.542 4.128 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](N[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001168039914 1094480485 /nfs/dbraw/zinc/48/04/85/1094480485.db2.gz IRQKWXRKYSKLLI-DKQPQCJKSA-N 2 0 357.586 4.136 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCC(=O)N2 ZINC000329166947 1094762597 /nfs/dbraw/zinc/76/25/97/1094762597.db2.gz IHSGMDGHXSCEBL-IPJUCJBFSA-N 2 0 371.525 4.361 20 0 FIADRP c1ccc(C[N@@H+](CCc2ccc3ccccc3c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000420320217 1094881272 /nfs/dbraw/zinc/88/12/72/1094881272.db2.gz YOTNIIQWXRBPCX-XMMPIXPASA-N 2 0 359.517 4.422 20 0 FIADRP Cc1nc([C@H](C)[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)oc1-c1ccc(Cl)cc1 ZINC000420331685 1094892015 /nfs/dbraw/zinc/89/20/15/1094892015.db2.gz IUDHKAYHUROWIZ-BHYGNILZSA-N 2 0 359.901 4.296 20 0 FIADRP Cc1c(Cl)cccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501779441 1094922516 /nfs/dbraw/zinc/92/25/16/1094922516.db2.gz WWUZVWCJBIBZED-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501784465 1094923277 /nfs/dbraw/zinc/92/32/77/1094923277.db2.gz GNSDUEODKKEAAA-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000522551464 1095135764 /nfs/dbraw/zinc/13/57/64/1095135764.db2.gz JMFPAPRULWVHFO-UGKGYDQZSA-N 2 0 357.586 4.147 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000502274523 1095293669 /nfs/dbraw/zinc/29/36/69/1095293669.db2.gz NQCWDVIZCHCPTP-QFIPXVFZSA-N 2 0 368.521 4.351 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)C1 ZINC000502278021 1095295442 /nfs/dbraw/zinc/29/54/42/1095295442.db2.gz SSTOXVIQWUTIBB-KNQAVFIVSA-N 2 0 356.554 4.357 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(CNCc2cnc(C(F)(F)F)s2)c1 ZINC000443976337 1095446540 /nfs/dbraw/zinc/44/65/40/1095446540.db2.gz DAOVQAURXMVCFB-UHFFFAOYSA-N 2 0 357.445 4.292 20 0 FIADRP C[C@H](c1ncc(C(C)(C)C)o1)N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000281952747 1095776675 /nfs/dbraw/zinc/77/66/75/1095776675.db2.gz FRFGAJNLIKLSGC-HZPDHXFCSA-N 2 0 356.514 4.446 20 0 FIADRP COC(=O)c1csc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000513760501 1095933589 /nfs/dbraw/zinc/93/35/89/1095933589.db2.gz JWQHZTSSRHXZFQ-INIZCTEOSA-N 2 0 372.534 4.371 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000421821927 1095934672 /nfs/dbraw/zinc/93/46/72/1095934672.db2.gz UWBSEUYNZDURJM-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccncc1Cl ZINC000421822764 1095935935 /nfs/dbraw/zinc/93/59/35/1095935935.db2.gz BHZVHKIHPZNHDT-BRWVUGGUSA-N 2 0 373.928 4.195 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000421887379 1095976595 /nfs/dbraw/zinc/97/65/95/1095976595.db2.gz VVJHUOPUUPREFC-TVPLGVNVSA-N 2 0 365.359 4.233 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]C[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000272649893 1096198298 /nfs/dbraw/zinc/19/82/98/1096198298.db2.gz DTHQXIIFGANLSO-IEBWSBKVSA-N 2 0 370.459 4.161 20 0 FIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422701436 1096456539 /nfs/dbraw/zinc/45/65/39/1096456539.db2.gz BYFITYQVRNNIKV-OCVOVZGFSA-N 2 0 354.469 4.338 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422710859 1096460032 /nfs/dbraw/zinc/46/00/32/1096460032.db2.gz GGPSXIGDVIRGDC-XUZZJYLKSA-N 2 0 374.532 4.206 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422732367 1096465728 /nfs/dbraw/zinc/46/57/28/1096465728.db2.gz PTEPOLOLCITCRB-MOPGFXCFSA-N 2 0 370.368 4.207 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422735375 1096467796 /nfs/dbraw/zinc/46/77/96/1096467796.db2.gz UPBVDRAGUMNLTP-BEFAXECRSA-N 2 0 370.368 4.065 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422735379 1096467971 /nfs/dbraw/zinc/46/79/71/1096467971.db2.gz UPBVDRAGUMNLTP-HNAYVOBHSA-N 2 0 370.368 4.065 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC1CCCC1 ZINC000422719556 1096470549 /nfs/dbraw/zinc/47/05/49/1096470549.db2.gz YSCIZDAEQISROZ-HNNXBMFYSA-N 2 0 369.509 4.030 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422801662 1096495261 /nfs/dbraw/zinc/49/52/61/1096495261.db2.gz CIENTPLWLHIEPC-ZQGJOIPISA-N 2 0 356.554 4.363 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1OC(F)F ZINC000422809901 1096497477 /nfs/dbraw/zinc/49/74/77/1096497477.db2.gz SQWVPFXEQCKPCU-OXTHUFEASA-N 2 0 374.431 4.195 20 0 FIADRP COc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)s2)cc1 ZINC000422822647 1096499719 /nfs/dbraw/zinc/49/97/19/1096499719.db2.gz KJXHMQSFJMZFBI-AWEZNQCLSA-N 2 0 367.518 4.437 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000422846602 1096504935 /nfs/dbraw/zinc/50/49/35/1096504935.db2.gz FSTRLAYYZLRWQO-JHDROBOHSA-N 2 0 368.443 4.201 20 0 FIADRP Cc1ccccc1Oc1ccccc1C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000422860771 1096507261 /nfs/dbraw/zinc/50/72/61/1096507261.db2.gz MYQWPZBRWLYVOC-PWRODBHTSA-N 2 0 366.505 4.034 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422892305 1096516543 /nfs/dbraw/zinc/51/65/43/1096516543.db2.gz MPZQDXJVZYRABA-CABCVRRESA-N 2 0 357.498 4.058 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422897361 1096518061 /nfs/dbraw/zinc/51/80/61/1096518061.db2.gz ZSRZYBZCWNYCRJ-HYVJGQCMSA-N 2 0 366.505 4.380 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000422875521 1096518191 /nfs/dbraw/zinc/51/81/91/1096518191.db2.gz PAIUDNNLWYYYOG-ACJLOTCBSA-N 2 0 365.290 4.395 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000422936988 1096530127 /nfs/dbraw/zinc/53/01/27/1096530127.db2.gz IYFWFJOZVNGVLU-LBPRGKRZSA-N 2 0 350.293 4.495 20 0 FIADRP c1sc2ccccc2c1CC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422938450 1096530235 /nfs/dbraw/zinc/53/02/35/1096530235.db2.gz POXNKGCIXNLWSC-KNQAVFIVSA-N 2 0 364.514 4.289 20 0 FIADRP Clc1ccc(C2([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422937591 1096530515 /nfs/dbraw/zinc/53/05/15/1096530515.db2.gz OIRZQUGDXAUATJ-UYAOXDASSA-N 2 0 354.881 4.175 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1C[NH3+])C1CCCCC1 ZINC000414705577 1096531802 /nfs/dbraw/zinc/53/18/02/1096531802.db2.gz FMYAAWYPQQDCNF-YLJYHZDGSA-N 2 0 372.557 4.090 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1 ZINC000423023959 1096553696 /nfs/dbraw/zinc/55/36/96/1096553696.db2.gz KXQCIUBCTZUJBQ-JCKWVBRZSA-N 2 0 371.352 4.147 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCOCc1ccc(Cl)cc1Cl ZINC000423025355 1096554299 /nfs/dbraw/zinc/55/42/99/1096554299.db2.gz LLDICOAHAOKZDL-GFCCVEGCSA-N 2 0 368.308 4.023 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)ccn1 ZINC000423082029 1096567573 /nfs/dbraw/zinc/56/75/73/1096567573.db2.gz DSKPGLBXGZETAD-BHIYHBOVSA-N 2 0 355.457 4.023 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089882 1096571330 /nfs/dbraw/zinc/57/13/30/1096571330.db2.gz WETDCLKTZGYCIL-TUNNFDKTSA-N 2 0 352.453 4.049 20 0 FIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423093513 1096572368 /nfs/dbraw/zinc/57/23/68/1096572368.db2.gz HVBFISRCWSRWPA-GPFWEFOESA-N 2 0 352.444 4.462 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423099521 1096573765 /nfs/dbraw/zinc/57/37/65/1096573765.db2.gz FIUGPTGSVZWQTG-LBPRGKRZSA-N 2 0 372.925 4.476 20 0 FIADRP Clc1cc2c(s1)CC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423120331 1096577584 /nfs/dbraw/zinc/57/75/84/1096577584.db2.gz GBUXIFYVJMQHQA-YZVOILCLSA-N 2 0 360.910 4.234 20 0 FIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC000423123979 1096580265 /nfs/dbraw/zinc/58/02/65/1096580265.db2.gz NUAZONLUVXHSEW-INDMIFKZSA-N 2 0 354.460 4.308 20 0 FIADRP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423104019 1096582668 /nfs/dbraw/zinc/58/26/68/1096582668.db2.gz PMUDPNVXMUEXIA-YESZJQIVSA-N 2 0 364.942 4.110 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423113087 1096585608 /nfs/dbraw/zinc/58/56/08/1096585608.db2.gz YIVXSSRVGYSJLT-QKKBWIMNSA-N 2 0 373.928 4.321 20 0 FIADRP Fc1cc(F)c2c(c1)[C@@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146242 1096586903 /nfs/dbraw/zinc/58/69/03/1096586903.db2.gz OVMVWBVCASAQOH-ONTIZHBOSA-N 2 0 370.443 4.188 20 0 FIADRP C[C@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@@H]1C[NH3+] ZINC000414719002 1096589019 /nfs/dbraw/zinc/58/90/19/1096589019.db2.gz XENLKYXWYFLUOU-LAUBAEHRSA-N 2 0 372.557 4.042 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000503950473 1096602019 /nfs/dbraw/zinc/60/20/19/1096602019.db2.gz UHFIVSARMDGUJI-LASHMREHSA-N 2 0 364.480 4.037 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)NCC2([NH3+])CCCCCC2)cc1 ZINC000423202814 1096615124 /nfs/dbraw/zinc/61/51/24/1096615124.db2.gz RFIKJBPPSDAEGX-OAQYLSRUSA-N 2 0 353.510 4.015 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423253845 1096631603 /nfs/dbraw/zinc/63/16/03/1096631603.db2.gz WNDYBFCSRFFDCR-QWRGUYRKSA-N 2 0 365.237 4.118 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000423290427 1096635746 /nfs/dbraw/zinc/63/57/46/1096635746.db2.gz CXGJZLNMUPOLDH-VOJFVSQTSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000423291465 1096635907 /nfs/dbraw/zinc/63/59/07/1096635907.db2.gz IJMKEVKONNHEMH-PIGZYNQJSA-N 2 0 363.274 4.385 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cnn1-c1ccc(F)cc1 ZINC000423290909 1096636067 /nfs/dbraw/zinc/63/60/67/1096636067.db2.gz FWUIXTDDFFDNML-HUUCEWRRSA-N 2 0 352.457 4.190 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423292663 1096636294 /nfs/dbraw/zinc/63/62/94/1096636294.db2.gz NURYCSMUUFAIJF-DLBZAZTESA-N 2 0 368.525 4.431 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423297290 1096644341 /nfs/dbraw/zinc/64/43/41/1096644341.db2.gz JQRCOFLPIRCRBF-GHMZBOCLSA-N 2 0 368.344 4.126 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296172 1096644803 /nfs/dbraw/zinc/64/48/03/1096644803.db2.gz YNWNWOZDHINKDT-HOTGVXAUSA-N 2 0 354.498 4.087 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000423344878 1096646864 /nfs/dbraw/zinc/64/68/64/1096646864.db2.gz XDVDZCDARIVEIS-DLBZAZTESA-N 2 0 351.494 4.333 20 0 FIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000504082083 1096658237 /nfs/dbraw/zinc/65/82/37/1096658237.db2.gz WBNPEMIMVLPREF-RTBURBONSA-N 2 0 354.542 4.233 20 0 FIADRP Brc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423383074 1096661474 /nfs/dbraw/zinc/66/14/74/1096661474.db2.gz KJHDNKHUUGGXJW-IBGZPJMESA-N 2 0 357.295 4.220 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1F ZINC000423386027 1096662912 /nfs/dbraw/zinc/66/29/12/1096662912.db2.gz LSRDQJRMTXYYDA-FPOVZHCZSA-N 2 0 354.469 4.254 20 0 FIADRP CCC[C@@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1cccc(C(F)(F)F)c1 ZINC000423397874 1096666087 /nfs/dbraw/zinc/66/60/87/1096666087.db2.gz CIVFSJIEVJQKOE-QGZVFWFLSA-N 2 0 358.448 4.152 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[NH2+]C[C@H]2C)nc1 ZINC000423406259 1096673604 /nfs/dbraw/zinc/67/36/04/1096673604.db2.gz UMYLPTRRAHIGLJ-XGRCMKMKSA-N 2 0 371.956 4.039 20 0 FIADRP COCC1(C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC[NH2+]CC1 ZINC000423413345 1096675102 /nfs/dbraw/zinc/67/51/02/1096675102.db2.gz YXRVWZAOVWQGBK-QGZVFWFLSA-N 2 0 358.448 4.008 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000423429778 1096683076 /nfs/dbraw/zinc/68/30/76/1096683076.db2.gz KOUVXEAOOWBLRV-SJKOYZFVSA-N 2 0 369.278 4.378 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423434958 1096685563 /nfs/dbraw/zinc/68/55/63/1096685563.db2.gz KVWNMLAIJXLQQQ-MDASCCDHSA-N 2 0 355.551 4.466 20 0 FIADRP FC(F)(F)c1ccc([C@H]2CC[C@@H]([NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC000423438112 1096687243 /nfs/dbraw/zinc/68/72/43/1096687243.db2.gz MPOZMJLJMPHJHJ-WZGPROSRSA-N 2 0 352.444 4.319 20 0 FIADRP CC[C@@H]([NH3+])CN[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423463670 1096690591 /nfs/dbraw/zinc/69/05/91/1096690591.db2.gz LMLJZNCQXZXBPE-IINYFYTJSA-N 2 0 368.344 4.269 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000423470577 1096692968 /nfs/dbraw/zinc/69/29/68/1096692968.db2.gz LKTSIEPUDFUPOL-FJPWCDISSA-N 2 0 352.497 4.301 20 0 FIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423471311 1096694674 /nfs/dbraw/zinc/69/46/74/1096694674.db2.gz FAQOMAMDXURKLH-RYUDHWBXSA-N 2 0 364.383 4.072 20 0 FIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1nc2ccc(Cl)cc2n1C ZINC000423507199 1096702044 /nfs/dbraw/zinc/70/20/44/1096702044.db2.gz PTNGTMKXFZIBOY-YOEHRIQHSA-N 2 0 356.901 4.358 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423483487 1096702977 /nfs/dbraw/zinc/70/29/77/1096702977.db2.gz QBNQWTBEYMSBDU-PBHICJAKSA-N 2 0 355.295 4.161 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423535610 1096711170 /nfs/dbraw/zinc/71/11/70/1096711170.db2.gz DOVDNUFDQDUGRN-GOSISDBHSA-N 2 0 353.535 4.395 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423536472 1096715479 /nfs/dbraw/zinc/71/54/79/1096715479.db2.gz AIDUUHCDPPXTBB-YAMOITTJSA-N 2 0 369.734 4.068 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423541364 1096716613 /nfs/dbraw/zinc/71/66/13/1096716613.db2.gz KRFHSQUIUBWGHC-ARLBYUKCSA-N 2 0 358.473 4.380 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)C2CCC2)o1 ZINC000423580200 1096725974 /nfs/dbraw/zinc/72/59/74/1096725974.db2.gz XIPWQGMQVBFQCP-QFIPXVFZSA-N 2 0 367.537 4.012 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CCOC4(CCCC4)C2)C3)cc1 ZINC000245743297 1098707593 /nfs/dbraw/zinc/70/75/93/1098707593.db2.gz RYRZWWPQBCZTIA-YUMYIRISSA-N 2 0 354.538 4.263 20 0 FIADRP Oc1ccc2ccncc2c1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000054488021 1098735109 /nfs/dbraw/zinc/73/51/09/1098735109.db2.gz BCHTURVPCBWXSM-UHFFFAOYSA-N 2 0 353.510 4.028 20 0 FIADRP FC(F)(F)Oc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533075799 1098741979 /nfs/dbraw/zinc/74/19/79/1098741979.db2.gz PMTGKRHOBWOHTA-CRAIPNDOSA-N 2 0 354.416 4.034 20 0 FIADRP FC(F)(F)COc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000533075671 1098742839 /nfs/dbraw/zinc/74/28/39/1098742839.db2.gz WZNJINPVDNNXRH-APWZRJJASA-N 2 0 368.443 4.076 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(OC)c(OC)c1C ZINC000515710381 1098855097 /nfs/dbraw/zinc/85/50/97/1098855097.db2.gz IQELXSYJRXKXBP-UHFFFAOYSA-N 2 0 356.510 4.096 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cs1 ZINC000436279637 1098882537 /nfs/dbraw/zinc/88/25/37/1098882537.db2.gz ISUQUZGTGOXKOG-UHFFFAOYSA-N 2 0 352.507 4.024 20 0 FIADRP CSc1ccc(CC[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000436289739 1098904026 /nfs/dbraw/zinc/90/40/26/1098904026.db2.gz HDUBOXHUSYKIIA-KRWDZBQOSA-N 2 0 358.551 4.242 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000436469468 1099044761 /nfs/dbraw/zinc/04/47/61/1099044761.db2.gz BPUJJLZFASDBAC-GOSISDBHSA-N 2 0 358.489 4.463 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccccc1N1CC[NH+](C)CC1 ZINC001211993718 1099143273 /nfs/dbraw/zinc/14/32/73/1099143273.db2.gz BZPCNIXMSDDLIJ-UHFFFAOYSA-N 2 0 352.526 4.024 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001211993719 1099144038 /nfs/dbraw/zinc/14/40/38/1099144038.db2.gz CBRNBQFVTSREPD-UHFFFAOYSA-N 2 0 352.526 4.024 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cncc(Br)c1 ZINC000578084185 1099305890 /nfs/dbraw/zinc/30/58/90/1099305890.db2.gz RWAJOSHBODEEOV-HUUCEWRRSA-N 2 0 354.336 4.149 20 0 FIADRP CC(C)N(C)c1ccccc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437075830 1099580197 /nfs/dbraw/zinc/58/01/97/1099580197.db2.gz MOIDASDFOGTJKC-IBGZPJMESA-N 2 0 369.553 4.322 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(OC(F)(F)F)c1 ZINC000123722744 1099602710 /nfs/dbraw/zinc/60/27/10/1099602710.db2.gz PFYGOFMQLKFVIV-AWEZNQCLSA-N 2 0 352.400 4.498 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000261991597 1099685405 /nfs/dbraw/zinc/68/54/05/1099685405.db2.gz MGPISANDYJGEDO-UHFFFAOYSA-N 2 0 373.928 4.136 20 0 FIADRP C[C@@H]1c2cccn2CC[NH+]1CCCCCC[N@@H+]1CCn2cccc2[C@H]1C ZINC000729815062 1099697633 /nfs/dbraw/zinc/69/76/33/1099697633.db2.gz NAWFDWDRBUZKDE-WOJBJXKFSA-N 2 0 354.542 4.303 20 0 FIADRP Fc1ccc(C2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CCCC2)cc1 ZINC000459390707 1099710224 /nfs/dbraw/zinc/71/02/24/1099710224.db2.gz NMYJHLIYKSLBFX-UHFFFAOYSA-N 2 0 353.485 4.291 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1Cl ZINC000076761478 1099815313 /nfs/dbraw/zinc/81/53/13/1099815313.db2.gz DGOBLDRZFBKYSS-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)ccc1SC ZINC000162516865 1099824686 /nfs/dbraw/zinc/82/46/86/1099824686.db2.gz VQFXBDLSUDMTPN-INIZCTEOSA-N 2 0 374.550 4.208 20 0 FIADRP CC[C@@]1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)OCCc2ccccc21 ZINC000516818775 1099827624 /nfs/dbraw/zinc/82/76/24/1099827624.db2.gz AAULWICWLQYNNS-QHCPKHFHSA-N 2 0 356.554 4.251 20 0 FIADRP CCOCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508703565 1099857880 /nfs/dbraw/zinc/85/78/80/1099857880.db2.gz YWTAGFDSYRTLEB-IFMALSPDSA-N 2 0 358.570 4.474 20 0 FIADRP Cc1ccc([C@H](CN[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000508709536 1099877313 /nfs/dbraw/zinc/87/73/13/1099877313.db2.gz HSMJTJIAJZXKGI-OYDLWJJNSA-N 2 0 365.565 4.098 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000162576652 1099885374 /nfs/dbraw/zinc/88/53/74/1099885374.db2.gz YRQDOISNLLZIHK-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713919 1099885954 /nfs/dbraw/zinc/88/59/54/1099885954.db2.gz GOOBVPBIKZZVJD-VJBMBRPKSA-N 2 0 352.522 4.000 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000162574540 1099903864 /nfs/dbraw/zinc/90/38/64/1099903864.db2.gz DGNGLYVIGALFOF-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP C[C@@H](NC1CC[NH+](CC2CCCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508716218 1099913379 /nfs/dbraw/zinc/91/33/79/1099913379.db2.gz KIZRRCNBGQWJAJ-OFNKIYASSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@@H]([NH2+]CCCN(C)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721442 1099937773 /nfs/dbraw/zinc/93/77/73/1099937773.db2.gz USOMYRFZJVVIBK-IRLDBZIGSA-N 2 0 351.538 4.013 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccc(Cl)c1 ZINC000414905865 1099938482 /nfs/dbraw/zinc/93/84/82/1099938482.db2.gz OOXKFHINRDHQQR-UHFFFAOYSA-N 2 0 354.885 4.021 20 0 FIADRP CO[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000508721162 1099939578 /nfs/dbraw/zinc/93/95/78/1099939578.db2.gz UANVVRIKQWTLBG-NQSCKRDGSA-N 2 0 356.485 4.013 20 0 FIADRP CCOc1cc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)ccc1O ZINC000459436067 1100147407 /nfs/dbraw/zinc/14/74/07/1100147407.db2.gz WQHNJRHLCZQWGI-UHFFFAOYSA-N 2 0 368.521 4.313 20 0 FIADRP CC[N@H+](Cc1occc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000536672839 1100158863 /nfs/dbraw/zinc/15/88/63/1100158863.db2.gz SOMTZOKGHHMJLF-UHFFFAOYSA-N 2 0 356.514 4.301 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2cn(C3CCCC3)nc2-c2ccccn2)C1 ZINC000459427041 1100164404 /nfs/dbraw/zinc/16/44/04/1100164404.db2.gz OBLHRMUEBMNHRW-ICSRJNTNSA-N 2 0 367.541 4.023 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CCCC2)c1 ZINC000459431448 1100168640 /nfs/dbraw/zinc/16/86/40/1100168640.db2.gz RDWZFMGQRFXSGY-UHFFFAOYSA-N 2 0 365.521 4.161 20 0 FIADRP c1ccc2c(c1)CCC[C@@H]2OCCC[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459450588 1100187683 /nfs/dbraw/zinc/18/76/83/1100187683.db2.gz WEGIFWGMEFSWMM-QHCPKHFHSA-N 2 0 365.521 4.124 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000459452689 1100190366 /nfs/dbraw/zinc/19/03/66/1100190366.db2.gz WJTYIUOYGRVQLJ-CQSZACIVSA-N 2 0 365.399 4.300 20 0 FIADRP Cc1ccc(C[NH+](C)CCC(C)CC[N@H+](C)Cc2ccc(C)cn2)nc1 ZINC000664656859 1100206578 /nfs/dbraw/zinc/20/65/78/1100206578.db2.gz JVYQBPATLZVHHD-UHFFFAOYSA-N 2 0 354.542 4.074 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000379638039 1100236078 /nfs/dbraw/zinc/23/60/78/1100236078.db2.gz UEIVSIXSTBVIER-QFBILLFUSA-N 2 0 358.913 4.491 20 0 FIADRP C[C@H](C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1)C[NH+]1CCCC1 ZINC000425913809 1100240073 /nfs/dbraw/zinc/24/00/73/1100240073.db2.gz GFTQQPWQDUOWGO-DYESRHJHSA-N 2 0 357.929 4.340 20 0 FIADRP Cc1noc(C[N@@H+]2CCCCC[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000459517742 1100255802 /nfs/dbraw/zinc/25/58/02/1100255802.db2.gz FWZPPSALFOUYMV-OAQYLSRUSA-N 2 0 368.525 4.035 20 0 FIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCCC[N@H+]3C[C@@H]3CCOC3)CC2)cc1 ZINC000459517867 1100256589 /nfs/dbraw/zinc/25/65/89/1100256589.db2.gz GDGSFNVTLKZODY-GMAHTHKFSA-N 2 0 356.554 4.180 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)C2 ZINC000425932380 1100307777 /nfs/dbraw/zinc/30/77/77/1100307777.db2.gz PXEKFVXYPQHCOK-IBGZPJMESA-N 2 0 370.562 4.116 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc(F)c1 ZINC000536808269 1100323879 /nfs/dbraw/zinc/32/38/79/1100323879.db2.gz ZBSXCVBALUEJKJ-IBGZPJMESA-N 2 0 355.501 4.079 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@H]4CC[N@H+](C)[C@H](C)C4)cc3)ccc2O1 ZINC000536842173 1100354501 /nfs/dbraw/zinc/35/45/01/1100354501.db2.gz WLQHAHIDKNDPLD-YVHKJVDXSA-N 2 0 350.506 4.249 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000536858613 1100375304 /nfs/dbraw/zinc/37/53/04/1100375304.db2.gz QZTWFYIBZIMBPR-KURKYZTESA-N 2 0 350.572 4.339 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000536860368 1100376597 /nfs/dbraw/zinc/37/65/97/1100376597.db2.gz YZWLFHBEWJDTLU-FCEWJHQRSA-N 2 0 370.484 4.218 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCSc3ccc(Cl)cc32)C[C@@H](C)O1 ZINC000536861957 1100379369 /nfs/dbraw/zinc/37/93/69/1100379369.db2.gz IKPHQBXLUAJAPT-RKVPGOIHSA-N 2 0 368.974 4.356 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000536876139 1100397396 /nfs/dbraw/zinc/39/73/96/1100397396.db2.gz LGUGFNDEQPRUMF-XXBNENTESA-N 2 0 352.522 4.128 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000438058006 1100401446 /nfs/dbraw/zinc/40/14/46/1100401446.db2.gz LEKUOXGMPFTXLO-QGZVFWFLSA-N 2 0 356.432 4.078 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000536878955 1100404821 /nfs/dbraw/zinc/40/48/21/1100404821.db2.gz WSYVLDZDAZSGPA-IBGZPJMESA-N 2 0 357.567 4.310 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)[C@H](C)C1 ZINC000438189454 1100501217 /nfs/dbraw/zinc/50/12/17/1100501217.db2.gz KPGMLAPJYHKYJU-XBYSBRQOSA-N 2 0 358.570 4.223 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC000426022151 1100677159 /nfs/dbraw/zinc/67/71/59/1100677159.db2.gz NGBUQOWFMIPSDA-BWAGFHJFSA-N 2 0 364.533 4.053 20 0 FIADRP Cc1nccn1C[C@H](C)C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426025595 1100685832 /nfs/dbraw/zinc/68/58/32/1100685832.db2.gz XIHHRLGZCXAWTB-IIBYNOLFSA-N 2 0 368.912 4.450 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426035770 1100694813 /nfs/dbraw/zinc/69/48/13/1100694813.db2.gz KOVVVBCVJJOWFP-OAQYLSRUSA-N 2 0 357.929 4.340 20 0 FIADRP CCC1(C[NH2+]C2CCC(C(=O)OC)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000426038776 1100705324 /nfs/dbraw/zinc/70/53/24/1100705324.db2.gz ZMLBRMOHJMNLSR-UHFFFAOYSA-N 2 0 372.553 4.000 20 0 FIADRP CC(C)[C@H]1OCCC[C@@H]1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438829252 1100948759 /nfs/dbraw/zinc/94/87/59/1100948759.db2.gz ZJZTVZWMSMDEQF-WYZYGFAWSA-N 2 0 358.570 4.470 20 0 FIADRP CC(C)[C@H]1OCCC[C@H]1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438829250 1100949128 /nfs/dbraw/zinc/94/91/28/1100949128.db2.gz ZJZTVZWMSMDEQF-SCZRWQTQSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCN(c3ccccc3F)C2)CC1 ZINC000426296589 1101220644 /nfs/dbraw/zinc/22/06/44/1101220644.db2.gz STLSMRQRZXVAFB-LMNJBCLMSA-N 2 0 359.533 4.037 20 0 FIADRP Brc1ccccc1C1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000426325184 1101259759 /nfs/dbraw/zinc/25/97/59/1101259759.db2.gz UMODVYFKWBLHCM-CVEARBPZSA-N 2 0 363.343 4.087 20 0 FIADRP [NH3+]C[C@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)C1 ZINC000261985116 1101279556 /nfs/dbraw/zinc/27/95/56/1101279556.db2.gz RVHILMDHJJQAPF-QGZVFWFLSA-N 2 0 372.472 4.066 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000536999857 1101385877 /nfs/dbraw/zinc/38/58/77/1101385877.db2.gz DBRAPKFBJVPEMN-GOSISDBHSA-N 2 0 351.332 4.222 20 0 FIADRP CCc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)C(C)C)cc1 ZINC000537014157 1101395453 /nfs/dbraw/zinc/39/54/53/1101395453.db2.gz DGNCTQYVACPODD-YTFSRNRJSA-N 2 0 358.570 4.304 20 0 FIADRP c1ccc(COc2cccc(CC[NH2+]C3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC000537093890 1101461002 /nfs/dbraw/zinc/46/10/02/1101461002.db2.gz GBCIGHBLNZHTRC-UHFFFAOYSA-N 2 0 364.533 4.272 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCc3cc(F)ccc31)c1ccccc1O2 ZINC000537190026 1101542147 /nfs/dbraw/zinc/54/21/47/1101542147.db2.gz OFRYIDNGDILHQC-SFTDATJTSA-N 2 0 366.480 4.391 20 0 FIADRP C[N@H+](CC1CC1)C[C@H]1CCN(Cc2c(Cl)cccc2N2CCCC2)C1 ZINC000537203395 1101557432 /nfs/dbraw/zinc/55/74/32/1101557432.db2.gz ZTXDACVAZIXEOF-GOSISDBHSA-N 2 0 361.961 4.104 20 0 FIADRP C[C@@H](C[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CC[NH+](C)CC1 ZINC000537295440 1101617399 /nfs/dbraw/zinc/61/73/99/1101617399.db2.gz LJPGBIQXTHZDCL-FXAWDEMLSA-N 2 0 365.993 4.290 20 0 FIADRP CN(c1ccccc1C[N@H+](C)[C@@H]1CCc2ccccc21)C1CC[NH+](C)CC1 ZINC000506652515 1101685677 /nfs/dbraw/zinc/68/56/77/1101685677.db2.gz GIPUHDGKMZIBDU-XMMPIXPASA-N 2 0 363.549 4.336 20 0 FIADRP COc1ccccc1CC1([NH3+])CC[NH+]([C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168168766 1101831813 /nfs/dbraw/zinc/83/18/13/1101831813.db2.gz VJCIWJPNOQJPER-KRWDZBQOSA-N 2 0 372.940 4.316 20 0 FIADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000643462261 1101927670 /nfs/dbraw/zinc/92/76/70/1101927670.db2.gz SEZGQPXOFQXOSE-ICSRJNTNSA-N 2 0 353.510 4.061 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000415011777 1102250201 /nfs/dbraw/zinc/25/02/01/1102250201.db2.gz IGVLHQCRXLDPAC-LJQANCHMSA-N 2 0 362.521 4.206 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Br)cc1F)c1ccccc1 ZINC000415050593 1102262319 /nfs/dbraw/zinc/26/23/19/1102262319.db2.gz ISIPIXXZYQVUHL-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415053694 1102269276 /nfs/dbraw/zinc/26/92/76/1102269276.db2.gz MRCRSJWIXCXUKY-QFIPXVFZSA-N 2 0 361.489 4.327 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C2CCC2)cc1 ZINC000187536666 1102276897 /nfs/dbraw/zinc/27/68/97/1102276897.db2.gz GVKGZISPZPPPQK-BJKOFHAPSA-N 2 0 364.533 4.193 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(=O)OC)cc1 ZINC000550782926 1102281856 /nfs/dbraw/zinc/28/18/56/1102281856.db2.gz BSDWOKIBEAJXAY-BSIFCXSSSA-N 2 0 358.526 4.167 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CCCS2 ZINC000187706244 1102302202 /nfs/dbraw/zinc/30/22/02/1102302202.db2.gz UNPOEVGASAGOFD-HXUWFJFHSA-N 2 0 356.535 4.474 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c(C)n1 ZINC000121046591 1102313492 /nfs/dbraw/zinc/31/34/92/1102313492.db2.gz WGMVSOHLCJWVAK-KRWDZBQOSA-N 2 0 352.526 4.176 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c(C)n1 ZINC000121642966 1102430056 /nfs/dbraw/zinc/43/00/56/1102430056.db2.gz FGDQGBDPVKAFTN-QGZVFWFLSA-N 2 0 352.526 4.320 20 0 FIADRP c1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCOCC2)cc1 ZINC001167974876 1102579471 /nfs/dbraw/zinc/57/94/71/1102579471.db2.gz CWAKYFCKQGEYTJ-NOTZXAQLSA-N 2 0 368.565 4.021 20 0 FIADRP COCC1(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000550861102 1102645249 /nfs/dbraw/zinc/64/52/49/1102645249.db2.gz WETNHCIGGUAJLC-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168252204 1102651791 /nfs/dbraw/zinc/65/17/91/1102651791.db2.gz OBMNHEZHULYOMR-ACRUOGEOSA-N 2 0 368.496 4.074 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)ccn1 ZINC000550886296 1102658729 /nfs/dbraw/zinc/65/87/29/1102658729.db2.gz GUSWWWNTEQTLHE-MSOLQXFVSA-N 2 0 353.510 4.173 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257505 1102675255 /nfs/dbraw/zinc/67/52/55/1102675255.db2.gz LSLMDHQMYHFSFQ-FKBYEOEOSA-N 2 0 368.496 4.074 20 0 FIADRP CC[C@@H]1CN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC[C@H]1[NH3+] ZINC000666657049 1102675643 /nfs/dbraw/zinc/67/56/43/1102675643.db2.gz KSJBPMYHIWELGI-YLJYHZDGSA-N 2 0 372.557 4.042 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257336 1102675734 /nfs/dbraw/zinc/67/57/34/1102675734.db2.gz LDTMPTKLHDWHAW-VABKMULXSA-N 2 0 364.533 4.243 20 0 FIADRP COc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1OC ZINC000123005591 1102725539 /nfs/dbraw/zinc/72/55/39/1102725539.db2.gz DWXFPGHKOOSEAN-GOSISDBHSA-N 2 0 368.521 4.459 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cn(C)nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000537652435 1102728450 /nfs/dbraw/zinc/72/84/50/1102728450.db2.gz UXRWEUPQOAIUMZ-QUCCMNQESA-N 2 0 368.569 4.108 20 0 FIADRP COc1ccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)cc1 ZINC001167978257 1102741934 /nfs/dbraw/zinc/74/19/34/1102741934.db2.gz NHDUNHXQIIEARJ-SEJPIABJSA-N 2 0 354.538 4.155 20 0 FIADRP c1ccc(OCc2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)cc1 ZINC000459369230 1102941082 /nfs/dbraw/zinc/94/10/82/1102941082.db2.gz GCZOTAPWDYPKHJ-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c(OC)c2Cl)CC1 ZINC000506893234 1102947066 /nfs/dbraw/zinc/94/70/66/1102947066.db2.gz RZTRHVIKEASXJF-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000551176102 1102948985 /nfs/dbraw/zinc/94/89/85/1102948985.db2.gz UOJALELOZIIAHO-AWDZXFJFSA-N 2 0 351.538 4.103 20 0 FIADRP CCCC[NH+]1CCC(N[C@@H]2CCc3sc(Br)cc32)CC1 ZINC000312368697 1102970431 /nfs/dbraw/zinc/97/04/31/1102970431.db2.gz LZEKEFWMSNBOIP-CQSZACIVSA-N 2 0 357.361 4.352 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc4cc(F)ccc4o3)cc2)CC1 ZINC000551227315 1102984189 /nfs/dbraw/zinc/98/41/89/1102984189.db2.gz LPKKJPKOFUOAJB-UHFFFAOYSA-N 2 0 368.452 4.335 20 0 FIADRP Cn1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(-c2ccccc2Cl)n1 ZINC000506945493 1102986140 /nfs/dbraw/zinc/98/61/40/1102986140.db2.gz OZUWKACRXDPLDP-UHFFFAOYSA-N 2 0 372.944 4.048 20 0 FIADRP C[C@@H](CC1CCCC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265354 1103024301 /nfs/dbraw/zinc/02/43/01/1103024301.db2.gz UBCBRZOUMSWCAD-NZQKXSOJSA-N 2 0 370.581 4.474 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)cc1 ZINC000551268150 1103027505 /nfs/dbraw/zinc/02/75/05/1103027505.db2.gz PEAHATALRNROFW-JOCHJYFZSA-N 2 0 368.521 4.280 20 0 FIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000459382344 1103098763 /nfs/dbraw/zinc/09/87/63/1103098763.db2.gz DHSDRHOKKYZLMP-RRDBBVDCSA-N 2 0 362.517 4.495 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000551373787 1103156844 /nfs/dbraw/zinc/15/68/44/1103156844.db2.gz ZNHJVHBNQMTTHO-HNNXBMFYSA-N 2 0 360.448 4.289 20 0 FIADRP Fc1ccccc1COc1cccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000666998239 1103405473 /nfs/dbraw/zinc/40/54/73/1103405473.db2.gz JFYBAMKOGSNFAM-LJQANCHMSA-N 2 0 354.469 4.169 20 0 FIADRP Fc1ccccc1COc1cccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000666998238 1103406797 /nfs/dbraw/zinc/40/67/97/1103406797.db2.gz JFYBAMKOGSNFAM-IBGZPJMESA-N 2 0 354.469 4.169 20 0 FIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551619660 1103444982 /nfs/dbraw/zinc/44/49/82/1103444982.db2.gz JNNACYHJHHWNON-UHFFFAOYSA-N 2 0 368.521 4.020 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000188037466 1103784576 /nfs/dbraw/zinc/78/45/76/1103784576.db2.gz CWFHNLLFRMTANF-WMZHIEFXSA-N 2 0 356.554 4.317 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2cc(Cl)ccc2C)CC1 ZINC000520045131 1104049639 /nfs/dbraw/zinc/04/96/39/1104049639.db2.gz BNBRIOOLDQTBMY-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCOC1CCCCC1)c1ccccc1O2 ZINC000538269495 1104091591 /nfs/dbraw/zinc/09/15/91/1104091591.db2.gz BYDKSEFFRHCGRK-NRFANRHFSA-N 2 0 372.553 4.304 20 0 FIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc(Cl)c1OC ZINC000520205084 1104171106 /nfs/dbraw/zinc/17/11/06/1104171106.db2.gz SYLCACUSHHPGJD-INIZCTEOSA-N 2 0 368.949 4.349 20 0 FIADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000520343993 1104285117 /nfs/dbraw/zinc/28/51/17/1104285117.db2.gz SRLYFAANSNFWQJ-TZIWHRDSSA-N 2 0 358.570 4.330 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)o2)cc1 ZINC000647976680 1104484707 /nfs/dbraw/zinc/48/47/07/1104484707.db2.gz RZXJLUBFSBBHOK-DLBZAZTESA-N 2 0 359.901 4.207 20 0 FIADRP Cc1ccccc1O[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995736 1104557433 /nfs/dbraw/zinc/55/74/33/1104557433.db2.gz PFPFKPVJLJTQKR-IUPYZPJSSA-N 2 0 354.538 4.244 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccccc3)n2)cc1 ZINC000536302057 1104636740 /nfs/dbraw/zinc/63/67/40/1104636740.db2.gz JNTSBWPSVTWULQ-FQEVSTJZSA-N 2 0 362.477 4.135 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1F ZINC000192688545 1104771737 /nfs/dbraw/zinc/77/17/37/1104771737.db2.gz YODXPYHVIFPDLP-UHFFFAOYSA-N 2 0 368.452 4.349 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000645390461 1104855431 /nfs/dbraw/zinc/85/54/31/1104855431.db2.gz ZZWIYEYIWIMNEB-DNQXCXABSA-N 2 0 365.565 4.452 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000221982582 1104990415 /nfs/dbraw/zinc/99/04/15/1104990415.db2.gz VHBOYJAZPFNYGJ-QGZVFWFLSA-N 2 0 351.332 4.289 20 0 FIADRP C[N@H+](CCSc1ccc(F)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000441614498 1105031347 /nfs/dbraw/zinc/03/13/47/1105031347.db2.gz PWLNABHBXQSASE-IBGZPJMESA-N 2 0 358.526 4.372 20 0 FIADRP c1cc(C2CCCCC2)ccc1CC[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000665235807 1105232347 /nfs/dbraw/zinc/23/23/47/1105232347.db2.gz AOOJYYRHRWRVES-XPWALMASSA-N 2 0 356.554 4.024 20 0 FIADRP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(C)C ZINC000427699413 1105251240 /nfs/dbraw/zinc/25/12/40/1105251240.db2.gz XIUDQQZZXOJRMO-DLBZAZTESA-N 2 0 357.464 4.434 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CCn4ccnc4C2)CCC3)cc1 ZINC000427899696 1105307975 /nfs/dbraw/zinc/30/79/75/1105307975.db2.gz XBRWIWSXOFZRPB-IAGOWNOFSA-N 2 0 364.518 4.297 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000474021678 1105312533 /nfs/dbraw/zinc/31/25/33/1105312533.db2.gz HRGGUSSFQOXVSK-OAQYLSRUSA-N 2 0 356.485 4.408 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C(=O)N(CC)CC)c2ccccc2)CC1 ZINC000520793176 1105357307 /nfs/dbraw/zinc/35/73/07/1105357307.db2.gz QXRMXHLQMQCING-JOCHJYFZSA-N 2 0 373.585 4.040 20 0 FIADRP Cc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc(C)c1O ZINC000390649038 1106737924 /nfs/dbraw/zinc/73/79/24/1106737924.db2.gz MYHNFPMXYPAWAG-FRIKZZABSA-N 2 0 350.506 4.294 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4cccc(-c5ccncc5)c4)C[C@@H]3C2)cc1 ZINC000475353758 1106748326 /nfs/dbraw/zinc/74/83/26/1106748326.db2.gz LEQLBVAZQPVLMX-PLQXJYEYSA-N 2 0 369.512 4.312 20 0 FIADRP COCCCC[C@H]([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1ccccc1 ZINC000475358711 1106757159 /nfs/dbraw/zinc/75/71/59/1106757159.db2.gz RANTYNNHBYVIFP-QFIPXVFZSA-N 2 0 364.493 4.223 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@H](COCC3CC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168064251 1106854357 /nfs/dbraw/zinc/85/43/57/1106854357.db2.gz PLVFFGSHRNMPML-KNKQGSTJSA-N 2 0 356.554 4.177 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@@H](C)O1 ZINC000451171860 1106958271 /nfs/dbraw/zinc/95/82/71/1106958271.db2.gz ULFIRVXSCDESCE-DIHCPRAOSA-N 2 0 362.945 4.409 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@H](C)O1 ZINC000451171862 1106958562 /nfs/dbraw/zinc/95/85/62/1106958562.db2.gz ULFIRVXSCDESCE-NHOKQLRBSA-N 2 0 362.945 4.409 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@@H]([NH+]3CC=CC3)C2)c1C ZINC000301467723 1107038724 /nfs/dbraw/zinc/03/87/24/1107038724.db2.gz QWWDEIMHRLLRBA-MRXNPFEDSA-N 2 0 372.310 4.065 20 0 FIADRP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000301780581 1107147063 /nfs/dbraw/zinc/14/70/63/1107147063.db2.gz IQPVQJJJURUEDT-AWEZNQCLSA-N 2 0 351.416 4.422 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1OCc1ccccc1 ZINC000530674115 1107245778 /nfs/dbraw/zinc/24/57/78/1107245778.db2.gz RDLMYCHASRIKSU-SFTDATJTSA-N 2 0 368.521 4.237 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc2c(cnn2C(C)C)c1 ZINC000530952991 1107431509 /nfs/dbraw/zinc/43/15/09/1107431509.db2.gz LWVRSPIOYMVOOY-AZUAARDMSA-N 2 0 357.546 4.002 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[N@@H+]1C ZINC000152433898 1107433181 /nfs/dbraw/zinc/43/31/81/1107433181.db2.gz BLFCHZNKVUXLLN-GDBMZVCRSA-N 2 0 371.352 4.114 20 0 FIADRP Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2ccccc2[nH+]1 ZINC000302880771 1107474708 /nfs/dbraw/zinc/47/47/08/1107474708.db2.gz INWHJLSIWAOJCW-FQEVSTJZSA-N 2 0 361.489 4.112 20 0 FIADRP Cc1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c(C)o1 ZINC000121310895 1107622895 /nfs/dbraw/zinc/62/28/95/1107622895.db2.gz QLVUUUYCWRKFKH-UHFFFAOYSA-N 2 0 356.510 4.057 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152468279 1107775860 /nfs/dbraw/zinc/77/58/60/1107775860.db2.gz YSDKGPANRGLMSL-KBXCAEBGSA-N 2 0 371.525 4.401 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)C3(C[NH+](C)C)CCCCC3)cc2)CC1 ZINC001625949096 1107854845 /nfs/dbraw/zinc/85/48/45/1107854845.db2.gz RZQHVPMEPDLIAE-UHFFFAOYSA-N 2 0 371.569 4.369 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc2c(c1)CCC2 ZINC000531705202 1108084322 /nfs/dbraw/zinc/08/43/22/1108084322.db2.gz IBFJMTJNFUQVNZ-GOSISDBHSA-N 2 0 352.522 4.357 20 0 FIADRP C[C@@H](CC[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)[N@H+](C)Cc1ccccc1 ZINC000531725757 1108099312 /nfs/dbraw/zinc/09/93/12/1108099312.db2.gz BVGTZUNCEDYKDZ-ROUUACIJSA-N 2 0 365.521 4.133 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cccc(N2CCCC2=O)c1 ZINC000531717861 1108109946 /nfs/dbraw/zinc/10/99/46/1108109946.db2.gz FEYAIGKNMUECQU-LJQANCHMSA-N 2 0 357.542 4.120 20 0 FIADRP Cc1cc(C[NH+](C)C)ccc1NC(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000909608360 1108124980 /nfs/dbraw/zinc/12/49/80/1108124980.db2.gz QJEHOUFUZKXNKF-UHFFFAOYSA-N 2 0 365.477 4.117 20 0 FIADRP Clc1ccc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCC2)cc1 ZINC000453112605 1108181315 /nfs/dbraw/zinc/18/13/15/1108181315.db2.gz QYPTWSTVPOJNGQ-HRAATJIYSA-N 2 0 362.945 4.272 20 0 FIADRP c1[nH]c2ncccc2c1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453169882 1108244216 /nfs/dbraw/zinc/24/42/16/1108244216.db2.gz KRMCEKXEQBNLFW-VABKMULXSA-N 2 0 374.532 4.138 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000453205612 1108275060 /nfs/dbraw/zinc/27/50/60/1108275060.db2.gz HAJWMPHFCRIWCQ-HOIMLPCSSA-N 2 0 356.554 4.224 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(-c2ccccc2)nn1C ZINC000453208585 1108277715 /nfs/dbraw/zinc/27/77/15/1108277715.db2.gz CHGGIICGGLSGCJ-TZIWHRDSSA-N 2 0 374.532 4.260 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1 ZINC000453211783 1108282592 /nfs/dbraw/zinc/28/25/92/1108282592.db2.gz OCNRMGNRMQWWOB-KZNAEPCWSA-N 2 0 352.444 4.362 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453265842 1108340470 /nfs/dbraw/zinc/34/04/70/1108340470.db2.gz DBAOKAPCQAEVTB-LLGFUMIMSA-N 2 0 354.494 4.190 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000531944049 1108388073 /nfs/dbraw/zinc/38/80/73/1108388073.db2.gz VOMRXFFPPBIJQW-GOSISDBHSA-N 2 0 374.573 4.331 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCOC3(CCC3)C2)CC1 ZINC000453321990 1108413993 /nfs/dbraw/zinc/41/39/93/1108413993.db2.gz QCOWUSCDQGQZFF-ITAUSPCMSA-N 2 0 356.554 4.369 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CCOC4(CCC4)C2)C3)cc1 ZINC000453326608 1108418261 /nfs/dbraw/zinc/41/82/61/1108418261.db2.gz VGOZFWJZPVQTLT-MYGLTJDJSA-N 2 0 354.538 4.121 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(Br)cc2)CCC1 ZINC000531956395 1108444660 /nfs/dbraw/zinc/44/46/60/1108444660.db2.gz GVHXFIUSJUPEFV-RVKKMQEKSA-N 2 0 365.359 4.189 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CSCCc3ccccc32)cc1 ZINC000531960119 1108453117 /nfs/dbraw/zinc/45/31/17/1108453117.db2.gz AURQBKMHLCEFQP-QFIPXVFZSA-N 2 0 370.562 4.137 20 0 FIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C)cc1 ZINC000531965335 1108461350 /nfs/dbraw/zinc/46/13/50/1108461350.db2.gz XGXSXDYIYLLBRF-PKTZIBPZSA-N 2 0 351.538 4.024 20 0 FIADRP CC(C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1(O)CCCC1 ZINC000453376408 1108496466 /nfs/dbraw/zinc/49/64/66/1108496466.db2.gz IFGHOKAOXNUKIL-MZADTFQBSA-N 2 0 356.554 4.103 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCC(C)(C)C2)c1)C1CCOCC1 ZINC000532265227 1108736823 /nfs/dbraw/zinc/73/68/23/1108736823.db2.gz JVTYYSJOCWYXPM-FQEVSTJZSA-N 2 0 374.569 4.235 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@@H](C)c3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000524750886 1109137621 /nfs/dbraw/zinc/13/76/21/1109137621.db2.gz DVTPMUZUUMXOTN-SIKLNZKXSA-N 2 0 357.586 4.145 20 0 FIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC000524968812 1109223603 /nfs/dbraw/zinc/22/36/03/1109223603.db2.gz RRMUVKBCWRUCCI-QZTJIDSGSA-N 2 0 374.500 4.373 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@@H]([NH+]3CCCC3)C2)c1C ZINC000525193333 1109303764 /nfs/dbraw/zinc/30/37/64/1109303764.db2.gz GJPOGUAHFSUUEW-MRXNPFEDSA-N 2 0 374.326 4.289 20 0 FIADRP Cc1cc(C(C)(C)C)cc(C)c1C[N@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000525267188 1109324907 /nfs/dbraw/zinc/32/49/07/1109324907.db2.gz OFLQPXBLEQCHBT-QFIPXVFZSA-N 2 0 371.613 4.201 20 0 FIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446889432 1109378266 /nfs/dbraw/zinc/37/82/66/1109378266.db2.gz WYTRQNQZGFFNGU-RTLBZRNLSA-N 2 0 356.554 4.427 20 0 FIADRP FC(F)Oc1ccc2ccccc2c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887032 1109383291 /nfs/dbraw/zinc/38/32/91/1109383291.db2.gz NALZLTKTLNAWNK-UHFFFAOYSA-N 2 0 360.448 4.405 20 0 FIADRP CCOc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc1OCC(C)C ZINC000446887617 1109384019 /nfs/dbraw/zinc/38/40/19/1109384019.db2.gz WIKDSMBYOLQETI-UHFFFAOYSA-N 2 0 360.542 4.084 20 0 FIADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000428463714 1109407063 /nfs/dbraw/zinc/40/70/63/1109407063.db2.gz PTQNLNLZXMGBPV-BDKRGJGYSA-N 2 0 358.570 4.064 20 0 FIADRP C[N@H+](CC/C=C/c1ccc(Br)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000525518130 1109410565 /nfs/dbraw/zinc/41/05/65/1109410565.db2.gz YSCXEGCPAHMOLH-ZVVFDCPKSA-N 2 0 351.332 4.126 20 0 FIADRP C[C@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Cl)c1 ZINC000525874954 1109548643 /nfs/dbraw/zinc/54/86/43/1109548643.db2.gz WNLDUEWIIONXFQ-XMSQKQJNSA-N 2 0 371.956 4.022 20 0 FIADRP C[NH+](C)C1(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000447523854 1109559986 /nfs/dbraw/zinc/55/99/86/1109559986.db2.gz WULKSGYXNMLQTL-KOUNCHBCSA-N 2 0 355.570 4.036 20 0 FIADRP FC(F)(F)C1CCN(C2CC([NH2+]Cc3ccnc4ccccc34)C2)CC1 ZINC000525997922 1109578830 /nfs/dbraw/zinc/57/88/30/1109578830.db2.gz WTXUJTUKTNTDBH-UHFFFAOYSA-N 2 0 363.427 4.130 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(C)o1 ZINC000447560709 1109581561 /nfs/dbraw/zinc/58/15/61/1109581561.db2.gz FGFQAXQRMCVTMO-IBGZPJMESA-N 2 0 355.526 4.149 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)o1 ZINC000447560013 1109581928 /nfs/dbraw/zinc/58/19/28/1109581928.db2.gz BSYMKQADEDAUGK-HZPDHXFCSA-N 2 0 359.489 4.199 20 0 FIADRP Fc1cccc2c1OCC[C@H]2N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447596718 1109591168 /nfs/dbraw/zinc/59/11/68/1109591168.db2.gz CLBLVHIHZKNWGO-VQQMMKBISA-N 2 0 366.480 4.435 20 0 FIADRP Fc1ccccc1NCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447603299 1109599791 /nfs/dbraw/zinc/59/97/91/1109599791.db2.gz XJQMAFYDVFKXAU-WKCHPHFGSA-N 2 0 367.512 4.413 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000508605160 1109605769 /nfs/dbraw/zinc/60/57/69/1109605769.db2.gz RXVRMVURJYRYFV-FHWLQOOXSA-N 2 0 357.542 4.118 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1nc(-c2ccccc2)c[nH]1 ZINC000447849476 1109658832 /nfs/dbraw/zinc/65/88/32/1109658832.db2.gz IAPGSUIAOQCWRK-WIYYLYMNSA-N 2 0 360.505 4.077 20 0 FIADRP c1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)n(-c2ccccc2)n1 ZINC000447931180 1109681349 /nfs/dbraw/zinc/68/13/49/1109681349.db2.gz OEGRLIHQAKADER-UHFFFAOYSA-N 2 0 360.505 4.148 20 0 FIADRP CC(C)(C)c1cnc(CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000447933708 1109682167 /nfs/dbraw/zinc/68/21/67/1109682167.db2.gz XSOYCLNYOTXKIC-SFHVURJKSA-N 2 0 357.567 4.095 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc3cc[nH]c3c2)cc1 ZINC000527637628 1109792359 /nfs/dbraw/zinc/79/23/59/1109792359.db2.gz KMQJLNJVSNRPAJ-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP COc1cccc([C@H](C[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)OC)c1 ZINC000527732913 1109813694 /nfs/dbraw/zinc/81/36/94/1109813694.db2.gz BOGCHZXLPSRYPP-HARLFGEKSA-N 2 0 368.521 4.025 20 0 FIADRP CCC(F)(F)C(C)(C)C[NH2+]C1CCN(CCc2ccc(F)cc2)CC1 ZINC000527792306 1109824696 /nfs/dbraw/zinc/82/46/96/1109824696.db2.gz VDPGJSDCGVNPEK-UHFFFAOYSA-N 2 0 356.476 4.494 20 0 FIADRP CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000527844923 1109832641 /nfs/dbraw/zinc/83/26/41/1109832641.db2.gz BGYKXBCHHSQKPN-MOPGFXCFSA-N 2 0 366.553 4.198 20 0 FIADRP CN1C(=O)c2ccccc2[C@H]1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000527999387 1109881413 /nfs/dbraw/zinc/88/14/13/1109881413.db2.gz DHKQNNVBBKMIAC-HXUWFJFHSA-N 2 0 371.569 4.082 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(CCc3ccccc3)s2)[C@H](C)C1 ZINC000449028946 1109959520 /nfs/dbraw/zinc/95/95/20/1109959520.db2.gz NHULIUGHTDNGAC-XLIONFOSSA-N 2 0 357.567 4.090 20 0 FIADRP Fc1cc2c(c(F)c1F)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000449068308 1109971826 /nfs/dbraw/zinc/97/18/26/1109971826.db2.gz RWKJYXVYRHKTIT-GOSISDBHSA-N 2 0 360.423 4.477 20 0 FIADRP Fc1cc2c(c(F)c1F)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000449068309 1109971962 /nfs/dbraw/zinc/97/19/62/1109971962.db2.gz RWKJYXVYRHKTIT-SFHVURJKSA-N 2 0 360.423 4.477 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C2CCN(c3ccccn3)CC2)CC1 ZINC000449073855 1109973580 /nfs/dbraw/zinc/97/35/80/1109973580.db2.gz AKMHELRXCMTBPI-UHFFFAOYSA-N 2 0 372.601 4.319 20 0 FIADRP C[C@H](Cc1cccc(O)c1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449131754 1109982462 /nfs/dbraw/zinc/98/24/62/1109982462.db2.gz PHNHNRJLVFYEGJ-RTBURBONSA-N 2 0 352.522 4.008 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449112722 1109983273 /nfs/dbraw/zinc/98/32/73/1109983273.db2.gz SEHUMUPMDPXEIK-XLIONFOSSA-N 2 0 350.934 4.067 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCOc3ccccc32)CC1 ZINC000449145502 1109984767 /nfs/dbraw/zinc/98/47/67/1109984767.db2.gz LMHQJZVSWLJYGM-TZIWHRDSSA-N 2 0 364.533 4.238 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000449143864 1109984776 /nfs/dbraw/zinc/98/47/76/1109984776.db2.gz XXCJBXMDBNSNOS-WFXMLNOXSA-N 2 0 358.526 4.090 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2cccc(-n3cncn3)c2)CC1 ZINC000449157613 1109987678 /nfs/dbraw/zinc/98/76/78/1109987678.db2.gz QUETYVUHNGLTHY-UHFFFAOYSA-N 2 0 369.557 4.036 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCC23CCCCC3)CC1 ZINC000449176499 1109989025 /nfs/dbraw/zinc/98/90/25/1109989025.db2.gz MVXAPCDLDLDFKG-JOCHJYFZSA-N 2 0 356.554 4.236 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCc2c[nH]c3ncccc23)CC1 ZINC000449211397 1109996537 /nfs/dbraw/zinc/99/65/37/1109996537.db2.gz VAPXPSCOQCEANO-UHFFFAOYSA-N 2 0 356.558 4.374 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449214470 1109996832 /nfs/dbraw/zinc/99/68/32/1109996832.db2.gz WTOVJMALVMAZEM-GMAHTHKFSA-N 2 0 371.613 4.040 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000449202768 1109998277 /nfs/dbraw/zinc/99/82/77/1109998277.db2.gz GMVTXKSMLVBYFG-QIJUGHKUSA-N 2 0 358.570 4.265 20 0 FIADRP Cc1ncsc1CN(C)C[C@@H]1CC[N@H+](Cc2cccc3ccoc32)C1 ZINC000449263192 1110017901 /nfs/dbraw/zinc/01/79/01/1110017901.db2.gz HKDZCFVOTZCZLN-INIZCTEOSA-N 2 0 355.507 4.152 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000449308374 1110023317 /nfs/dbraw/zinc/02/33/17/1110023317.db2.gz WPQVAKZAKSQBGU-QGZVFWFLSA-N 2 0 350.497 4.497 20 0 FIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cnc(CCc4ccccc4)s3)C2)CC1 ZINC000449325909 1110026509 /nfs/dbraw/zinc/02/65/09/1110026509.db2.gz QKYUKXHGODEGBM-FQEVSTJZSA-N 2 0 369.578 4.092 20 0 FIADRP C[C@H](CC(C)(C)C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000449343042 1110034875 /nfs/dbraw/zinc/03/48/75/1110034875.db2.gz HFXDGLUAUMKDHU-TZIWHRDSSA-N 2 0 358.570 4.330 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCOC3(CCC3)C2)CC1 ZINC000449480507 1110085124 /nfs/dbraw/zinc/08/51/24/1110085124.db2.gz OQKFAQPRNGOVOK-TZIWHRDSSA-N 2 0 356.554 4.021 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000449542306 1110100468 /nfs/dbraw/zinc/10/04/68/1110100468.db2.gz QEPOCGOZVGMBBX-VXKWHMMOSA-N 2 0 367.537 4.050 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C2CC2)cn1 ZINC000528851342 1110131842 /nfs/dbraw/zinc/13/18/42/1110131842.db2.gz LZLYDXKIRNIXCI-HSZRJFAPSA-N 2 0 365.521 4.317 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)C2CC(F)(F)C2)CC1 ZINC000529541046 1110285114 /nfs/dbraw/zinc/28/51/14/1110285114.db2.gz ZVDHXEDWIUVNBG-HUUCEWRRSA-N 2 0 369.475 4.052 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000538446052 1111144340 /nfs/dbraw/zinc/14/43/40/1111144340.db2.gz BLPXUCBVWZGSOD-UHFFFAOYSA-N 2 0 356.897 4.271 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000538446601 1111144930 /nfs/dbraw/zinc/14/49/30/1111144930.db2.gz IWKGGUCYEKPDNQ-UHFFFAOYSA-N 2 0 372.516 4.199 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000538548272 1111188325 /nfs/dbraw/zinc/18/83/25/1111188325.db2.gz GTOBHBDRZFKYKC-GOSISDBHSA-N 2 0 355.526 4.170 20 0 FIADRP COc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2ccccc12 ZINC000538799120 1111295382 /nfs/dbraw/zinc/29/53/82/1111295382.db2.gz OKCUGSZJBCRHTK-PGRDOPGGSA-N 2 0 350.506 4.297 20 0 FIADRP COc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c2ccccc12 ZINC000538799119 1111295542 /nfs/dbraw/zinc/29/55/42/1111295542.db2.gz OKCUGSZJBCRHTK-GCJKJVERSA-N 2 0 350.506 4.297 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3ccc(F)cc3o2)CC1)CC1CC1 ZINC000538951845 1111356537 /nfs/dbraw/zinc/35/65/37/1111356537.db2.gz ZLCHVAUWZCSHEM-UHFFFAOYSA-N 2 0 359.489 4.301 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159280 1111454852 /nfs/dbraw/zinc/45/48/52/1111454852.db2.gz NQRIOTYOEHKUDX-JXFKEZNVSA-N 2 0 359.514 4.332 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C[C@@H](C)O1 ZINC000539260750 1111497836 /nfs/dbraw/zinc/49/78/36/1111497836.db2.gz HGIFUDCIVZITRY-MDZRGWNJSA-N 2 0 366.933 4.033 20 0 FIADRP CC[C@@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)c1nccn1C ZINC000539294334 1111505165 /nfs/dbraw/zinc/50/51/65/1111505165.db2.gz BWBRUEABHBGNHD-HXUWFJFHSA-N 2 0 354.542 4.153 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H]1CCc3ccccc31)c1ccccc1O2 ZINC000539396678 1111552946 /nfs/dbraw/zinc/55/29/46/1111552946.db2.gz MLBCNNOPGHAKSZ-KNQAVFIVSA-N 2 0 362.517 4.294 20 0 FIADRP Cc1ccc2nc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn2c1 ZINC000552046778 1111556986 /nfs/dbraw/zinc/55/69/86/1111556986.db2.gz QYAOHNFLZHDMOC-UHFFFAOYSA-N 2 0 362.521 4.176 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)[C@H](C)C1 ZINC000552089863 1111570670 /nfs/dbraw/zinc/57/06/70/1111570670.db2.gz XPEAXGPLEBLKSU-KGLIPLIRSA-N 2 0 371.388 4.252 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4ccccc4)s3)C2)CC1 ZINC000552092409 1111572860 /nfs/dbraw/zinc/57/28/60/1111572860.db2.gz SRPJMXGPMDKRRR-FQEVSTJZSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000477868254 1111583006 /nfs/dbraw/zinc/58/30/06/1111583006.db2.gz WQSSNYLFULWKJB-RXVVDRJESA-N 2 0 360.542 4.160 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2n[nH]cc2c1 ZINC000552099309 1111585400 /nfs/dbraw/zinc/58/54/00/1111585400.db2.gz DSOQLZXNMQBHDG-ZIPUMODLSA-N 2 0 360.505 4.409 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000477869547 1111591124 /nfs/dbraw/zinc/59/11/24/1111591124.db2.gz XUSZAONIWSWPDE-HSMVNMDESA-N 2 0 354.325 4.336 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1OC(F)F ZINC000477907780 1111595505 /nfs/dbraw/zinc/59/55/05/1111595505.db2.gz AGHHVQOZGHEVNK-CQSZACIVSA-N 2 0 356.457 4.069 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477915477 1111597563 /nfs/dbraw/zinc/59/75/63/1111597563.db2.gz CHAUONBHDCLTGD-OAHLLOKOSA-N 2 0 358.555 4.286 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477915544 1111597790 /nfs/dbraw/zinc/59/77/90/1111597790.db2.gz KVUYHKATHKCBJA-MRXNPFEDSA-N 2 0 365.949 4.077 20 0 FIADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000478036671 1111650061 /nfs/dbraw/zinc/65/00/61/1111650061.db2.gz UNHAQZJZJSMMPG-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000552527117 1111739277 /nfs/dbraw/zinc/73/92/77/1111739277.db2.gz YZMNLSBCSYFWOF-HXUWFJFHSA-N 2 0 371.569 4.057 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc(F)ccc1F ZINC000479055239 1111938023 /nfs/dbraw/zinc/93/80/23/1111938023.db2.gz GXTOKFXUXLOGOY-GQIGUUNPSA-N 2 0 354.485 4.141 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccc(Br)cc2)C1 ZINC000479290015 1111986455 /nfs/dbraw/zinc/98/64/55/1111986455.db2.gz XFGXJRFNDLCHCK-DOTOQJQBSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1C(F)(F)F ZINC000479296457 1111987734 /nfs/dbraw/zinc/98/77/34/1111987734.db2.gz NMIPLLNWVLOYHN-NSHDSACASA-N 2 0 367.253 4.460 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479332035 1111994164 /nfs/dbraw/zinc/99/41/64/1111994164.db2.gz SFMRNBJMCPLHRW-UGKGYDQZSA-N 2 0 366.553 4.494 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(F)ccc1F ZINC000479353200 1111996614 /nfs/dbraw/zinc/99/66/14/1111996614.db2.gz XRRSYDIOTSCAQJ-OAQYLSRUSA-N 2 0 362.464 4.392 20 0 FIADRP CC1(C)C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cc(Br)ccc21 ZINC000479367207 1112002076 /nfs/dbraw/zinc/00/20/76/1112002076.db2.gz WEEBUOHCQHLBOQ-UGSOOPFHSA-N 2 0 363.343 4.245 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3c(cc(C)cc3C)[nH]2)[C@@H](C)C1 ZINC000479396180 1112011965 /nfs/dbraw/zinc/01/19/65/1112011965.db2.gz PBFROJQNLJEMFB-GHTZIAJQSA-N 2 0 357.542 4.011 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000479464294 1112034394 /nfs/dbraw/zinc/03/43/94/1112034394.db2.gz LPCSBUDWUKUGQD-TZIWHRDSSA-N 2 0 360.505 4.045 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466326 1112041547 /nfs/dbraw/zinc/04/15/47/1112041547.db2.gz RNJXXHOVNAUDEW-UNMCSNQZSA-N 2 0 350.506 4.320 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCO[C@H](C(F)(F)F)C3)cc2)C1 ZINC000554050139 1112176966 /nfs/dbraw/zinc/17/69/66/1112176966.db2.gz FYJNFFHIDYNRFX-LZQZEXGQSA-N 2 0 370.459 4.118 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000480160205 1112308106 /nfs/dbraw/zinc/30/81/06/1112308106.db2.gz NTSAAAFMZWLLQV-GUYCJALGSA-N 2 0 351.332 4.461 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2nccn2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000480306439 1112379392 /nfs/dbraw/zinc/37/93/92/1112379392.db2.gz HYIYWLDHEZHDID-IRLDBZIGSA-N 2 0 374.532 4.263 20 0 FIADRP CC(C)C[NH+]1CCC(NCc2cc(Br)c(Cl)s2)CC1 ZINC000480342703 1112393969 /nfs/dbraw/zinc/39/39/69/1112393969.db2.gz NYXVHYXFRQUDGD-UHFFFAOYSA-N 2 0 365.768 4.374 20 0 FIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000480535474 1112465693 /nfs/dbraw/zinc/46/56/93/1112465693.db2.gz JXYMRCXXTVYZCD-IBGZPJMESA-N 2 0 367.537 4.156 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)C1CC1 ZINC000480548038 1112471320 /nfs/dbraw/zinc/47/13/20/1112471320.db2.gz JGFGKSCSSWMAND-XMMPIXPASA-N 2 0 364.533 4.464 20 0 FIADRP COC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)C1CC1 ZINC000480548037 1112471380 /nfs/dbraw/zinc/47/13/80/1112471380.db2.gz JGFGKSCSSWMAND-DEOSSOPVSA-N 2 0 364.533 4.464 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCCCc3ccccc3)CC2)CC1 ZINC000480583207 1112483163 /nfs/dbraw/zinc/48/31/63/1112483163.db2.gz QTGGKGPYSCJLRZ-UHFFFAOYSA-N 3 0 371.613 4.137 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(-n2cccn2)cc1 ZINC000480601521 1112491448 /nfs/dbraw/zinc/49/14/48/1112491448.db2.gz ASUGGLMZDSGXPU-ZCNNSNEGSA-N 2 0 354.542 4.281 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1 ZINC000480645943 1112520202 /nfs/dbraw/zinc/52/02/02/1112520202.db2.gz YFCKGCXDUKPTJN-JTOYRKQZSA-N 2 0 371.613 4.245 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480632361 1112522308 /nfs/dbraw/zinc/52/23/08/1112522308.db2.gz UTQTWODZQIBRAR-HNAYVOBHSA-N 2 0 372.384 4.450 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc2c(c1)OCO2 ZINC000480635485 1112523393 /nfs/dbraw/zinc/52/33/93/1112523393.db2.gz AIJMLZTYJKSCJK-MSOLQXFVSA-N 2 0 366.505 4.498 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNCc2nccn2-c2ccccc2)C1 ZINC000480665510 1112544128 /nfs/dbraw/zinc/54/41/28/1112544128.db2.gz XVIVOPKMOXPATM-HXUWFJFHSA-N 2 0 374.532 4.394 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H]2CCCc3sccc32)CC1 ZINC000480708167 1112557072 /nfs/dbraw/zinc/55/70/72/1112557072.db2.gz RXUNTYVWHGXDHE-OAQYLSRUSA-N 2 0 369.578 4.053 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCOc3ccccc32)cc1 ZINC000480726229 1112573231 /nfs/dbraw/zinc/57/32/31/1112573231.db2.gz GMFZWOSDHYFJOD-JOCHJYFZSA-N 2 0 368.521 4.411 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000480751125 1112578060 /nfs/dbraw/zinc/57/80/60/1112578060.db2.gz UYKMPLCWHJMWAH-BKULYWANSA-N 2 0 363.549 4.013 20 0 FIADRP CCC[C@@H]([NH2+]CCCC[NH+]1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000480777965 1112593119 /nfs/dbraw/zinc/59/31/19/1112593119.db2.gz WLWQAEHOVQKFTI-HXUWFJFHSA-N 2 0 351.966 4.189 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000480782766 1112595625 /nfs/dbraw/zinc/59/56/25/1112595625.db2.gz XTIPIWJXZSJJMV-AZUAARDMSA-N 2 0 357.567 4.086 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000554993511 1112605064 /nfs/dbraw/zinc/60/50/64/1112605064.db2.gz BZVQMSKNBJWLDF-TZIWHRDSSA-N 2 0 351.538 4.310 20 0 FIADRP CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000555004316 1112613637 /nfs/dbraw/zinc/61/36/37/1112613637.db2.gz CNEDNSDCOHJDEB-UHFFFAOYSA-N 2 0 371.569 4.057 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000480879151 1112652045 /nfs/dbraw/zinc/65/20/45/1112652045.db2.gz GTSJJGZYQLYZKE-FXAWDEMLSA-N 2 0 366.977 4.344 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000481297562 1112866164 /nfs/dbraw/zinc/86/61/64/1112866164.db2.gz DZLDFOICQUZNPE-SFHVURJKSA-N 2 0 366.505 4.081 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]CC3CCCCC3)C3(C2)CCOCC3)cc1 ZINC000555611993 1112946484 /nfs/dbraw/zinc/94/64/84/1112946484.db2.gz FZSOBJSVZBLWFW-JOCHJYFZSA-N 2 0 356.554 4.085 20 0 FIADRP COc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000481546457 1112977594 /nfs/dbraw/zinc/97/75/94/1112977594.db2.gz QGJMBVZGSMRGBX-JOCHJYFZSA-N 2 0 350.506 4.184 20 0 FIADRP C[NH+](C)[C@H]1CCCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)CC1 ZINC000899876057 1113039139 /nfs/dbraw/zinc/03/91/39/1113039139.db2.gz JUQGVRVDGJRXHB-ZDUSSCGKSA-N 2 0 353.388 4.054 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C(F)(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000481710373 1113050322 /nfs/dbraw/zinc/05/03/22/1113050322.db2.gz BOYCPVVQXPZSIQ-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2ccccc2n1)c1cccc(OCC[NH+](C)C)c1 ZINC000481715782 1113052748 /nfs/dbraw/zinc/05/27/48/1113052748.db2.gz JHNYVTUCIRBBMQ-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000481731888 1113058915 /nfs/dbraw/zinc/05/89/15/1113058915.db2.gz GCZOFFFLXXLBBV-XLIONFOSSA-N 2 0 366.977 4.344 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccccc3OC)CC2)cc1 ZINC000481739389 1113062817 /nfs/dbraw/zinc/06/28/17/1113062817.db2.gz GASWRBXJDQWVCK-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](CCc2ccc(Cl)cc2)C(C)C)CC1 ZINC000481937668 1113139945 /nfs/dbraw/zinc/13/99/45/1113139945.db2.gz KWQFYMDDHXNQRV-OAQYLSRUSA-N 2 0 366.977 4.388 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000482134093 1113178422 /nfs/dbraw/zinc/17/84/22/1113178422.db2.gz FLXFUKWLUVSYMY-VQTJNVASSA-N 2 0 370.541 4.159 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000482134091 1113178748 /nfs/dbraw/zinc/17/87/48/1113178748.db2.gz FLXFUKWLUVSYMY-PMACEKPBSA-N 2 0 370.541 4.159 20 0 FIADRP c1csc(CN2CCC[C@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)c1 ZINC000482131244 1113184694 /nfs/dbraw/zinc/18/46/94/1113184694.db2.gz WWAVYYGBNOUZGL-YLJYHZDGSA-N 2 0 356.535 4.464 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000482326634 1113226249 /nfs/dbraw/zinc/22/62/49/1113226249.db2.gz ZDZURPNMNTWDMG-RDTXWAMCSA-N 2 0 356.432 4.283 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000482333080 1113228068 /nfs/dbraw/zinc/22/80/68/1113228068.db2.gz ZCYABYSJPOXUOV-CVEARBPZSA-N 2 0 358.448 4.399 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000162920993 1113249576 /nfs/dbraw/zinc/24/95/76/1113249576.db2.gz TZEZKVXDOFCBCW-SFHVURJKSA-N 2 0 355.551 4.469 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CCC2 ZINC000482442951 1113258070 /nfs/dbraw/zinc/25/80/70/1113258070.db2.gz ZYHSOWFROUIPPV-HYBUGGRVSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000162933038 1113258664 /nfs/dbraw/zinc/25/86/64/1113258664.db2.gz WPMUKYQZGPJBJQ-HXUWFJFHSA-N 2 0 374.532 4.378 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482503529 1113279616 /nfs/dbraw/zinc/27/96/16/1113279616.db2.gz LPLFPMLNICVYNR-XLIONFOSSA-N 2 0 371.594 4.142 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)CC1 ZINC000482503309 1113279641 /nfs/dbraw/zinc/27/96/41/1113279641.db2.gz DHAKLIXABDJLHM-RTBURBONSA-N 2 0 371.594 4.339 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482537110 1113290496 /nfs/dbraw/zinc/29/04/96/1113290496.db2.gz RRFVDYWISAYJPS-QHCPKHFHSA-N 2 0 368.521 4.224 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000482543632 1113293310 /nfs/dbraw/zinc/29/33/10/1113293310.db2.gz NJDJYXOHYQYAIB-VGSWGCGISA-N 2 0 367.512 4.224 20 0 FIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482567432 1113299414 /nfs/dbraw/zinc/29/94/14/1113299414.db2.gz VLZVATGOFQEIGJ-FQEVSTJZSA-N 2 0 367.537 4.157 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000482570020 1113299962 /nfs/dbraw/zinc/29/99/62/1113299962.db2.gz YLEGNSGYMSDORH-FQEVSTJZSA-N 2 0 374.525 4.135 20 0 FIADRP Cc1ncsc1C[NH+](C)CCCCCC[N@@H+](C)Cc1scnc1C ZINC000066563012 1113373795 /nfs/dbraw/zinc/37/37/95/1113373795.db2.gz RZLOWVFFXKQBOP-UHFFFAOYSA-N 2 0 366.600 4.341 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-c2ccccc2)cc1 ZINC000482875424 1113386630 /nfs/dbraw/zinc/38/66/30/1113386630.db2.gz LWLGAGSLTNHIFF-AUSIDOKSSA-N 2 0 352.522 4.241 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(Sc3ccccc3)CC2)[C@@H](C)C1 ZINC000482881618 1113391360 /nfs/dbraw/zinc/39/13/60/1113391360.db2.gz DOMKANKAZLDCPM-AZUAARDMSA-N 2 0 362.583 4.038 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cccc(-c2ccccc2)c1 ZINC000482883671 1113391762 /nfs/dbraw/zinc/39/17/62/1113391762.db2.gz AJDHXUOMHUKMDX-WMZHIEFXSA-N 2 0 352.522 4.241 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000482907815 1113396470 /nfs/dbraw/zinc/39/64/70/1113396470.db2.gz ZDWINZXQEXRWAC-NFBKMPQASA-N 2 0 366.549 4.313 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(F)c1 ZINC000482905523 1113396716 /nfs/dbraw/zinc/39/67/16/1113396716.db2.gz UDHOHEUONZCTOI-QGZVFWFLSA-N 2 0 372.484 4.160 20 0 FIADRP CCc1nc2ccccc2n1C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000162218713 1113443084 /nfs/dbraw/zinc/44/30/84/1113443084.db2.gz MGTBOLYPLJWBOD-UHFFFAOYSA-N 2 0 354.542 4.112 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3c(s2)CCC3)[C@@H](C)C1 ZINC000483140250 1113451882 /nfs/dbraw/zinc/45/18/82/1113451882.db2.gz PSAYFFUNYDGQKV-JZXOWHBKSA-N 2 0 350.572 4.024 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)ccc1OC(F)F ZINC000483185968 1113462874 /nfs/dbraw/zinc/46/28/74/1113462874.db2.gz OGTGHPFEAMPIJY-DYVFJYSZSA-N 2 0 358.473 4.314 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)ccc1OC(F)F ZINC000483185967 1113462996 /nfs/dbraw/zinc/46/29/96/1113462996.db2.gz OGTGHPFEAMPIJY-CXAGYDPISA-N 2 0 358.473 4.314 20 0 FIADRP C[C@@H]1[C@H](N[C@H]2CC[NH+](C)[C@H](c3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000569244745 1113485707 /nfs/dbraw/zinc/48/57/07/1113485707.db2.gz MKTKQFCSTCLZGO-GOUWZUTHSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(-c2cnn(C)c2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486489866 1113577355 /nfs/dbraw/zinc/57/73/55/1113577355.db2.gz PFPCJMJRTUMCPP-AUSIDOKSSA-N 2 0 374.532 4.087 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)cc1 ZINC000486702177 1113625759 /nfs/dbraw/zinc/62/57/59/1113625759.db2.gz PQXUEEHVXNIDJF-UHFFFAOYSA-N 2 0 369.484 4.317 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486708762 1113626896 /nfs/dbraw/zinc/62/68/96/1113626896.db2.gz KHDXSYZFXXNAEB-KKSFZXQISA-N 2 0 351.469 4.307 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000488117325 1113859077 /nfs/dbraw/zinc/85/90/77/1113859077.db2.gz YEJCEYWWTCUQKI-CIQXWFTPSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2ccc(C(C)(C)C)cc2)CC1)C1CC[NH+](C)CC1 ZINC000151080690 1114293610 /nfs/dbraw/zinc/29/36/10/1114293610.db2.gz YHXWSQBLBLGPRO-GOSISDBHSA-N 2 0 357.586 4.273 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccc(F)cc2)cc1 ZINC000491003565 1114358961 /nfs/dbraw/zinc/35/89/61/1114358961.db2.gz FWYSYIZASYVYKU-QFIPXVFZSA-N 2 0 356.485 4.245 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000571312866 1114455210 /nfs/dbraw/zinc/45/52/10/1114455210.db2.gz JJTNLLHKFRPQAY-JTQLQIEISA-N 2 0 365.237 4.118 20 0 FIADRP Cc1cccc(C2([NH2+]Cc3ccc(OCC[NH+](C)C)cc3)CCCC2)c1 ZINC000589651397 1114822132 /nfs/dbraw/zinc/82/21/32/1114822132.db2.gz RVNRDOJDJAXPNU-UHFFFAOYSA-N 2 0 352.522 4.495 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(Cl)c1 ZINC000573098734 1115048730 /nfs/dbraw/zinc/04/87/30/1115048730.db2.gz ZOZIRNRHOLQSMC-UHFFFAOYSA-N 2 0 358.913 4.411 20 0 FIADRP CCc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1 ZINC000591714963 1115120155 /nfs/dbraw/zinc/12/01/55/1115120155.db2.gz SMEGKOQIVQAFBZ-GOSISDBHSA-N 2 0 369.528 4.381 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168401469 1115174901 /nfs/dbraw/zinc/17/49/01/1115174901.db2.gz WXAHNBUWDKXYGI-CVDCTZTESA-N 2 0 352.497 4.185 20 0 FIADRP COCc1cc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1OC ZINC000157542421 1115176083 /nfs/dbraw/zinc/17/60/83/1115176083.db2.gz JDEUKVUBOVEMSI-KRWDZBQOSA-N 2 0 360.542 4.289 20 0 FIADRP COc1cccc(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)c1OC1CCCC1 ZINC000573793192 1115181592 /nfs/dbraw/zinc/18/15/92/1115181592.db2.gz WUCNMNOENGXXAW-UXHICEINSA-N 2 0 352.478 4.251 20 0 FIADRP COC(=O)c1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1Cl ZINC000597076629 1115639108 /nfs/dbraw/zinc/63/91/08/1115639108.db2.gz SUKQUVMRZLHORC-UHFFFAOYSA-N 2 0 374.912 4.257 20 0 FIADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000669614551 1115667875 /nfs/dbraw/zinc/66/78/75/1115667875.db2.gz YLSRVWJVXMPCTO-NZQKXSOJSA-N 2 0 364.533 4.227 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000669703969 1115831375 /nfs/dbraw/zinc/83/13/75/1115831375.db2.gz ZUTIUHNIKAXKHO-MFKCLSPESA-N 2 0 356.554 4.082 20 0 FIADRP Cc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc(C)c1OCc1ccccn1 ZINC000062426955 1115925941 /nfs/dbraw/zinc/92/59/41/1115925941.db2.gz VYPFVBUWWPYDCD-FQEVSTJZSA-N 2 0 367.537 4.097 20 0 FIADRP CC[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1F ZINC000606467403 1115946442 /nfs/dbraw/zinc/94/64/42/1115946442.db2.gz IEBNXNXFXUWATR-NRFANRHFSA-N 2 0 362.464 4.189 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3cccc(C[NH+](C)C)c3)cc2)C1 ZINC000607384298 1116021334 /nfs/dbraw/zinc/02/13/34/1116021334.db2.gz RVCXKNGNBSHZFO-SFHVURJKSA-N 2 0 365.521 4.232 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3F)o2)CC1 ZINC000607732076 1116055970 /nfs/dbraw/zinc/05/59/70/1116055970.db2.gz BCKMKWNHKXWGDV-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP C#CCOc1ccccc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000063776100 1116108074 /nfs/dbraw/zinc/10/80/74/1116108074.db2.gz FHUDQYSDVKVQNK-UHFFFAOYSA-N 2 0 362.517 4.364 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)c1 ZINC000534705684 1116227616 /nfs/dbraw/zinc/22/76/16/1116227616.db2.gz NHPHJGVMHYAROS-UHFFFAOYSA-N 2 0 365.477 4.117 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000546871698 1116253575 /nfs/dbraw/zinc/25/35/75/1116253575.db2.gz CPJDHUFKEDRMKN-HXUWFJFHSA-N 2 0 357.929 4.340 20 0 FIADRP CC(C)[N@H+](Cc1ccccn1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000535083163 1116265687 /nfs/dbraw/zinc/26/56/87/1116265687.db2.gz UFLSAARBFWXMBG-UHFFFAOYSA-N 2 0 366.553 4.023 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535231011 1116283353 /nfs/dbraw/zinc/28/33/53/1116283353.db2.gz UWSFTATWGFMBNA-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP c1onc(Cc2ccccc2)c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000508853902 1116345181 /nfs/dbraw/zinc/34/51/81/1116345181.db2.gz DHSSLYBVQRGUSX-UHFFFAOYSA-N 2 0 367.537 4.353 20 0 FIADRP Cc1cc(Br)ccc1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000539817124 1116384499 /nfs/dbraw/zinc/38/44/99/1116384499.db2.gz AMYRANRGEFAJKN-SFHVURJKSA-N 2 0 351.332 4.208 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)CC1 ZINC000462683779 1116390363 /nfs/dbraw/zinc/39/03/63/1116390363.db2.gz NXGPCAJMIILVKP-UHFFFAOYSA-N 2 0 365.565 4.088 20 0 FIADRP Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CCC2 ZINC000462809516 1117780647 /nfs/dbraw/zinc/78/06/47/1117780647.db2.gz BMQVQCLULBSVGP-QHCPKHFHSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462804155 1117786643 /nfs/dbraw/zinc/78/66/43/1117786643.db2.gz CVGQDNJELSZTOW-GZMRBYKVSA-N 2 0 351.332 4.013 20 0 FIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000462804602 1117787238 /nfs/dbraw/zinc/78/72/38/1117787238.db2.gz DTQWPDGFNANMAF-RTBURBONSA-N 2 0 371.569 4.051 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2(CCO)CC2)c2ccc(F)cc2)CC1 ZINC000462806822 1117788602 /nfs/dbraw/zinc/78/86/02/1117788602.db2.gz XTXWCLLBYKDNLB-NRFANRHFSA-N 2 0 362.533 4.131 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)[C@H](C)C1 ZINC000540141168 1117894213 /nfs/dbraw/zinc/89/42/13/1117894213.db2.gz FIABDWFHQDPNLS-VGSWGCGISA-N 2 0 356.485 4.225 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(-c2cccs2)cc1 ZINC000540159218 1117903287 /nfs/dbraw/zinc/90/32/87/1117903287.db2.gz ZVDMVJMKQZJWNT-DQLDELGASA-N 2 0 370.562 4.444 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000540170947 1117912286 /nfs/dbraw/zinc/91/22/86/1117912286.db2.gz NGLJQSCSCOHKIM-OAGGEKHMSA-N 2 0 374.447 4.125 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000463076508 1117958930 /nfs/dbraw/zinc/95/89/30/1117958930.db2.gz AYGUYRYSMIQOAP-UHFFFAOYSA-N 2 0 368.569 4.323 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000463112715 1117970587 /nfs/dbraw/zinc/97/05/87/1117970587.db2.gz VVCJLCHTYWBIPV-HYBUGGRVSA-N 2 0 365.565 4.281 20 0 FIADRP COc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000540302002 1117976451 /nfs/dbraw/zinc/97/64/51/1117976451.db2.gz MHHQNCUBVRHZEM-HYBUGGRVSA-N 2 0 364.533 4.301 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+](C)C)cc1 ZINC000463120469 1117979212 /nfs/dbraw/zinc/97/92/12/1117979212.db2.gz VYRKYIMYTZSIKZ-OYDLWJJNSA-N 2 0 365.565 4.240 20 0 FIADRP c1ccc(N2CCC([NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)cc1 ZINC000463145756 1117983061 /nfs/dbraw/zinc/98/30/61/1117983061.db2.gz YMXWUZXJOYMCET-UHFFFAOYSA-N 2 0 363.549 4.431 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]C2CCN(CCc3ccccc3)CC2)C1 ZINC000463138801 1117986637 /nfs/dbraw/zinc/98/66/37/1117986637.db2.gz QNHXXXICBDOJMF-FGZHOGPDSA-N 2 0 371.613 4.041 20 0 FIADRP CC(C)[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Nc1ccccc1 ZINC000463158809 1117988549 /nfs/dbraw/zinc/98/85/49/1117988549.db2.gz XSTMACYMFATPAT-DEOSSOPVSA-N 2 0 365.565 4.420 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cccc(OCc2ccccn2)c1 ZINC000540354099 1117998227 /nfs/dbraw/zinc/99/82/27/1117998227.db2.gz LETHXBGDORHPLX-RXVVDRJESA-N 2 0 353.510 4.186 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H]2CCOc3c(F)cccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463263604 1118057973 /nfs/dbraw/zinc/05/79/73/1118057973.db2.gz DDMOZZNRDNMIRY-MMOPVJDHSA-N 2 0 354.469 4.292 20 0 FIADRP C[C@@H](Cc1ccsc1)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475941 1118077114 /nfs/dbraw/zinc/07/71/14/1118077114.db2.gz WOHNZSQBQKPVMS-QFBILLFUSA-N 2 0 356.535 4.257 20 0 FIADRP C[C@@H]1CCCC[C@H]1OCC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475536 1118077969 /nfs/dbraw/zinc/07/79/69/1118077969.db2.gz NUQIKHOWSDQYTG-HLAWJBBLSA-N 2 0 372.553 4.160 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000540748033 1118231621 /nfs/dbraw/zinc/23/16/21/1118231621.db2.gz NWCVFWRBRLCMEX-XXBNENTESA-N 2 0 351.538 4.379 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@H]1C ZINC000463744323 1118311934 /nfs/dbraw/zinc/31/19/34/1118311934.db2.gz KJHDHKQYVPUFSI-SBHAEUEKSA-N 2 0 374.569 4.091 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000540988454 1118339573 /nfs/dbraw/zinc/33/95/73/1118339573.db2.gz LLWSMKWGBKXXDS-IFMALSPDSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc2c(s1)CCC2 ZINC000540990771 1118341002 /nfs/dbraw/zinc/34/10/02/1118341002.db2.gz RRLGANRYPHADLG-UZLBHIALSA-N 2 0 370.562 4.044 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000540992653 1118342121 /nfs/dbraw/zinc/34/21/21/1118342121.db2.gz YKFAZUAXIMTTOE-NJNPRVFISA-N 2 0 365.521 4.206 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000541215500 1118430918 /nfs/dbraw/zinc/43/09/18/1118430918.db2.gz DVNKLMSHNCLXKQ-SJBKTWHCSA-N 2 0 368.569 4.285 20 0 FIADRP Brc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000541223478 1118435017 /nfs/dbraw/zinc/43/50/17/1118435017.db2.gz VMMWGFRCINSQOG-IBGZPJMESA-N 2 0 363.343 4.433 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000541564055 1118556142 /nfs/dbraw/zinc/55/61/42/1118556142.db2.gz CMXXJNCYMVLDDB-QHCPKHFHSA-N 2 0 361.464 4.315 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCc3c(Cl)cccc32)cc1 ZINC000541746144 1118624731 /nfs/dbraw/zinc/62/47/31/1118624731.db2.gz FPGFIAXYADFUNB-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP c1ccc2c(c1)-c1ccccc1C2[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000174238749 1119104219 /nfs/dbraw/zinc/10/42/19/1119104219.db2.gz FYQNRIOZYVGGCQ-UHFFFAOYSA-N 2 0 362.517 4.333 20 0 FIADRP CN1CCC([NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000177206143 1119317081 /nfs/dbraw/zinc/31/70/81/1119317081.db2.gz RYZDGFCLOFAJOP-UHFFFAOYSA-N 2 0 363.549 4.133 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2ccc(O)cc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311491844 1119376972 /nfs/dbraw/zinc/37/69/72/1119376972.db2.gz CFPPSZIMPIFVME-NYDSKATKSA-N 2 0 350.506 4.270 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1cccc(OCc2ccccc2)c1 ZINC000311523623 1119378604 /nfs/dbraw/zinc/37/86/04/1119378604.db2.gz PVANYEVAEPVTDF-PWHSHALESA-N 2 0 352.522 4.126 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1ccc(OCc2ccccc2)cc1 ZINC000311821916 1119390407 /nfs/dbraw/zinc/39/04/07/1119390407.db2.gz QOIJKFPAGQKHEI-SELNLUPBSA-N 2 0 352.522 4.126 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311863742 1119392753 /nfs/dbraw/zinc/39/27/53/1119392753.db2.gz VOPDMBSJSLOOHB-KSEOMHKRSA-N 2 0 356.554 4.369 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493923713 1119509960 /nfs/dbraw/zinc/50/99/60/1119509960.db2.gz DKJNDPWZBOCARB-XYQBIQKZSA-N 2 0 351.332 4.158 20 0 FIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000493945733 1119513738 /nfs/dbraw/zinc/51/37/38/1119513738.db2.gz TZXPHCBTTXTHRW-WMZHIEFXSA-N 2 0 352.522 4.059 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000183794954 1119583875 /nfs/dbraw/zinc/58/38/75/1119583875.db2.gz YCOSMEKQWLEQIC-GOSISDBHSA-N 2 0 363.299 4.063 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000186574157 1119737075 /nfs/dbraw/zinc/73/70/75/1119737075.db2.gz STIFEHJBHNKHCK-WOJBJXKFSA-N 2 0 367.537 4.156 20 0 FIADRP CC[C@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000186599204 1119738804 /nfs/dbraw/zinc/73/88/04/1119738804.db2.gz QCEKZWNDNSWLNW-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)[C@@H]3CCC[NH+]3C3CCCC3)c2C1 ZINC000494504867 1119871934 /nfs/dbraw/zinc/87/19/34/1119871934.db2.gz CZFOQEYWAHXNDJ-NRFANRHFSA-N 2 0 355.526 4.004 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542485085 1119902369 /nfs/dbraw/zinc/90/23/69/1119902369.db2.gz IELMXIDFAXVDLV-QRWLVFNGSA-N 2 0 370.884 4.095 20 0 FIADRP CC1(C)CC([NH2+][C@@H]2CCc3c2cccc3Br)CC(C)(C)[NH2+]1 ZINC000223016769 1119928965 /nfs/dbraw/zinc/92/89/65/1119928965.db2.gz SKYSZEGWPFGMAX-MRXNPFEDSA-N 2 0 351.332 4.335 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Cl)cs2)C[C@H](C)O1 ZINC000193031256 1120095763 /nfs/dbraw/zinc/09/57/63/1120095763.db2.gz JPBCDMIZXAYEGR-GJZGRUSLSA-N 2 0 364.942 4.301 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCCO2 ZINC000195133134 1120120288 /nfs/dbraw/zinc/12/02/88/1120120288.db2.gz DNRGUGFLOCQUIM-UGKGYDQZSA-N 2 0 366.505 4.021 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000195133651 1120120365 /nfs/dbraw/zinc/12/03/65/1120120365.db2.gz ZYHVIROFDURBMO-NQIIRXRSSA-N 2 0 368.546 4.344 20 0 FIADRP C[N@H+](CCCOCc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000542508523 1120289721 /nfs/dbraw/zinc/28/97/21/1120289721.db2.gz VWXAAYGKBVEDJD-QHCPKHFHSA-N 2 0 352.522 4.047 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494916440 1120369351 /nfs/dbraw/zinc/36/93/51/1120369351.db2.gz IGHNLULHMGKCEP-KNQAVFIVSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cc(Cl)cs3)CC2)C[C@H](C)O1 ZINC000494985349 1120411096 /nfs/dbraw/zinc/41/10/96/1120411096.db2.gz JJEUPVFNFKHPAU-GJZGRUSLSA-N 2 0 356.963 4.113 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc(OC(F)(F)F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542533267 1120430535 /nfs/dbraw/zinc/43/05/35/1120430535.db2.gz KXLAJIIEBCQYKG-NVXWUHKLSA-N 2 0 370.459 4.370 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)C1CCCC1 ZINC000495076343 1120459724 /nfs/dbraw/zinc/45/97/24/1120459724.db2.gz ZFHHEMBUIWYDRW-AUSIDOKSSA-N 2 0 356.554 4.317 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@H]3O)CC1)CCS2 ZINC000250103073 1120475857 /nfs/dbraw/zinc/47/58/57/1120475857.db2.gz RRSYBIGFBYGNEY-NJDAHSKKSA-N 2 0 374.594 4.198 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000495434249 1120808861 /nfs/dbraw/zinc/80/88/61/1120808861.db2.gz REDPQJITYKWERW-JTAQYXEDSA-N 2 0 374.532 4.434 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000495438869 1120824536 /nfs/dbraw/zinc/82/45/36/1120824536.db2.gz JDVARZFWOKBHOZ-KFKAGJAMSA-N 2 0 355.551 4.329 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(C)cc2)CC1 ZINC000236981091 1120972056 /nfs/dbraw/zinc/97/20/56/1120972056.db2.gz XBCFJGXRIWTLNW-GOSISDBHSA-N 2 0 355.501 4.127 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000237075934 1120973137 /nfs/dbraw/zinc/97/31/37/1120973137.db2.gz NVKHEKJEOARNTI-OAQYLSRUSA-N 2 0 374.532 4.030 20 0 FIADRP Clc1ccc(OCc2cccnc2)c(CNCCC[NH+]2CCCCC2)c1 ZINC000237762892 1120983568 /nfs/dbraw/zinc/98/35/68/1120983568.db2.gz NIDJJRGLWCRAAI-UHFFFAOYSA-N 2 0 373.928 4.280 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1ccc(C)c(F)c1 ZINC000028899144 1121026266 /nfs/dbraw/zinc/02/62/66/1121026266.db2.gz ZRVDCLDZRJKRFQ-KRWDZBQOSA-N 2 0 371.500 4.093 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2CC(F)(F)F)[C@H](C)C1 ZINC000624307313 1121152206 /nfs/dbraw/zinc/15/22/06/1121152206.db2.gz GXOQQTMDQNXYKJ-APWZRJJASA-N 2 0 372.475 4.018 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1csc(Cl)c1 ZINC000397636146 1121256576 /nfs/dbraw/zinc/25/65/76/1121256576.db2.gz PXHHIMNYRUYTAA-OAHLLOKOSA-N 2 0 364.942 4.079 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000061070952 1121507052 /nfs/dbraw/zinc/50/70/52/1121507052.db2.gz NCIAPQUSCPCQRW-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000108428099 1121542046 /nfs/dbraw/zinc/54/20/46/1121542046.db2.gz HVPHRVZUZFMAKK-KRWDZBQOSA-N 2 0 366.534 4.032 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cnn1-c1ccc(F)cc1 ZINC000123726844 1121627270 /nfs/dbraw/zinc/62/72/70/1121627270.db2.gz VNYJZRYIAFCUBJ-INIZCTEOSA-N 2 0 366.484 4.232 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000123945182 1121647914 /nfs/dbraw/zinc/64/79/14/1121647914.db2.gz USLHCEJUDKOFSP-SFHVURJKSA-N 2 0 362.521 4.483 20 0 FIADRP Cc1nccn1CCCCN1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000125497602 1121785776 /nfs/dbraw/zinc/78/57/76/1121785776.db2.gz VHOVMCHQRJKWMR-SFHVURJKSA-N 2 0 368.308 4.352 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C[C@H]4CC45CCOCC5)[C@H]3C2)cc1 ZINC000671761458 1121790928 /nfs/dbraw/zinc/79/09/28/1121790928.db2.gz VDZKCPJRRYHFBK-BJESRGMDSA-N 2 0 368.565 4.084 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)s1 ZINC000671764914 1121814995 /nfs/dbraw/zinc/81/49/95/1121814995.db2.gz UYKYVFXNUGVICK-ZIAGYGMSSA-N 2 0 369.372 4.149 20 0 FIADRP CC(C)[N@H+](C)CC1CCN(C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC1 ZINC000073079538 1121919036 /nfs/dbraw/zinc/91/90/36/1121919036.db2.gz NOWVCXXLPCAASV-UHFFFAOYSA-N 2 0 366.509 4.018 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccs1 ZINC000126698094 1121977430 /nfs/dbraw/zinc/97/74/30/1121977430.db2.gz NNCITXPPZHQSSR-CRAIPNDOSA-N 2 0 361.530 4.441 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126702966 1121978869 /nfs/dbraw/zinc/97/88/69/1121978869.db2.gz XEJQCRCDKYLYEF-JKSUJKDBSA-N 2 0 361.530 4.359 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126727658 1121981412 /nfs/dbraw/zinc/98/14/12/1121981412.db2.gz UWELNGOMBYLGGA-HNAYVOBHSA-N 2 0 373.541 4.367 20 0 FIADRP Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000126762464 1121984617 /nfs/dbraw/zinc/98/46/17/1121984617.db2.gz PNJMXWJPXFJYEV-MSOLQXFVSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)c(F)c3)cc2)C1 ZINC000917008506 1122001062 /nfs/dbraw/zinc/00/10/62/1122001062.db2.gz KUSABSRGESQXPO-AOMKIAJQSA-N 2 0 374.475 4.020 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000127329170 1122079219 /nfs/dbraw/zinc/07/92/19/1122079219.db2.gz HOIFANMSLUSUCM-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000066960834 1122116035 /nfs/dbraw/zinc/11/60/35/1122116035.db2.gz RUAKTPNBOHTJSF-HXUWFJFHSA-N 2 0 373.585 4.383 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2cccs2)cc1 ZINC000128264950 1122217464 /nfs/dbraw/zinc/21/74/64/1122217464.db2.gz OBEHRJARWVUNJT-GOSISDBHSA-N 2 0 357.567 4.093 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497867174 1122453372 /nfs/dbraw/zinc/45/33/72/1122453372.db2.gz INCDKBFVPDUZLO-DYESRHJHSA-N 2 0 357.542 4.136 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@H](C[NH+]2CCCC2)c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556053495 1122625665 /nfs/dbraw/zinc/62/56/65/1122625665.db2.gz TVUPZEYJAALGKY-RBZQAINGSA-N 2 0 363.549 4.249 20 0 FIADRP CN1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)cc3)C2)C[C@@H]1c1ccccc1 ZINC000556131838 1122678310 /nfs/dbraw/zinc/67/83/10/1122678310.db2.gz XPFRXZPGHLNBNT-JAXLGGSGSA-N 2 0 369.940 4.344 20 0 FIADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230722 1122757274 /nfs/dbraw/zinc/75/72/74/1122757274.db2.gz ANFIPZXFMCDWRS-DNVJHFABSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H](CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[NH+]1CCCCC1 ZINC000556261206 1122770626 /nfs/dbraw/zinc/77/06/26/1122770626.db2.gz JRDSTMNVEXUANG-RBKXMNCYSA-N 3 0 357.586 4.284 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498805384 1123023179 /nfs/dbraw/zinc/02/31/79/1123023179.db2.gz KFLXBFBOSXHYAY-MDNUFGMLSA-N 2 0 372.528 4.119 20 0 FIADRP C[NH2+]C1CCC([N@H+](C)Cc2c(Br)ccc(C)c2Cl)CC1 ZINC001236216327 1123069777 /nfs/dbraw/zinc/06/97/77/1123069777.db2.gz YTJABYFOLJVWGJ-UHFFFAOYSA-N 2 0 359.739 4.373 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000556885073 1123162431 /nfs/dbraw/zinc/16/24/31/1123162431.db2.gz UMGSWSROJXUZRS-UHFFFAOYSA-N 2 0 363.549 4.311 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000556890649 1123176645 /nfs/dbraw/zinc/17/66/45/1123176645.db2.gz UHIPXBWEDYWPHA-KRWDZBQOSA-N 2 0 356.432 4.358 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]CCC(=O)Nc2ccccc2)cc1 ZINC000556926413 1123228471 /nfs/dbraw/zinc/22/84/71/1123228471.db2.gz LCSAEDILSBQQJH-LJQANCHMSA-N 2 0 365.521 4.179 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1ccc(C)cc1F ZINC000073737090 1123242447 /nfs/dbraw/zinc/24/24/47/1123242447.db2.gz GPOBPWVSAULWOR-KRWDZBQOSA-N 2 0 371.500 4.093 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)cc1 ZINC000132501342 1123273894 /nfs/dbraw/zinc/27/38/94/1123273894.db2.gz XCHKSSNQEXYBCN-WIYYLYMNSA-N 2 0 363.615 4.110 20 0 FIADRP CCOc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499138058 1123279556 /nfs/dbraw/zinc/27/95/56/1123279556.db2.gz BSNZRCCHNDHVIG-KOUNCHBCSA-N 2 0 350.506 4.371 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499138845 1123280821 /nfs/dbraw/zinc/28/08/21/1123280821.db2.gz JOWDFWCAYNVKNS-TWDDROGUSA-N 3 0 369.597 4.426 20 0 FIADRP C[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCC[C@H]1C ZINC000499148768 1123293424 /nfs/dbraw/zinc/29/34/24/1123293424.db2.gz DOJJNUPSXXVEJD-WMAOBNEYSA-N 2 0 355.570 4.035 20 0 FIADRP CC(C)[NH+](CCCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000499237449 1123349552 /nfs/dbraw/zinc/34/95/52/1123349552.db2.gz MZOIJGFTXIAOKN-NUNAXRQHSA-N 2 0 357.586 4.281 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc(C)c1F ZINC000132828774 1123365887 /nfs/dbraw/zinc/36/58/87/1123365887.db2.gz WGFXYOAVLRGDIN-SFHVURJKSA-N 2 0 370.512 4.250 20 0 FIADRP Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000920179401 1123396466 /nfs/dbraw/zinc/39/64/66/1123396466.db2.gz FJKMZEOZQREZOC-UHFFFAOYSA-N 2 0 374.960 4.436 20 0 FIADRP c1ccc(COc2cccc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)c2)cc1 ZINC000245618307 1124145282 /nfs/dbraw/zinc/14/52/82/1124145282.db2.gz VZJVCWSIMCLKNG-YADHBBJMSA-N 2 0 350.506 4.025 20 0 FIADRP CC[NH+](CC)Cc1cccc(N[C@@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000245651650 1124167811 /nfs/dbraw/zinc/16/78/11/1124167811.db2.gz BHXQWEUJMWDECT-AUSIDOKSSA-N 2 0 366.553 4.246 20 0 FIADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245655387 1124170470 /nfs/dbraw/zinc/17/04/70/1124170470.db2.gz DIPBLBRGIQDEHT-HPAIXVDQSA-N 2 0 356.554 4.223 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000245677435 1124187132 /nfs/dbraw/zinc/18/71/32/1124187132.db2.gz IGNLUJIJNRJWKI-XBYSBRQOSA-N 2 0 355.570 4.036 20 0 FIADRP C[NH+](C)[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245765566 1124244411 /nfs/dbraw/zinc/24/44/11/1124244411.db2.gz WHPKHKIYVVWLNO-UEQSERJNSA-N 2 0 363.549 4.075 20 0 FIADRP c1cnn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245777226 1124247558 /nfs/dbraw/zinc/24/75/58/1124247558.db2.gz YINVJLKHYSORAP-MFKCLSPESA-N 2 0 364.537 4.152 20 0 FIADRP c1cnn([C@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245777235 1124247709 /nfs/dbraw/zinc/24/77/09/1124247709.db2.gz YINVJLKHYSORAP-SPHOGXRMSA-N 2 0 364.537 4.152 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000245925165 1124285702 /nfs/dbraw/zinc/28/57/02/1124285702.db2.gz HNHVQMAEGIZBKO-JOCHJYFZSA-N 2 0 371.956 4.047 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)CCO1 ZINC000245942066 1124293732 /nfs/dbraw/zinc/29/37/32/1124293732.db2.gz JXXSDKJJJJQIHW-ZNLUXHQJSA-N 2 0 362.558 4.261 20 0 FIADRP CN1CC[C@H]([NH2+]CCCOCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000518575425 1124370049 /nfs/dbraw/zinc/37/00/49/1124370049.db2.gz WCZLWLYQOHCVPH-GOTSBHOMSA-N 2 0 352.522 4.061 20 0 FIADRP CCCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1 ZINC000542846113 1124442914 /nfs/dbraw/zinc/44/29/14/1124442914.db2.gz JWAVGAPXJVDRGJ-PKTZIBPZSA-N 2 0 352.522 4.274 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1 ZINC000246586811 1124537760 /nfs/dbraw/zinc/53/77/60/1124537760.db2.gz ZCWIYFCUWCZROR-SLFFLAALSA-N 2 0 350.934 4.149 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)c1ccc(OCC[NH+](C)C)cc1 ZINC000246993411 1124579693 /nfs/dbraw/zinc/57/96/93/1124579693.db2.gz KYLRQJPRYWOAEC-CDNPAEQRSA-N 2 0 368.521 4.198 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cc(F)c(Cl)cc1Cl ZINC000247133605 1124593229 /nfs/dbraw/zinc/59/32/29/1124593229.db2.gz AURQHWGWENRWIS-STQMWFEESA-N 2 0 363.304 4.020 20 0 FIADRP Cc1cccc([C@H]2CCCN2CCC[N@H+]2CCC[C@H]2c2cccc(C)n2)n1 ZINC000140296108 1124594616 /nfs/dbraw/zinc/59/46/16/1124594616.db2.gz SUAYZNDOVMSQPE-ZRZAMGCNSA-N 2 0 364.537 4.458 20 0 FIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)s1 ZINC000247154306 1124594941 /nfs/dbraw/zinc/59/49/41/1124594941.db2.gz TVZQKTXFRJWNLF-JYJNAYRXSA-N 2 0 373.566 4.220 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnn(C)c1 ZINC000247199211 1124597890 /nfs/dbraw/zinc/59/78/90/1124597890.db2.gz WFECUXAYCSEDAR-HMFYCAOWSA-N 2 0 354.542 4.139 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC(F)F)cc2)[C@H](C)C1 ZINC000248031053 1124739187 /nfs/dbraw/zinc/73/91/87/1124739187.db2.gz QJHQVTASKQNDPP-MDZRGWNJSA-N 2 0 370.484 4.076 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCOC5(CCCC5)C4)[C@@H]3C2)cc1 ZINC000248394682 1124760688 /nfs/dbraw/zinc/76/06/88/1124760688.db2.gz FSSFORPZGSYMIX-GPJHCHHRSA-N 2 0 368.565 4.369 20 0 FIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000248433301 1124768063 /nfs/dbraw/zinc/76/80/63/1124768063.db2.gz DBWUQAFCDKHJIJ-FXAWDEMLSA-N 2 0 364.489 4.159 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc2ccccc21 ZINC000248437159 1124768184 /nfs/dbraw/zinc/76/81/84/1124768184.db2.gz GWTAOGLTLTXCNI-PGRDOPGGSA-N 2 0 360.501 4.257 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc2ccccc2o1 ZINC000248445933 1124769511 /nfs/dbraw/zinc/76/95/11/1124769511.db2.gz MSGKAGJRRVNJDQ-UWJYYQICSA-N 2 0 364.489 4.240 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1csc(Cl)c1 ZINC000248676012 1124800913 /nfs/dbraw/zinc/80/09/13/1124800913.db2.gz AEWWCYJONUAALL-KSSFIOAISA-N 2 0 364.942 4.209 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000249145008 1124846395 /nfs/dbraw/zinc/84/63/95/1124846395.db2.gz WQNGHFOKUFLRJR-ZWUBBELISA-N 2 0 356.554 4.082 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000249255953 1124852078 /nfs/dbraw/zinc/85/20/78/1124852078.db2.gz GNCKJSMCLYBNJU-IPMKNSEASA-N 2 0 354.460 4.262 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000089215712 1124891785 /nfs/dbraw/zinc/89/17/85/1124891785.db2.gz SACIWUPPQZAQRJ-HNNXBMFYSA-N 2 0 361.436 4.250 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCCc3nc4ccccc4n3C)CC2)C1 ZINC000090050958 1124979036 /nfs/dbraw/zinc/97/90/36/1124979036.db2.gz XPRAXXFPNWDNRM-QUCCMNQESA-N 2 0 368.569 4.139 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F ZINC000090523094 1125001662 /nfs/dbraw/zinc/00/16/62/1125001662.db2.gz FHMQJSWLOZRFBD-KYNGSXCRSA-N 2 0 370.459 4.124 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000091265998 1125059975 /nfs/dbraw/zinc/05/99/75/1125059975.db2.gz QHPQYXGFZFPDDR-AWEZNQCLSA-N 2 0 356.901 4.139 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccc(OC)c2)ccc1OC ZINC000182227287 1125301015 /nfs/dbraw/zinc/30/10/15/1125301015.db2.gz JBJOUIYKUZSBBS-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)cc1C[NH+]1CCCCC1 ZINC000182226644 1125301151 /nfs/dbraw/zinc/30/11/51/1125301151.db2.gz OCXQHBNVVZDCEW-MSOLQXFVSA-N 2 0 353.510 4.488 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(C)cc2C)CC1 ZINC000303294483 568265103 /nfs/dbraw/zinc/26/51/03/568265103.db2.gz OUXGSOPGOHIBRK-LJQANCHMSA-N 2 0 369.528 4.435 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2F)ccc1OC ZINC000182536902 1125555035 /nfs/dbraw/zinc/55/50/35/1125555035.db2.gz YTOVHCOMRKNPDW-IIBYNOLFSA-N 2 0 374.500 4.060 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2F)ccc1OC ZINC000182536870 1125555067 /nfs/dbraw/zinc/55/50/67/1125555067.db2.gz YTOVHCOMRKNPDW-IERDGZPVSA-N 2 0 374.500 4.060 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H](O)c2cccc(F)c2)ccc1OC ZINC000182629007 1125589116 /nfs/dbraw/zinc/58/91/16/1125589116.db2.gz PBXNCPGHCPGKAN-IERDGZPVSA-N 2 0 374.500 4.060 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCC(C)(C)CO)cc1C[NH+]1CCCCC1 ZINC000183015970 1125720838 /nfs/dbraw/zinc/72/08/38/1125720838.db2.gz YBIGPGXFAKPYMC-SFHVURJKSA-N 2 0 362.558 4.130 20 0 FIADRP CCC[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccn1 ZINC000179464953 1080181310 /nfs/dbraw/zinc/18/13/10/1080181310.db2.gz XIFKRVSJLINKCC-QFIPXVFZSA-N 2 0 366.553 4.115 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccccc3-c3cnn(C)c3)CC2)C1 ZINC000537947871 1080242046 /nfs/dbraw/zinc/24/20/46/1080242046.db2.gz MLGZVFWCUARZFS-PGRDOPGGSA-N 2 0 366.553 4.220 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000547754487 1080422512 /nfs/dbraw/zinc/42/25/12/1080422512.db2.gz OJRCFBCCRAKJOI-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180119292 1080450508 /nfs/dbraw/zinc/45/05/08/1080450508.db2.gz JWTKLXRRLNNOTM-AVRDEDQJSA-N 2 0 371.956 4.045 20 0 FIADRP CC(C)[C@@H](CN[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC001648791883 1080495203 /nfs/dbraw/zinc/49/52/03/1080495203.db2.gz CQSHYYJQVCOPJW-YMPZKCBVSA-N 2 0 357.586 4.168 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cnn(C4CCC4)c3)cc2)C1 ZINC001648792076 1080503477 /nfs/dbraw/zinc/50/34/77/1080503477.db2.gz HJZDVMSTSQJZGQ-GOSISDBHSA-N 2 0 352.526 4.130 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC000180711471 1080541600 /nfs/dbraw/zinc/54/16/00/1080541600.db2.gz VHVOOTYAKNJGRZ-DEOSSOPVSA-N 2 0 365.565 4.008 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CCCO1 ZINC000683344007 1080684250 /nfs/dbraw/zinc/68/42/50/1080684250.db2.gz HUSHQSQKCBPJBB-FQEVSTJZSA-N 2 0 367.537 4.045 20 0 FIADRP CCOc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)n1 ZINC001648795673 1080804950 /nfs/dbraw/zinc/80/49/50/1080804950.db2.gz UKZHYDFNEADZOR-SFHVURJKSA-N 2 0 353.510 4.145 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC001648804660 1080995761 /nfs/dbraw/zinc/99/57/61/1080995761.db2.gz BWGIDCSGIGSEEA-UHFFFAOYSA-N 2 0 354.523 4.064 20 0 FIADRP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000683523461 1081048005 /nfs/dbraw/zinc/04/80/05/1081048005.db2.gz KXIBFYYOOVVHIK-OAQYLSRUSA-N 2 0 369.578 4.015 20 0 FIADRP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000683523459 1081048131 /nfs/dbraw/zinc/04/81/31/1081048131.db2.gz KXIBFYYOOVVHIK-NRFANRHFSA-N 2 0 369.578 4.015 20 0 FIADRP [NH3+][C@@H](CCC(=O)Nc1cccc(C[NH+]2CCCCC2)c1)c1ccccc1 ZINC000237958782 1081074623 /nfs/dbraw/zinc/07/46/23/1081074623.db2.gz POYIWOKKOUTOKE-NRFANRHFSA-N 2 0 351.494 4.091 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2cccc3c[nH]nc32)C1 ZINC001648808359 1081112071 /nfs/dbraw/zinc/11/20/71/1081112071.db2.gz MEOWCRHFKBSXRW-QZTJIDSGSA-N 2 0 362.521 4.331 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2N)C1 ZINC001648808572 1081112951 /nfs/dbraw/zinc/11/29/51/1081112951.db2.gz UWQDGHVJKAMTSG-IAGOWNOFSA-N 2 0 355.501 4.176 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000655804955 1081211471 /nfs/dbraw/zinc/21/14/71/1081211471.db2.gz GYXJCRWGYLPMNA-YTJPUZGESA-N 2 0 363.480 4.393 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000121777660 1081252537 /nfs/dbraw/zinc/25/25/37/1081252537.db2.gz IVHTXDGTXJUWKK-KRWDZBQOSA-N 2 0 369.553 4.483 20 0 FIADRP Cc1cc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)c(C)s1 ZINC001648830143 1081267643 /nfs/dbraw/zinc/26/76/43/1081267643.db2.gz JJZCZLHVHGSFSA-UHFFFAOYSA-N 2 0 371.594 4.053 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)N[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[NH+](C)C ZINC000579986269 1081371490 /nfs/dbraw/zinc/37/14/90/1081371490.db2.gz XNFHXIZNXJDNHG-SJROBZAFSA-N 2 0 365.565 4.411 20 0 FIADRP C[C@H](O)[C@H]1CCCC[N@@H+]1C[C@@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167337094 1081470141 /nfs/dbraw/zinc/47/01/41/1081470141.db2.gz GZGCQRXXCLRXHP-TUACAJSNSA-N 2 0 366.549 4.138 20 0 FIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000537956462 1081504278 /nfs/dbraw/zinc/50/42/78/1081504278.db2.gz RQIRBZVHWMPONH-XUVXKRRUSA-N 2 0 350.934 4.149 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](C(=O)c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000656127336 1081715604 /nfs/dbraw/zinc/71/56/04/1081715604.db2.gz ZIGIYZQFVPJRMK-TVTNDZMWSA-N 2 0 361.489 4.022 20 0 FIADRP CC[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000580373564 1081906648 /nfs/dbraw/zinc/90/66/48/1081906648.db2.gz CILUNRLISXDFAS-IBGZPJMESA-N 2 0 361.917 4.306 20 0 FIADRP CCN(C(=O)c1ccc([C@H](C)[NH3+])cc1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000580442650 1081948907 /nfs/dbraw/zinc/94/89/07/1081948907.db2.gz KWHXTBRCXLIVIB-NJNPRVFISA-N 2 0 365.521 4.004 20 0 FIADRP CCN(C(=O)c1ccc([C@H](C)[NH3+])cc1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000580442653 1081949061 /nfs/dbraw/zinc/94/90/61/1081949061.db2.gz KWHXTBRCXLIVIB-SVMVAKDDSA-N 2 0 365.521 4.004 20 0 FIADRP CCN(C(=O)c1ccc([C@H](C)[NH3+])cc1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000580442651 1081949156 /nfs/dbraw/zinc/94/91/56/1081949156.db2.gz KWHXTBRCXLIVIB-NPPFBWRTSA-N 2 0 365.521 4.004 20 0 FIADRP CCCO[C@@H]1CCC[NH+](C/C=C/C[N@H+]2CCC[C@@H](OCCC)CC2)CC1 ZINC000247274689 1082013995 /nfs/dbraw/zinc/01/39/95/1082013995.db2.gz YJVXXAKTHGWQHL-QDWIBDRMSA-N 2 0 366.590 4.105 20 0 FIADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 ZINC000580570537 1082022050 /nfs/dbraw/zinc/02/20/50/1082022050.db2.gz BXOZNOQPCRZLDB-LSDHHAIUSA-N 2 0 365.399 4.252 20 0 FIADRP [NH3+]CCC1CC[NH+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000580837908 1082182140 /nfs/dbraw/zinc/18/21/40/1082182140.db2.gz YWXMYTQCSLYDNG-UHFFFAOYSA-N 2 0 371.912 4.153 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCc2c(Cl)cccc21 ZINC000580857167 1082191451 /nfs/dbraw/zinc/19/14/51/1082191451.db2.gz YMCYEONSFZURCF-FQEVSTJZSA-N 2 0 373.928 4.233 20 0 FIADRP CC[N@H+](Cc1c[nH]nc1-c1ccsc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000580979401 1082264908 /nfs/dbraw/zinc/26/49/08/1082264908.db2.gz QNLVTURXCAIXIG-UHFFFAOYSA-N 2 0 354.523 4.222 20 0 FIADRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1OCC ZINC000581100616 1082313056 /nfs/dbraw/zinc/31/30/56/1082313056.db2.gz WBEMAOAJCVORKP-HXUWFJFHSA-N 2 0 360.542 4.038 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000656677785 1082711958 /nfs/dbraw/zinc/71/19/58/1082711958.db2.gz PYHRYJGZVSSAFJ-AWEZNQCLSA-N 2 0 354.897 4.021 20 0 FIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000656683161 1082713079 /nfs/dbraw/zinc/71/30/79/1082713079.db2.gz ILHLDSWJOBRLOJ-OAQYLSRUSA-N 2 0 355.913 4.224 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656784799 1082768897 /nfs/dbraw/zinc/76/88/97/1082768897.db2.gz HKVXFFYLXNBHAW-HXUWFJFHSA-N 2 0 353.485 4.099 20 0 FIADRP COc1cc(F)c(F)cc1C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001143400076 1082946270 /nfs/dbraw/zinc/94/62/70/1082946270.db2.gz MBNIUHGTWLJXMH-UHFFFAOYSA-N 2 0 372.459 4.071 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000647192123 1082976454 /nfs/dbraw/zinc/97/64/54/1082976454.db2.gz QVLLUDPBOSKWRD-NHCUHLMSSA-N 2 0 356.554 4.369 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc1Br ZINC000131798915 1083136973 /nfs/dbraw/zinc/13/69/73/1083136973.db2.gz ZAKRPZLZBIZNFW-OHRKKDJYSA-N 2 0 367.331 4.124 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000510800371 1083317212 /nfs/dbraw/zinc/31/72/12/1083317212.db2.gz ZAYPGAARTVBCHX-KRWDZBQOSA-N 2 0 372.940 4.478 20 0 FIADRP CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000658288436 1083394622 /nfs/dbraw/zinc/39/46/22/1083394622.db2.gz PHUYPAQOMKQNKC-OFAXGOBFSA-N 2 0 370.537 4.036 20 0 FIADRP C[C@@H](c1ccccc1)[C@H](O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000658339392 1083415045 /nfs/dbraw/zinc/41/50/45/1083415045.db2.gz JTTDAQOBKHZTMN-OIULLBJASA-N 2 0 366.549 4.184 20 0 FIADRP c1csc([C@H](Cc2ccncc2)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000658352705 1083424183 /nfs/dbraw/zinc/42/41/83/1083424183.db2.gz IBTAHEDZTZRYFT-FQEVSTJZSA-N 2 0 355.551 4.139 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000581995697 1083443614 /nfs/dbraw/zinc/44/36/14/1083443614.db2.gz WFKGUMYLWPNVGQ-DEOSSOPVSA-N 2 0 363.549 4.311 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000192818096 1083512773 /nfs/dbraw/zinc/51/27/73/1083512773.db2.gz AFPDVHQWVQENHK-QFIPXVFZSA-N 2 0 353.510 4.054 20 0 FIADRP COc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000535680182 1083573119 /nfs/dbraw/zinc/57/31/19/1083573119.db2.gz LCMMZKKOXFHLJH-UHFFFAOYSA-N 2 0 350.506 4.183 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000535813153 1083685234 /nfs/dbraw/zinc/68/52/34/1083685234.db2.gz ILSPWZADECFWNZ-UHFFFAOYSA-N 2 0 360.933 4.282 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCC[NH+](C)C2CCCCC2)cc1)C(C)C ZINC000511353650 1083869162 /nfs/dbraw/zinc/86/91/62/1083869162.db2.gz ONQVPRDORVRQMS-UHFFFAOYSA-N 2 0 373.585 4.301 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000181318829 1083871568 /nfs/dbraw/zinc/87/15/68/1083871568.db2.gz DEOKKHRSLAODOL-HRAATJIYSA-N 2 0 372.484 4.331 20 0 FIADRP Cc1nccn1CCC[NH2+][C@H](C)c1cc2cc(Br)ccc2o1 ZINC000510994365 1084016741 /nfs/dbraw/zinc/01/67/41/1084016741.db2.gz HVUGCLGJLXLMIL-GFCCVEGCSA-N 2 0 362.271 4.441 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c1 ZINC000657297396 1084302513 /nfs/dbraw/zinc/30/25/13/1084302513.db2.gz CCECYUINVZXDAQ-UHFFFAOYSA-N 2 0 358.551 4.416 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000657307228 1084369704 /nfs/dbraw/zinc/36/97/04/1084369704.db2.gz DIOHBKBVNYJRHG-UHFFFAOYSA-N 2 0 356.485 4.497 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@@H]3CCCC[NH+]3C)cc2)C1 ZINC000431755844 1084409295 /nfs/dbraw/zinc/40/92/95/1084409295.db2.gz DWRSWJJOIHACBY-NQIIRXRSSA-N 2 0 357.542 4.122 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@H]3CCCC[NH+]3C)cc2)C1 ZINC000431755842 1084409950 /nfs/dbraw/zinc/40/99/50/1084409950.db2.gz DWRSWJJOIHACBY-GHTZIAJQSA-N 2 0 357.542 4.122 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@@H](C)CCN3CC[NH+](C)CC3)cc2)c1 ZINC000472127777 1084426130 /nfs/dbraw/zinc/42/61/30/1084426130.db2.gz IRGMZNIHONBPSP-NRFANRHFSA-N 2 0 365.565 4.086 20 0 FIADRP COc1ccc(C[NH+](C)C)cc1N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582029660 1084483251 /nfs/dbraw/zinc/48/32/51/1084483251.db2.gz GDWWGUANAKGSNB-GHTZIAJQSA-N 2 0 367.537 4.079 20 0 FIADRP COc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(Br)c1 ZINC000582089347 1084602385 /nfs/dbraw/zinc/60/23/85/1084602385.db2.gz BCMUZUPCZAWAPJ-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP Clc1cccc([C@H]2CC[C@@H]([NH2+]CC3(N4CCCC4)CCOCC3)C2)c1 ZINC000414124190 1084627452 /nfs/dbraw/zinc/62/74/52/1084627452.db2.gz PFJNXIAUQOBHIJ-AZUAARDMSA-N 2 0 362.945 4.211 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000472165655 1084635015 /nfs/dbraw/zinc/63/50/15/1084635015.db2.gz QTRJNELAMIOJTQ-INIZCTEOSA-N 2 0 360.523 4.082 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](CNCc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC000657348227 1084669892 /nfs/dbraw/zinc/66/98/92/1084669892.db2.gz OMNZWSWXIWVCRA-SFHVURJKSA-N 2 0 357.473 4.223 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)ccc2OC(F)F)c1 ZINC000657347704 1084674294 /nfs/dbraw/zinc/67/42/94/1084674294.db2.gz FIXDTMNDSLBVJX-UHFFFAOYSA-N 2 0 352.400 4.169 20 0 FIADRP CC[C@H]([NH2+]C1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@@H]1CC1(C)C ZINC000414143282 1084687734 /nfs/dbraw/zinc/68/77/34/1084687734.db2.gz IQESQNYGSMERGJ-SFTDATJTSA-N 2 0 357.542 4.024 20 0 FIADRP CSC1(C[NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH+](C)CC1 ZINC000414142612 1084691411 /nfs/dbraw/zinc/69/14/11/1084691411.db2.gz IYWOJIBOPKBECP-AEFFLSMTSA-N 2 0 352.975 4.393 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CC1 ZINC000414162435 1084720983 /nfs/dbraw/zinc/72/09/83/1084720983.db2.gz DNDCDUYIVYFYFU-SFHVURJKSA-N 2 0 374.257 4.477 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OCC ZINC000171126927 1084774196 /nfs/dbraw/zinc/77/41/96/1084774196.db2.gz UMPWXEQKTTVTPE-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)C2)cc1 ZINC000684928077 1085195564 /nfs/dbraw/zinc/19/55/64/1085195564.db2.gz YQVCYVVFHVGJSS-WZYRSQIMSA-N 2 0 356.554 4.084 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000236870850 1085632593 /nfs/dbraw/zinc/63/25/93/1085632593.db2.gz OQENPMOBOWCHJH-KRWDZBQOSA-N 2 0 366.534 4.032 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCSc2ccc(OC)cc2)CC1 ZINC001204650427 1085685362 /nfs/dbraw/zinc/68/53/62/1085685362.db2.gz FSPCSYLHDLWCEA-UHFFFAOYSA-N 2 0 350.572 4.231 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)O1 ZINC000432229682 1085691250 /nfs/dbraw/zinc/69/12/50/1085691250.db2.gz TXCRPMJIDSNDOH-STQMWFEESA-N 2 0 363.304 4.112 20 0 FIADRP Cc1cc(C)cc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000657625981 1085715159 /nfs/dbraw/zinc/71/51/59/1085715159.db2.gz LJEYQWGHBFYNOD-UHFFFAOYSA-N 2 0 351.538 4.124 20 0 FIADRP COc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccccn2)cc1 ZINC000652202177 1085753425 /nfs/dbraw/zinc/75/34/25/1085753425.db2.gz BYNIYXCRKLWEFK-QFIPXVFZSA-N 2 0 353.510 4.035 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1 ZINC000432238223 1085928747 /nfs/dbraw/zinc/92/87/47/1085928747.db2.gz OLGJWCBHKNKPEP-UHFFFAOYSA-N 2 0 371.283 4.363 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)c1ccccc1Cl ZINC000582927144 1085929881 /nfs/dbraw/zinc/92/98/81/1085929881.db2.gz STEYOLCBUXAFST-WOUAJJJCSA-N 2 0 351.966 4.041 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2=CC[N@H+](C)CC2)C(C)C)c(Br)c1 ZINC000582993972 1086006112 /nfs/dbraw/zinc/00/61/12/1086006112.db2.gz CWFSHDPEIKTHGS-SFHVURJKSA-N 2 0 367.331 4.006 20 0 FIADRP COc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)cc1 ZINC001167647383 1086024586 /nfs/dbraw/zinc/02/45/86/1086024586.db2.gz MBWRTMSTDMLFLE-JTHBVZDNSA-N 2 0 350.506 4.182 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000583135295 1086257238 /nfs/dbraw/zinc/25/72/38/1086257238.db2.gz VMRCMQRPRCZVJV-OAHLLOKOSA-N 2 0 360.448 4.289 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC(C)(C)C(F)(F)F)c1ccccc1O2 ZINC000583476393 1086331563 /nfs/dbraw/zinc/33/15/63/1086331563.db2.gz PQCKCMJZCKCFBD-HNNXBMFYSA-N 2 0 356.432 4.153 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2OC(F)F)[C@H](C)C1 ZINC000583174403 1086350606 /nfs/dbraw/zinc/35/06/06/1086350606.db2.gz AWZXJHNAOQRLAK-ZDSWQNORSA-N 2 0 352.469 4.353 20 0 FIADRP COc1ccccc1-c1nc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cs1 ZINC000662290944 1086396848 /nfs/dbraw/zinc/39/68/48/1086396848.db2.gz AIVIGZZLLDDUBA-QGZVFWFLSA-N 2 0 371.550 4.030 20 0 FIADRP Clc1cccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)co2)c1 ZINC000662291196 1086396875 /nfs/dbraw/zinc/39/68/75/1086396875.db2.gz DFEDIOVOBVHVSZ-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662294419 1086399686 /nfs/dbraw/zinc/39/96/86/1086399686.db2.gz VXXXQKUTTHXZEF-YOEHRIQHSA-N 2 0 374.916 4.163 20 0 FIADRP COc1cccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000662295535 1086401154 /nfs/dbraw/zinc/40/11/54/1086401154.db2.gz UUTARTJBJBKJLD-GOSISDBHSA-N 2 0 371.550 4.030 20 0 FIADRP c1ccc(-c2nc3c(s2)C[N@H+](Cc2ccc4c(c2)C[NH2+]CC4)CC3)cc1 ZINC000662305193 1086404307 /nfs/dbraw/zinc/40/43/07/1086404307.db2.gz QDLMUVMWYCICDM-UHFFFAOYSA-N 2 0 361.514 4.014 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Br)s1 ZINC000663346893 1086447375 /nfs/dbraw/zinc/44/73/75/1086447375.db2.gz WTAVIWDJWHUEBS-JSGCOSHPSA-N 2 0 357.361 4.283 20 0 FIADRP Cc1nccc([C@@H]2CCC[N@H+](Cc3cccc(C[NH+]4CCCCC4)c3)C2)n1 ZINC000662504899 1086474368 /nfs/dbraw/zinc/47/43/68/1086474368.db2.gz HEVXDLUWURVTAP-JOCHJYFZSA-N 2 0 364.537 4.151 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cccc(Cl)c1 ZINC000583286081 1086523014 /nfs/dbraw/zinc/52/30/14/1086523014.db2.gz BSNJSNCFJKHFHT-LJQANCHMSA-N 2 0 361.917 4.306 20 0 FIADRP C[C@H](C[NH2+]C1CCN([C@@H]2CCOC2)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000657751326 1086561535 /nfs/dbraw/zinc/56/15/35/1086561535.db2.gz QBQHXJGERFKSMZ-PGRDOPGGSA-N 2 0 358.570 4.006 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COCc2ccncc2)C1 ZINC001167821044 1086582476 /nfs/dbraw/zinc/58/24/76/1086582476.db2.gz ACYRDDYXGDDIOA-MZYLBHOOSA-N 2 0 373.585 4.211 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCc2ccc(Br)cc2C1 ZINC001167824182 1086606113 /nfs/dbraw/zinc/60/61/13/1086606113.db2.gz CMZUEYTWSSBPDJ-HNNXBMFYSA-N 2 0 353.348 4.318 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(OCc2ccccc2F)CC1 ZINC001167826191 1086615826 /nfs/dbraw/zinc/61/58/26/1086615826.db2.gz ONAIHTHIGGFQJO-GOSISDBHSA-N 2 0 350.522 4.317 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001167827561 1086627432 /nfs/dbraw/zinc/62/74/32/1086627432.db2.gz XLRDUMNEFRRZAH-JOCHJYFZSA-N 3 0 371.613 4.485 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000643522340 1086632158 /nfs/dbraw/zinc/63/21/58/1086632158.db2.gz LUVPLDYMKTYSNW-ZYHUDNBSSA-N 2 0 365.237 4.261 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCc2ncnc(-c3ccccc3)c2CC1 ZINC001167828075 1086635978 /nfs/dbraw/zinc/63/59/78/1086635978.db2.gz VYQUYTBLCXGJJY-LJQANCHMSA-N 2 0 366.553 4.055 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@@H](C5CC5)C4)[C@@H]3C2)cc1 ZINC000583456813 1086700491 /nfs/dbraw/zinc/70/04/91/1086700491.db2.gz ZWMQYRXFGQDGHF-UDIRQSBCSA-N 2 0 368.565 4.224 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167837220 1086710900 /nfs/dbraw/zinc/71/09/00/1086710900.db2.gz JOROIKBTWYHZSS-OALUTQOASA-N 2 0 369.594 4.076 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001167837772 1086711787 /nfs/dbraw/zinc/71/17/87/1086711787.db2.gz MKQKQMZNWROWML-NRFANRHFSA-N 3 0 359.602 4.341 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2cccc(C(=O)OC)c2)CC1 ZINC001167840081 1086718958 /nfs/dbraw/zinc/71/89/58/1086718958.db2.gz DSGCVXCUCYUIHJ-GOSISDBHSA-N 2 0 360.542 4.163 20 0 FIADRP C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000127420963 1086720218 /nfs/dbraw/zinc/72/02/18/1086720218.db2.gz SSMWHEIVTMVQSZ-ICSRJNTNSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CCCO1 ZINC000432422558 1086747255 /nfs/dbraw/zinc/74/72/55/1086747255.db2.gz FUVMRCOJSCPNJG-CXAGYDPISA-N 2 0 357.325 4.071 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccccc2)c2ccccc2)CCCO1 ZINC000432438715 1086769492 /nfs/dbraw/zinc/76/94/92/1086769492.db2.gz BWWNYPGWLVSIHF-REWPJTCUSA-N 2 0 352.522 4.061 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCO1 ZINC000657771560 1086798890 /nfs/dbraw/zinc/79/88/90/1086798890.db2.gz CXZHKLKPOZPGPO-VSKRKVRLSA-N 2 0 356.554 4.082 20 0 FIADRP CCc1nc(CNC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cs1 ZINC000657771736 1086801881 /nfs/dbraw/zinc/80/18/81/1086801881.db2.gz NKAUQILSFCQVIZ-GOSISDBHSA-N 2 0 355.551 4.097 20 0 FIADRP CC(C)Oc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000382383442 1086890948 /nfs/dbraw/zinc/89/09/48/1086890948.db2.gz RYGONTZBJOJNTF-QFIPXVFZSA-N 2 0 352.522 4.476 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CCC2(C[NH3+])CC2)c2ccc(F)c(F)c2)c1 ZINC000650745324 1086927913 /nfs/dbraw/zinc/92/79/13/1086927913.db2.gz DJCSRHFSAASFRF-LJQANCHMSA-N 2 0 362.489 4.495 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650753462 1086956238 /nfs/dbraw/zinc/95/62/38/1086956238.db2.gz NPKFPKDHERJFEV-CQSZACIVSA-N 2 0 369.509 4.491 20 0 FIADRP CC[C@H](c1ccccc1OC)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000583780700 1086960203 /nfs/dbraw/zinc/96/02/03/1086960203.db2.gz ZCPIJJJMMANDGA-HXUWFJFHSA-N 2 0 350.466 4.167 20 0 FIADRP CC[N@H+](Cc1cnc(-c2ccco2)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000584021456 1087115409 /nfs/dbraw/zinc/11/54/09/1087115409.db2.gz VKEBLUOZLZPSQX-UHFFFAOYSA-N 2 0 355.507 4.487 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000584142200 1087192150 /nfs/dbraw/zinc/19/21/50/1087192150.db2.gz KTVKULZLWGSKPY-NTCAYCPXSA-N 2 0 352.469 4.401 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2COC3(CCC3)C2)cc1 ZINC000657833208 1087205576 /nfs/dbraw/zinc/20/55/76/1087205576.db2.gz PSMFLFYKIQYMSM-OAQYLSRUSA-N 2 0 350.506 4.216 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc3cc(OC)c(OC)cc3c2)C1 ZINC000657845360 1087291721 /nfs/dbraw/zinc/29/17/21/1087291721.db2.gz NJAPFPCXTFDFPG-IAGOWNOFSA-N 2 0 356.510 4.240 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](c3cccnc3)C(C)C)CC2)cc1 ZINC000091312621 1087427805 /nfs/dbraw/zinc/42/78/05/1087427805.db2.gz UAHUHYGZNRQFAS-HSZRJFAPSA-N 2 0 367.537 4.289 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3ccncc3s2)[C@@H](C)C1 ZINC000657884430 1087528927 /nfs/dbraw/zinc/52/89/27/1087528927.db2.gz UHSJMKHDBXGXON-BQFCYCMXSA-N 2 0 361.555 4.084 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccncc3s2)[C@@H](C)C1 ZINC000657884432 1087528968 /nfs/dbraw/zinc/52/89/68/1087528968.db2.gz UHSJMKHDBXGXON-JZXOWHBKSA-N 2 0 361.555 4.084 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000657886874 1087536247 /nfs/dbraw/zinc/53/62/47/1087536247.db2.gz CEFGKXXSJYCFAW-RZUBCFFCSA-N 2 0 372.597 4.468 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCCn3nccc32)CC[NH+](Cc2ccccc2)CC1 ZINC000657931046 1087659100 /nfs/dbraw/zinc/65/91/00/1087659100.db2.gz QSMTVXFOZZWVDK-HXUWFJFHSA-N 2 0 352.526 4.000 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c2ccccc21 ZINC000658136615 1087731017 /nfs/dbraw/zinc/73/10/17/1087731017.db2.gz HNVLBGJQJZODEZ-QDSKXPNFSA-N 2 0 364.533 4.227 20 0 FIADRP CCCC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccccc1 ZINC000658141744 1087733466 /nfs/dbraw/zinc/73/34/66/1087733466.db2.gz UKWXQBOTAHKLDG-XZOQPEGZSA-N 2 0 352.522 4.274 20 0 FIADRP C[C@@H]([NH2+]CCc1ccnc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658128243 1087733650 /nfs/dbraw/zinc/73/36/50/1087733650.db2.gz CCHFXPMRKMXOGU-KNQAVFIVSA-N 2 0 359.517 4.278 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658143153 1087734967 /nfs/dbraw/zinc/73/49/67/1087734967.db2.gz XBLBTDVJRHGEAL-MBSDFSHPSA-N 2 0 352.522 4.057 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(Cl)c1 ZINC000658144500 1087736324 /nfs/dbraw/zinc/73/63/24/1087736324.db2.gz MHNLDRQTEAYSBZ-RTWAWAEBSA-N 2 0 358.913 4.148 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](c3ccc(Cl)cc3)C3CC3)cc2)C1 ZINC000658137304 1087742480 /nfs/dbraw/zinc/74/24/80/1087742480.db2.gz GLCRBVPOYFJVAR-FCHUYYIVSA-N 2 0 370.924 4.148 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1Cl ZINC000658163772 1087760898 /nfs/dbraw/zinc/76/08/98/1087760898.db2.gz AXMNJBUMWOTXLO-OAHLLOKOSA-N 2 0 361.892 4.437 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(OC)c1 ZINC000658165275 1087762918 /nfs/dbraw/zinc/76/29/18/1087762918.db2.gz HRQKERGSQUENMM-QFIPXVFZSA-N 2 0 353.510 4.043 20 0 FIADRP Fc1ccc([C@H]2CCC[C@H]2[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168481 1087764271 /nfs/dbraw/zinc/76/42/71/1087764271.db2.gz XLAVYLWPSHMVHB-DHIUTWEWSA-N 2 0 367.512 4.359 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCCO2 ZINC000658167299 1087764690 /nfs/dbraw/zinc/76/46/90/1087764690.db2.gz RLMMUJCYRJXGMJ-JOCHJYFZSA-N 2 0 365.521 4.106 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168441 1087765228 /nfs/dbraw/zinc/76/52/28/1087765228.db2.gz XFDNBRYRORZESS-MOPGFXCFSA-N 2 0 367.537 4.084 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CSCc2ccc(Br)cc21)C1CC[NH+](C)CC1 ZINC000658189401 1087778586 /nfs/dbraw/zinc/77/85/86/1087778586.db2.gz RWBRVFGMAMTYGD-SJKOYZFVSA-N 2 0 369.372 4.057 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(Cl)c1 ZINC000424319218 1087917876 /nfs/dbraw/zinc/91/78/76/1087917876.db2.gz SCKYLFNVZJTGTH-CYBMUJFWSA-N 2 0 350.865 4.400 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000414787662 1087987452 /nfs/dbraw/zinc/98/74/52/1087987452.db2.gz VSFQMCXWUGXRRC-SFTDATJTSA-N 2 0 350.506 4.184 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414803493 1088112045 /nfs/dbraw/zinc/11/20/45/1088112045.db2.gz CXLHYPHZZHFLTK-CQSZACIVSA-N 2 0 354.885 4.144 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414810474 1088200273 /nfs/dbraw/zinc/20/02/73/1088200273.db2.gz OERVQEYCAAWZPH-SJORKVTESA-N 2 0 353.510 4.337 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCc3c2cccc3F)C[C@H](C)O1 ZINC000513867230 1088494488 /nfs/dbraw/zinc/49/44/88/1088494488.db2.gz CZLWHLRIIOQLIO-SAHWJRBASA-N 2 0 368.496 4.212 20 0 FIADRP CCc1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@H](N)c1ccc(C(C)C)cc1 ZINC000414843645 1088502369 /nfs/dbraw/zinc/50/23/69/1088502369.db2.gz JWXRMOFSRPIJGA-UWJYYQICSA-N 2 0 367.537 4.379 20 0 FIADRP C[C@]1(C[NH2+]Cc2c[nH]nc2-c2cccs2)CC[N@H+](Cc2ccccc2)C1 ZINC000311546343 1088721657 /nfs/dbraw/zinc/72/16/57/1088721657.db2.gz VBVZHOFERXHKBX-OAQYLSRUSA-N 2 0 366.534 4.140 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC([NH+](C)Cc2ccccc2)CC1 ZINC000514089435 1088732885 /nfs/dbraw/zinc/73/28/85/1088732885.db2.gz QBMWAXLURZVVSW-RDABAPPSSA-N 3 0 357.586 4.284 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000514093590 1088739686 /nfs/dbraw/zinc/73/96/86/1088739686.db2.gz JTYISLIFZNNKKL-WMZHIEFXSA-N 2 0 367.537 4.228 20 0 FIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000514249490 1088929688 /nfs/dbraw/zinc/92/96/88/1088929688.db2.gz GUQOJAXHWFJOFI-SJAXDAAESA-N 2 0 370.924 4.100 20 0 FIADRP Clc1cc2c(c(C[NH+]3CCC(c4ncc5n4CCCC5)CC3)c1)OCC2 ZINC000434736196 1089020595 /nfs/dbraw/zinc/02/05/95/1089020595.db2.gz KUGKUFQNHBOWKU-UHFFFAOYSA-N 2 0 371.912 4.187 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000415011006 1089039208 /nfs/dbraw/zinc/03/92/08/1089039208.db2.gz VPYQTTFREJAAHH-YGRLFVJLSA-N 2 0 354.338 4.331 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c(-c2ccccc2Cl)n1 ZINC000415029511 1089059067 /nfs/dbraw/zinc/05/90/67/1089059067.db2.gz DPOGLMIKYKAREG-GOEBONIOSA-N 2 0 360.933 4.176 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415041037 1089079711 /nfs/dbraw/zinc/07/97/11/1089079711.db2.gz PMJBCAFLQVPYAU-RXVVDRJESA-N 2 0 360.505 4.065 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415045262 1089089254 /nfs/dbraw/zinc/08/92/54/1089089254.db2.gz BHXGZRPZGYRQID-LPHOPBHVSA-N 2 0 373.928 4.435 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(F)c(Br)c1)c1ccccc1 ZINC000415072057 1089129730 /nfs/dbraw/zinc/12/97/30/1089129730.db2.gz XMMSIGHDIFNRHH-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1OCC ZINC000414857892 1089132645 /nfs/dbraw/zinc/13/26/45/1089132645.db2.gz QKUDYQVAFHDUDS-GDBMZVCRSA-N 2 0 354.922 4.005 20 0 FIADRP c1ccc(-c2ccccc2OCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000415079091 1089135440 /nfs/dbraw/zinc/13/54/40/1089135440.db2.gz HFUKDONYDNWVRZ-BDTNDASRSA-N 2 0 350.506 4.243 20 0 FIADRP CC1CC[NH+]([C@H](CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c2cccs2)CC1 ZINC000415089313 1089148678 /nfs/dbraw/zinc/14/86/78/1089148678.db2.gz WDFDOBBLHPIABN-UAFMIMERSA-N 2 0 361.599 4.031 20 0 FIADRP C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414860062 1089149843 /nfs/dbraw/zinc/14/98/43/1089149843.db2.gz OCLNFNLVKSGULC-AWEZNQCLSA-N 2 0 371.447 4.064 20 0 FIADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000415116914 1089175289 /nfs/dbraw/zinc/17/52/89/1089175289.db2.gz IKNUQZMPWHOWFD-LIRRHRJNSA-N 2 0 370.368 4.078 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000415116679 1089175879 /nfs/dbraw/zinc/17/58/79/1089175879.db2.gz IADUUJLXLKHUBZ-NJDAHSKKSA-N 2 0 352.526 4.006 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000415127267 1089181078 /nfs/dbraw/zinc/18/10/78/1089181078.db2.gz QRPVLSLESQHJEI-FDDCHVKYSA-N 2 0 370.537 4.494 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CCC[NH2+]C1 ZINC000414863737 1089205141 /nfs/dbraw/zinc/20/51/41/1089205141.db2.gz YBHPQVLMNHKONJ-PWSUYJOCSA-N 2 0 354.338 4.202 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1cccc2c1OCC[C@H]2[NH+](C)C ZINC000435041538 1089219325 /nfs/dbraw/zinc/21/93/25/1089219325.db2.gz JOQKLURLHLTZOX-VOQZNFBZSA-N 2 0 365.521 4.004 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000435060236 1089246793 /nfs/dbraw/zinc/24/67/93/1089246793.db2.gz RXBASWKDFLCRKM-UHFFFAOYSA-N 2 0 350.441 4.037 20 0 FIADRP C[C@@H]1COCC[C@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549236666 1089311150 /nfs/dbraw/zinc/31/11/50/1089311150.db2.gz DBGXKGOQMMKLIC-DWYIHVRCSA-N 2 0 362.945 4.269 20 0 FIADRP CO[C@H](C)[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549237097 1089319042 /nfs/dbraw/zinc/31/90/42/1089319042.db2.gz JTVCHWFGUAHTKX-PRXSRLESSA-N 2 0 350.934 4.267 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435369359 1089579360 /nfs/dbraw/zinc/57/93/60/1089579360.db2.gz DVZUXZMESFZNDK-NVXWUHKLSA-N 2 0 371.912 4.152 20 0 FIADRP CC(C)(C)n1cc(C[NH+]2CCC(C[NH3+])CC2)c(-c2ccccc2Cl)n1 ZINC000435389133 1089596161 /nfs/dbraw/zinc/59/61/61/1089596161.db2.gz JEMFMXZSDGQLGJ-UHFFFAOYSA-N 2 0 360.933 4.129 20 0 FIADRP c1cc(C[N@H+](Cc2ccc3ncccc3c2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000435425095 1089642756 /nfs/dbraw/zinc/64/27/56/1089642756.db2.gz BTSHDNZLXSUHST-NRFANRHFSA-N 2 0 363.530 4.441 20 0 FIADRP Fc1c(Br)cccc1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959411 1089771294 /nfs/dbraw/zinc/77/12/94/1089771294.db2.gz OTRCBTXUOBPBNB-MQVJKMGUSA-N 2 0 367.306 4.083 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000515249709 1089913395 /nfs/dbraw/zinc/91/33/95/1089913395.db2.gz LEPGVCSOQJHOEA-NRFANRHFSA-N 2 0 353.510 4.043 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+]C2CCC(C[NH+](C)C)CC2)cn1 ZINC000435789772 1089936346 /nfs/dbraw/zinc/93/63/46/1089936346.db2.gz YNTNLURYTKGQPR-UHFFFAOYSA-N 2 0 352.526 4.060 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc([S@](C)=O)cc1 ZINC000163937202 1090280201 /nfs/dbraw/zinc/28/02/01/1090280201.db2.gz BICOZYLOIZBTHV-HFJWLAOPSA-N 2 0 370.562 4.261 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(NC(C)=O)cc1 ZINC000181924365 1090317358 /nfs/dbraw/zinc/31/73/58/1090317358.db2.gz SRYPAKBBTMUHRT-QGZVFWFLSA-N 2 0 353.510 4.338 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000549424259 1090321399 /nfs/dbraw/zinc/32/13/99/1090321399.db2.gz CTBPIHLAENDYLQ-QGZVFWFLSA-N 2 0 364.415 4.130 20 0 FIADRP Fc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000363863347 1090418549 /nfs/dbraw/zinc/41/85/49/1090418549.db2.gz KQVDCPTWPUDMDJ-IFMALSPDSA-N 2 0 360.517 4.433 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000511565598 1090441496 /nfs/dbraw/zinc/44/14/96/1090441496.db2.gz KJLJRHPULSHRIC-KCESLBEFSA-N 2 0 352.522 4.069 20 0 FIADRP C[C@H]([NH2+][C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)C1CC[NH+](C)CC1 ZINC000312267202 1090467110 /nfs/dbraw/zinc/46/71/10/1090467110.db2.gz GELREKUOGJLAJN-YWZLYKJASA-N 2 0 373.541 4.341 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](CCc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000511595884 1090612086 /nfs/dbraw/zinc/61/20/86/1090612086.db2.gz TYNIMWVAKYWLMO-PMACEKPBSA-N 2 0 366.549 4.204 20 0 FIADRP c1c2c(nn1-c1ccccc1)CCC[C@@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000584669494 1090683887 /nfs/dbraw/zinc/68/38/87/1090683887.db2.gz YYUUCGOLMKODDQ-NRFANRHFSA-N 2 0 352.526 4.105 20 0 FIADRP Cc1ncc(C[N@@H+]2CC(C)(C)[C@H]2C2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000628297648 1090798894 /nfs/dbraw/zinc/79/88/94/1090798894.db2.gz GWDNCXYQRYYUEL-OAQYLSRUSA-N 2 0 353.510 4.106 20 0 FIADRP C[C@H]([NH2+]CCc1nccn1Cc1ccccc1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323169 1090814108 /nfs/dbraw/zinc/81/41/08/1090814108.db2.gz OBOYMICJOOYNOA-YTQUADARSA-N 2 0 351.519 4.317 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cnc(CC(F)(F)F)s1 ZINC000893327742 1091007483 /nfs/dbraw/zinc/00/74/83/1091007483.db2.gz OICYOSLHSUCDJS-UHFFFAOYSA-N 2 0 371.472 4.378 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000388464730 1091370542 /nfs/dbraw/zinc/37/05/42/1091370542.db2.gz CYJZDMFTAFOJMX-AEFFLSMTSA-N 2 0 360.448 4.461 20 0 FIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000500416086 1091469965 /nfs/dbraw/zinc/46/99/65/1091469965.db2.gz MWFMNIRGWZBYHN-VZVUQDNOSA-N 2 0 370.459 4.199 20 0 FIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000500416085 1091470301 /nfs/dbraw/zinc/47/03/01/1091470301.db2.gz MWFMNIRGWZBYHN-NOCRFKNCSA-N 2 0 370.459 4.199 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)cc1)C(F)(F)F ZINC000660474364 1091592587 /nfs/dbraw/zinc/59/25/87/1091592587.db2.gz IDDUSTUFLFTNHK-APWZRJJASA-N 2 0 370.459 4.039 20 0 FIADRP [NH2+]=C(NCCCC[NH3+])Nc1ccc(-c2ccc(C(F)(F)F)cc2)cc1 ZINC001167881937 1091955910 /nfs/dbraw/zinc/95/59/10/1091955910.db2.gz NCRBWLVBXQSFRH-UHFFFAOYSA-N 2 0 350.388 4.048 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512317913 1092029697 /nfs/dbraw/zinc/02/96/97/1092029697.db2.gz HDSVJUKWNIPNKW-NSHGMRRFSA-N 2 0 352.526 4.176 20 0 FIADRP CCOc1cc(CNCCC[N@H+](C)Cc2ccccc2)cc(Cl)c1O ZINC000508339324 1092253974 /nfs/dbraw/zinc/25/39/74/1092253974.db2.gz KZZFFSDFRHNBCW-UHFFFAOYSA-N 2 0 362.901 4.056 20 0 FIADRP CCCc1nc(C)c(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)o1 ZINC000428231911 1092273362 /nfs/dbraw/zinc/27/33/62/1092273362.db2.gz SLWVAOMZCMFWEE-UHFFFAOYSA-N 2 0 355.526 4.280 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCOc2ccccc2F)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012040 1092332697 /nfs/dbraw/zinc/33/26/97/1092332697.db2.gz VEEQKGGUFFDLGM-OPVJXMOQSA-N 2 0 356.485 4.236 20 0 FIADRP COc1cc([C@@H](C)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000521016650 1092424908 /nfs/dbraw/zinc/42/49/08/1092424908.db2.gz QGBCDIFIFFXLHY-MJGOQNOKSA-N 2 0 371.500 4.182 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000521312894 1092635751 /nfs/dbraw/zinc/63/57/51/1092635751.db2.gz JAFJTTOFWLCFTG-UWJYYQICSA-N 2 0 364.518 4.254 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442707379 1092733048 /nfs/dbraw/zinc/73/30/48/1092733048.db2.gz GMRRVCYGBDFZGW-UHFFFAOYSA-N 2 0 354.485 4.321 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]CCCC[NH+]3CCOCC3)C2)cc1 ZINC000442710432 1092734598 /nfs/dbraw/zinc/73/45/98/1092734598.db2.gz CAQSWIBRSGPAPN-IEBWSBKVSA-N 2 0 370.459 4.044 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]CCCC[NH+]3CCOCC3)C2)cc1 ZINC000442710435 1092734631 /nfs/dbraw/zinc/73/46/31/1092734631.db2.gz CAQSWIBRSGPAPN-MJGOQNOKSA-N 2 0 370.459 4.044 20 0 FIADRP C[C@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000442825134 1092779843 /nfs/dbraw/zinc/77/98/43/1092779843.db2.gz IEHPVXNOPAMFRH-SXLOBPIMSA-N 2 0 359.517 4.135 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCC(C)(C)[NH+]2CCC[C@H](C)C2)cc1)C(C)C ZINC000110229063 1092832447 /nfs/dbraw/zinc/83/24/47/1092832447.db2.gz HZIIFEYBSCCXNO-IBGZPJMESA-N 2 0 373.585 4.157 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000442991806 1092901554 /nfs/dbraw/zinc/90/15/54/1092901554.db2.gz MPIZVCCYUJEHLR-AWEZNQCLSA-N 2 0 374.410 4.488 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CCC[C@H](CC[NH3+])C2)c1 ZINC000443062311 1092923983 /nfs/dbraw/zinc/92/39/83/1092923983.db2.gz UKORVFGXLCQIMZ-DENIHFKCSA-N 2 0 365.521 4.044 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000521817456 1092935848 /nfs/dbraw/zinc/93/58/48/1092935848.db2.gz BVINXIUYOIMVBE-ROUUACIJSA-N 2 0 362.521 4.331 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)C1 ZINC000236930428 1092983684 /nfs/dbraw/zinc/98/36/84/1092983684.db2.gz ZJFMZHLPIMWZOH-FQEVSTJZSA-N 2 0 367.537 4.099 20 0 FIADRP C[C@H](c1nc(-c2cccc(C[NH+]3CCCC3)c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443212203 1092985997 /nfs/dbraw/zinc/98/59/97/1092985997.db2.gz LVBVCOCTQQFJLW-IXDOHACOSA-N 2 0 354.498 4.266 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000512614125 1092992954 /nfs/dbraw/zinc/99/29/54/1092992954.db2.gz UXGIGPGNHMPXGI-QHAWAJNXSA-N 2 0 369.578 4.193 20 0 FIADRP C[C@@H]1CC([NH2+]CC[C@@H](O)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015826 1093039021 /nfs/dbraw/zinc/03/90/21/1093039021.db2.gz SMWQPCYCNSNXRW-DNVFCKCGSA-N 2 0 352.522 4.141 20 0 FIADRP COC1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512648503 1093069572 /nfs/dbraw/zinc/06/95/72/1093069572.db2.gz NQPZAFHXJZZFDZ-CIAQSOCLSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCOc2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168018831 1093174046 /nfs/dbraw/zinc/17/40/46/1093174046.db2.gz FKQAJDHXUBTAJU-VTYHHJSWSA-N 2 0 352.522 4.487 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2(CO)CC(c3ccccc3)C2)CC1 ZINC000433076217 1093203763 /nfs/dbraw/zinc/20/37/63/1093203763.db2.gz MVDTYVBIZJTCCR-ZOGZRVJRSA-N 2 0 370.581 4.175 20 0 FIADRP C[C@@H]1CC([NH2+]CCCCc2ccccn2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020887 1093225610 /nfs/dbraw/zinc/22/56/10/1093225610.db2.gz OJNQUTXRXPPRID-WOJBJXKFSA-N 2 0 351.538 4.436 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@H](O)c2ccc(F)c(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168021969 1093260832 /nfs/dbraw/zinc/26/08/32/1093260832.db2.gz RQSFYNODOZLZBX-MCFFVMPBSA-N 2 0 374.475 4.029 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000389082511 1093348104 /nfs/dbraw/zinc/34/81/04/1093348104.db2.gz DMSRXISUTXJOCV-DENIHFKCSA-N 2 0 352.522 4.215 20 0 FIADRP COCc1cccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168024304 1093385362 /nfs/dbraw/zinc/38/53/62/1093385362.db2.gz DVKJGZHBWMEXPV-RTBURBONSA-N 2 0 352.522 4.364 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000512846955 1093446560 /nfs/dbraw/zinc/44/65/60/1093446560.db2.gz RZGVQLKSZXFGIZ-SFHVURJKSA-N 2 0 358.913 4.350 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500912824 1093453166 /nfs/dbraw/zinc/45/31/66/1093453166.db2.gz AQQJTDOFPMYDOH-UHFFFAOYSA-N 2 0 369.347 4.204 20 0 FIADRP C[C@H]1CC([NH2+]CCCC2CC[NH+](C)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168027927 1093525278 /nfs/dbraw/zinc/52/52/78/1093525278.db2.gz NNPHBPRKILCEJC-PMACEKPBSA-N 3 0 357.586 4.140 20 0 FIADRP C[C@@H]1CC([NH2+]CCCC2CC[NH+](C)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168027931 1093525616 /nfs/dbraw/zinc/52/56/16/1093525616.db2.gz NNPHBPRKILCEJC-WOJBJXKFSA-N 3 0 357.586 4.140 20 0 FIADRP C[C@@H]1CC(NC2CC[NH+](C3CCCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168027995 1093528655 /nfs/dbraw/zinc/52/86/55/1093528655.db2.gz NWQLTFDDGDCBFH-WOJBJXKFSA-N 2 0 369.597 4.425 20 0 FIADRP CC[N@H+](CCCc1ccc(C)nc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000474274983 1093634777 /nfs/dbraw/zinc/63/47/77/1093634777.db2.gz NWFUXWGOMQAYTG-HSZRJFAPSA-N 2 0 351.538 4.167 20 0 FIADRP CCOC(=O)[C@@H]1CCC[C@H]([NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168032218 1093652754 /nfs/dbraw/zinc/65/27/54/1093652754.db2.gz GQDPZVMSRRGFPI-MMKMLUHNSA-N 2 0 372.553 4.140 20 0 FIADRP C[C@@H]1C[C@@H]([N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)N1Cc1ccccc1 ZINC001168032537 1093659767 /nfs/dbraw/zinc/65/97/67/1093659767.db2.gz HWAXIILUEVWSIO-NFGCXPRFSA-N 2 0 369.597 4.410 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000513052910 1093697585 /nfs/dbraw/zinc/69/75/85/1093697585.db2.gz UHINXJVCYUNDCF-CVDCTZTESA-N 2 0 359.517 4.420 20 0 FIADRP C[C@H]1CC([NH2+]C2(CC3CC3)CCOCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168033385 1093714278 /nfs/dbraw/zinc/71/42/78/1093714278.db2.gz KZFUCQKWWILEJX-OALUTQOASA-N 2 0 356.554 4.367 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000513063791 1093715702 /nfs/dbraw/zinc/71/57/02/1093715702.db2.gz IPMSNMKPHANNDL-UTKZUKDTSA-N 2 0 365.496 4.492 20 0 FIADRP C[C@@H]1CC([N@@H+]2CCCC[C@@H](CCC[NH3+])C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033470 1093721183 /nfs/dbraw/zinc/72/11/83/1093721183.db2.gz LAJZBMGCRQMCDC-NJYVYQBISA-N 3 0 357.586 4.269 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)Cc2cccnc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168034692 1093763452 /nfs/dbraw/zinc/76/34/52/1093763452.db2.gz QPYAUDKPGDULSM-HATOLVCRSA-N 2 0 351.538 4.434 20 0 FIADRP Cc1ccnc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)[C@@H](C)C3)CC2)c1 ZINC001168034747 1093768095 /nfs/dbraw/zinc/76/80/95/1093768095.db2.gz RBTZODMTIBHGGD-VTYHHJSWSA-N 2 0 363.549 4.453 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000513078918 1093780707 /nfs/dbraw/zinc/78/07/07/1093780707.db2.gz XNNNSPANOYARGD-CEMLEFRQSA-N 2 0 369.553 4.305 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000474474491 1093819527 /nfs/dbraw/zinc/81/95/27/1093819527.db2.gz GZNWNYWFIGPTKB-UHFFFAOYSA-N 2 0 374.532 4.456 20 0 FIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]CCCC[NH+]1CCOCC1 ZINC000474483202 1093829521 /nfs/dbraw/zinc/82/95/21/1093829521.db2.gz UAMSSCQZHWNGIL-UHFFFAOYSA-N 2 0 356.963 4.043 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[N@H+]3CCCC[C@H]3C)cc12 ZINC000894179361 1093889766 /nfs/dbraw/zinc/88/97/66/1093889766.db2.gz QWOJSXRGXZOOBQ-MRXNPFEDSA-N 2 0 364.493 4.195 20 0 FIADRP C[N@H+](Cc1ccc(OCc2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513149501 1093909083 /nfs/dbraw/zinc/90/90/83/1093909083.db2.gz LNTJEISMRNASIP-CBQGHPETSA-N 2 0 350.506 4.323 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CCCC[NH+]2CCCC2)cc1 ZINC000729321118 1093962538 /nfs/dbraw/zinc/96/25/38/1093962538.db2.gz SIHQYFHZYDNJRN-IBGZPJMESA-N 2 0 357.542 4.266 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000513350413 1094073797 /nfs/dbraw/zinc/07/37/97/1094073797.db2.gz HSWGNYLHCNHDKB-JFJDKTSWSA-N 2 0 369.597 4.282 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1OC ZINC000513499810 1094172757 /nfs/dbraw/zinc/17/27/57/1094172757.db2.gz IXZCODLMEVSWNO-RXVVDRJESA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1 ZINC000513525020 1094197784 /nfs/dbraw/zinc/19/77/84/1094197784.db2.gz JGYREUOLJNPIPO-NRFANRHFSA-N 2 0 374.475 4.463 20 0 FIADRP Cc1ccc(C)c(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000513608515 1094243843 /nfs/dbraw/zinc/24/38/43/1094243843.db2.gz IUKYNSAOBBZLJB-PMACEKPBSA-N 2 0 352.522 4.202 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(C)o1 ZINC000513696857 1094363576 /nfs/dbraw/zinc/36/35/76/1094363576.db2.gz FIFPJRSCQCZEAF-QNWVGRARSA-N 2 0 367.537 4.114 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000513703684 1094411651 /nfs/dbraw/zinc/41/16/51/1094411651.db2.gz YTAFXKCLPSWFPR-FDFHNCONSA-N 2 0 350.506 4.195 20 0 FIADRP CC(C)CC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000501038763 1094465525 /nfs/dbraw/zinc/46/55/25/1094465525.db2.gz SQYUSBVZXHHXDX-HXUWFJFHSA-N 2 0 351.966 4.044 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)CC1 ZINC000501060565 1094472066 /nfs/dbraw/zinc/47/20/66/1094472066.db2.gz SWOGLLIRKPSECI-UIFIKXQLSA-N 2 0 363.977 4.043 20 0 FIADRP COc1cc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)ccc1SC ZINC000501064803 1094476432 /nfs/dbraw/zinc/47/64/32/1094476432.db2.gz ZDFZYUUZWJQPRP-UHFFFAOYSA-N 2 0 371.550 4.161 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000501117704 1094516229 /nfs/dbraw/zinc/51/62/29/1094516229.db2.gz IKSWJYPPYRPVIK-QHAWAJNXSA-N 2 0 365.565 4.391 20 0 FIADRP Fc1ccc(C(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccc(F)cc2)cc1 ZINC000501377264 1094669167 /nfs/dbraw/zinc/66/91/67/1094669167.db2.gz KBTSBMDEWOFMCT-MRXNPFEDSA-N 2 0 356.460 4.171 20 0 FIADRP CCc1nc(C)c(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)o1 ZINC000428305427 1094846660 /nfs/dbraw/zinc/84/66/60/1094846660.db2.gz KRTPFBWPIQTSON-UHFFFAOYSA-N 2 0 353.510 4.034 20 0 FIADRP Cc1nc([C@H](C)[N@@H+]2CCC3(C2)CC[NH2+]CC3)oc1-c1ccc(Cl)cc1 ZINC000420308266 1094872806 /nfs/dbraw/zinc/87/28/06/1094872806.db2.gz NIMGCBOLAKKFLY-HNNXBMFYSA-N 2 0 359.901 4.440 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420379816 1094905807 /nfs/dbraw/zinc/90/58/07/1094905807.db2.gz NPRJBIZRWRHIIU-UUWFMWQGSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccccc3Oc3ccccc3)CC2)C1 ZINC000420386641 1094907173 /nfs/dbraw/zinc/90/71/73/1094907173.db2.gz JBPMWPQZQLCKKH-NFBKMPQASA-N 2 0 366.505 4.197 20 0 FIADRP Cc1c(Cl)cccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501779445 1094922270 /nfs/dbraw/zinc/92/22/70/1094922270.db2.gz WWUZVWCJBIBZED-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000522799480 1095690537 /nfs/dbraw/zinc/69/05/37/1095690537.db2.gz DSWPFAVZROZDKE-QHAWAJNXSA-N 2 0 365.565 4.391 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)oc1C ZINC000502699453 1095722634 /nfs/dbraw/zinc/72/26/34/1095722634.db2.gz YYVOKKWCZDKNPE-KSZLIROESA-N 2 0 356.510 4.356 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cnn(C2CCCC2)c1 ZINC000502699931 1095725086 /nfs/dbraw/zinc/72/50/86/1095725086.db2.gz OERHFLDYVQPBOJ-GOSISDBHSA-N 2 0 370.541 4.180 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cnn1-c1cc(C)ccc1C ZINC000421876474 1095971374 /nfs/dbraw/zinc/97/13/74/1095971374.db2.gz KVSULJOANUAMNJ-QHGAOEGBSA-N 2 0 354.542 4.321 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CC24CCSCC4)C3)cc1 ZINC000421872274 1095980807 /nfs/dbraw/zinc/98/08/07/1095980807.db2.gz GNLOTSVIFWUHJK-MXEMCNAFSA-N 2 0 356.579 4.305 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422710860 1096459614 /nfs/dbraw/zinc/45/96/14/1096459614.db2.gz GGPSXIGDVIRGDC-ZJSXRUAMSA-N 2 0 374.532 4.206 20 0 FIADRP CC(C)CC(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422720768 1096470092 /nfs/dbraw/zinc/47/00/92/1096470092.db2.gz MVBZRXKFRSTJTH-PCCBWWKXSA-N 2 0 357.542 4.072 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)CCc1ccc(OC(C)C)cc1 ZINC000422722128 1096471860 /nfs/dbraw/zinc/47/18/60/1096471860.db2.gz OWQJSDHMBPOSJL-DLBZAZTESA-N 2 0 355.526 4.308 20 0 FIADRP c1ccc(SCCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422754625 1096483576 /nfs/dbraw/zinc/48/35/76/1096483576.db2.gz JPYDMGGJFUDWGO-CTNGQTDRSA-N 2 0 354.519 4.014 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784231 1096489996 /nfs/dbraw/zinc/48/99/96/1096489996.db2.gz PKCISXYXRLDGBO-NFBKMPQASA-N 2 0 350.506 4.330 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@H](C)C[C@H](C)[NH3+])cc1OC ZINC000422781446 1096490118 /nfs/dbraw/zinc/49/01/18/1096490118.db2.gz KQBKOIGDLDABOZ-QKLQHJQFSA-N 2 0 356.510 4.011 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422791249 1096498550 /nfs/dbraw/zinc/49/85/50/1096498550.db2.gz PZAMDDABFCEMGN-STQMWFEESA-N 2 0 353.388 4.108 20 0 FIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422838326 1096502437 /nfs/dbraw/zinc/50/24/37/1096502437.db2.gz OEFCWPBFAPSKKT-NJDAHSKKSA-N 2 0 374.594 4.147 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422862516 1096507352 /nfs/dbraw/zinc/50/73/52/1096507352.db2.gz PXDSEGPLFJWIJF-RYUDHWBXSA-N 2 0 352.309 4.437 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422880809 1096510767 /nfs/dbraw/zinc/51/07/67/1096510767.db2.gz OTBOAZKARGMSCM-XPGWFJOJSA-N 2 0 355.913 4.209 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422880808 1096511297 /nfs/dbraw/zinc/51/12/97/1096511297.db2.gz OTBOAZKARGMSCM-UIAACRFSSA-N 2 0 355.913 4.209 20 0 FIADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422880088 1096511388 /nfs/dbraw/zinc/51/13/88/1096511388.db2.gz NEGURYPXOUQIQW-KDOFPFPSSA-N 2 0 371.352 4.019 20 0 FIADRP Fc1ccc(Oc2ccnc(CN[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2)cc1 ZINC000422886276 1096512965 /nfs/dbraw/zinc/51/29/65/1096512965.db2.gz IRNMASFDOKZXPK-BHDDXSALSA-N 2 0 369.484 4.413 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422892307 1096515834 /nfs/dbraw/zinc/51/58/34/1096515834.db2.gz MPZQDXJVZYRABA-HUUCEWRRSA-N 2 0 357.498 4.058 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000422874668 1096518491 /nfs/dbraw/zinc/51/84/91/1096518491.db2.gz OCMXHEFAWNIHSZ-KBPBESRZSA-N 2 0 357.473 4.188 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cn2)cc1 ZINC000422900917 1096519531 /nfs/dbraw/zinc/51/95/31/1096519531.db2.gz RBWLXIXHMFHPNG-HSALFYBXSA-N 2 0 355.457 4.023 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422901373 1096519567 /nfs/dbraw/zinc/51/95/67/1096519567.db2.gz BWTUJDSERDUYPN-LJQANCHMSA-N 2 0 362.521 4.206 20 0 FIADRP Cc1sc(CC[NH2+][C@@H](Cc2ccccc2)[C@H](C)[NH3+])nc1-c1ccccc1 ZINC000422927540 1096527174 /nfs/dbraw/zinc/52/71/74/1096527174.db2.gz GQWYIYNTFAWMLB-JXFKEZNVSA-N 2 0 365.546 4.209 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(c3ccccc3Cl)CCOCC2)c2ccccc21 ZINC000422955109 1096537586 /nfs/dbraw/zinc/53/75/86/1096537586.db2.gz IPYGXLCKRHQLRB-WOJBJXKFSA-N 2 0 356.897 4.123 20 0 FIADRP Cc1cc([C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)ccc1F ZINC000423009858 1096549256 /nfs/dbraw/zinc/54/92/56/1096549256.db2.gz FEQPAABCBBNGHC-YMPZKCBVSA-N 2 0 366.480 4.431 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N1CCC[C@@H](CC[NH3+])C1)C1CCCCC1 ZINC000414713361 1096557045 /nfs/dbraw/zinc/55/70/45/1096557045.db2.gz OYUWPWHAAZFUJQ-SFHVURJKSA-N 2 0 372.557 4.044 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000423038641 1096557327 /nfs/dbraw/zinc/55/73/27/1096557327.db2.gz OTEVTTPRTZLNCV-UWSIMGETSA-N 2 0 362.517 4.472 20 0 FIADRP FC(F)(F)COc1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423096251 1096573302 /nfs/dbraw/zinc/57/33/02/1096573302.db2.gz OHLVEJJDIVZPAB-IPMKNSEASA-N 2 0 370.459 4.071 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](CC)[C@H]2CCC[NH2+]CC2)cc1OC ZINC000414715782 1096574235 /nfs/dbraw/zinc/57/42/35/1096574235.db2.gz NMGQRDWDXHRNDS-INIZCTEOSA-N 2 0 354.922 4.101 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423100981 1096574901 /nfs/dbraw/zinc/57/49/01/1096574901.db2.gz NFYKKZKXGFFJOD-KLHJMIIUSA-N 2 0 354.519 4.315 20 0 FIADRP FC(F)(F)c1ccc(Cl)c(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)c1 ZINC000423075932 1096576487 /nfs/dbraw/zinc/57/64/87/1096576487.db2.gz XYKZMFBANJXCCF-PBWFPOADSA-N 2 0 358.835 4.263 20 0 FIADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423119770 1096578502 /nfs/dbraw/zinc/57/85/02/1096578502.db2.gz DQXBFCXEIGBPNF-LYOVBCGYSA-N 2 0 350.304 4.023 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000423127444 1096580287 /nfs/dbraw/zinc/58/02/87/1096580287.db2.gz TWHTVTHMGLPUEO-DYVFJYSZSA-N 2 0 362.315 4.040 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000423106740 1096583469 /nfs/dbraw/zinc/58/34/69/1096583469.db2.gz OZDJNDPUQLCTNR-RDTXWAMCSA-N 2 0 358.448 4.280 20 0 FIADRP Clc1ccc(-c2ncc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)s2)cc1 ZINC000423108387 1096583806 /nfs/dbraw/zinc/58/38/06/1096583806.db2.gz RDGJOTSLDQRHDW-KZNAEPCWSA-N 2 0 361.942 4.474 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000503916385 1096585820 /nfs/dbraw/zinc/58/58/20/1096585820.db2.gz ZZFTXIUKMLVWFT-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP Clc1cccc(CC2([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000423154812 1096589961 /nfs/dbraw/zinc/58/99/61/1096589961.db2.gz JXFAJDITCNMGTQ-UGKGYDQZSA-N 2 0 368.908 4.261 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000503911873 1096593679 /nfs/dbraw/zinc/59/36/79/1096593679.db2.gz QXAFFFISCQVOIC-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1OCC ZINC000503915188 1096595822 /nfs/dbraw/zinc/59/58/22/1096595822.db2.gz ZIBJZAGWNKCNAY-UHFFFAOYSA-N 2 0 368.949 4.349 20 0 FIADRP Cc1ncsc1C[N@H+](CCc1ccc(C(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC000414721412 1096598209 /nfs/dbraw/zinc/59/82/09/1096598209.db2.gz CAYNUSSRZDMLQE-IBGZPJMESA-N 2 0 357.567 4.229 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH]1 ZINC000503951805 1096610173 /nfs/dbraw/zinc/61/01/73/1096610173.db2.gz YFSXYPDPUSRVBG-KOUNCHBCSA-N 2 0 359.517 4.496 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423238400 1096618428 /nfs/dbraw/zinc/61/84/28/1096618428.db2.gz ADVKTGAMCYBZMH-TZMCWYRMSA-N 2 0 367.324 4.138 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1cc(Cl)ccc1Cl)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414727764 1096629883 /nfs/dbraw/zinc/62/98/83/1096629883.db2.gz BOBFDISXDLHNGK-ZIAGYGMSSA-N 2 0 372.340 4.032 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccco2)cc1 ZINC000423260763 1096634217 /nfs/dbraw/zinc/63/42/17/1096634217.db2.gz QPZVIRXYYNAYHD-KSSFIOAISA-N 2 0 363.299 4.111 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]C[C@@H]([NH3+])C(C)C)nc1 ZINC000423269468 1096638242 /nfs/dbraw/zinc/63/82/42/1096638242.db2.gz HHVOVUYLPYWBLE-LEWJYISDSA-N 2 0 359.945 4.024 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@]3(C)CCC[NH2+]C3)s2)cc1 ZINC000423315745 1096641393 /nfs/dbraw/zinc/64/13/93/1096641393.db2.gz AELSGHKQDWOJJH-VBKZILBWSA-N 2 0 359.539 4.167 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423296623 1096644548 /nfs/dbraw/zinc/64/45/48/1096644548.db2.gz ZOXFTCOLFKJWPL-KGLIPLIRSA-N 2 0 352.507 4.384 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423297293 1096644616 /nfs/dbraw/zinc/64/46/16/1096644616.db2.gz JQRCOFLPIRCRBF-WDEREUQCSA-N 2 0 368.344 4.126 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)CCC3)cc1 ZINC000423344804 1096646593 /nfs/dbraw/zinc/64/65/93/1096646593.db2.gz YEAULUVWWBUYPG-UWJYYQICSA-N 2 0 371.550 4.175 20 0 FIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000504082081 1096658402 /nfs/dbraw/zinc/65/84/02/1096658402.db2.gz WBNPEMIMVLPREF-KDURUIRLSA-N 2 0 354.542 4.233 20 0 FIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000504082082 1096658570 /nfs/dbraw/zinc/65/85/70/1096658570.db2.gz WBNPEMIMVLPREF-OALUTQOASA-N 2 0 354.542 4.233 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)CC[NH2+]CC1 ZINC000423398593 1096667099 /nfs/dbraw/zinc/66/70/99/1096667099.db2.gz DDFPCEJNRRXREG-GOSISDBHSA-N 2 0 368.521 4.029 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423426560 1096671651 /nfs/dbraw/zinc/67/16/51/1096671651.db2.gz FILZYNOEGKQTOP-OAUYIBNBSA-N 2 0 358.473 4.380 20 0 FIADRP COc1ccc(C[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c2ccc(OC)cc2)cc1 ZINC000423479174 1096698371 /nfs/dbraw/zinc/69/83/71/1096698371.db2.gz UMMLOAPFFAHKQL-NOXFTYBFSA-N 2 0 368.521 4.095 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000423480902 1096698736 /nfs/dbraw/zinc/69/87/36/1096698736.db2.gz WGCBTYMCNYDSCM-CKEIUWERSA-N 2 0 359.514 4.434 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2ccc(F)cc2)CC1 ZINC000423503290 1096701333 /nfs/dbraw/zinc/70/13/33/1096701333.db2.gz KJANFJMGLXOBAL-QIJUGHKUSA-N 3 0 361.549 4.096 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546840 1096718380 /nfs/dbraw/zinc/71/83/80/1096718380.db2.gz ZOFQAJPJBCFGAZ-YVEFUNNKSA-N 2 0 367.356 4.131 20 0 FIADRP Clc1c2ccccc2sc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000515546806 1098690581 /nfs/dbraw/zinc/69/05/81/1098690581.db2.gz CVTRHFNHGIGHKR-UHFFFAOYSA-N 2 0 364.942 4.099 20 0 FIADRP FC(F)(F)Oc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533075800 1098742557 /nfs/dbraw/zinc/74/25/57/1098742557.db2.gz PMTGKRHOBWOHTA-MAUKXSAKSA-N 2 0 354.416 4.034 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cc3c(cccc3F)[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000436298647 1098911201 /nfs/dbraw/zinc/91/12/01/1098911201.db2.gz ZLNCRFBCMIPSNA-AEFFLSMTSA-N 2 0 351.469 4.450 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cc3c(cccc3F)[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000436298650 1098911335 /nfs/dbraw/zinc/91/13/35/1098911335.db2.gz ZLNCRFBCMIPSNA-WMZOPIPTSA-N 2 0 351.469 4.450 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)C1 ZINC000436304956 1098918300 /nfs/dbraw/zinc/91/83/00/1098918300.db2.gz GBSZJCBHOMIWAY-VSKRKVRLSA-N 2 0 356.554 4.058 20 0 FIADRP C[C@H](CCc1n[nH]c2ccccc21)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436307815 1098930053 /nfs/dbraw/zinc/93/00/53/1098930053.db2.gz LOZDPJSMPYVGAT-IEBWSBKVSA-N 2 0 354.542 4.271 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3c[nH]nc3-c3ccsc3)CC2)CC1 ZINC000436400801 1098988310 /nfs/dbraw/zinc/98/83/10/1098988310.db2.gz LUJORZYNBWTNNQ-UHFFFAOYSA-N 2 0 358.555 4.271 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000436402230 1098991855 /nfs/dbraw/zinc/99/18/55/1098991855.db2.gz UUDUNPQTOLPFFS-HUVFLSCGSA-N 2 0 364.533 4.069 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1C ZINC000533447236 1099072480 /nfs/dbraw/zinc/07/24/80/1099072480.db2.gz PKNCLIJZTXZWHN-ZIAGYGMSSA-N 2 0 372.340 4.127 20 0 FIADRP C[NH+](C)CCCOc1ccc(CNCc2nc(C(C)(C)C)cs2)cc1 ZINC000729686649 1099112263 /nfs/dbraw/zinc/11/22/63/1099112263.db2.gz QXPZBPDDWDMURY-UHFFFAOYSA-N 2 0 361.555 4.061 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001211993983 1099131610 /nfs/dbraw/zinc/13/16/10/1099131610.db2.gz HXTUAJNVBVGGHK-UHFFFAOYSA-N 2 0 370.516 4.163 20 0 FIADRP CCC[N@H+](Cc1ccccc1F)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533518054 1099137585 /nfs/dbraw/zinc/13/75/85/1099137585.db2.gz VLWXYWASYKBEFV-UHFFFAOYSA-N 2 0 356.489 4.114 20 0 FIADRP Cc1ccncc1CCC[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000516116560 1099196319 /nfs/dbraw/zinc/19/63/19/1099196319.db2.gz NMGKSZLAUGERFB-FQEVSTJZSA-N 2 0 351.538 4.487 20 0 FIADRP Cc1cc(C)c(NC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)c(C)n1 ZINC000455479006 1099250141 /nfs/dbraw/zinc/25/01/41/1099250141.db2.gz NLILJFHZDKUOJN-UHFFFAOYSA-N 2 0 366.509 4.101 20 0 FIADRP COc1ccc(F)c(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000516197009 1099260257 /nfs/dbraw/zinc/26/02/57/1099260257.db2.gz RVGKVTZJNLWNAT-UHFFFAOYSA-N 2 0 368.452 4.349 20 0 FIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459389756 1099363259 /nfs/dbraw/zinc/36/32/59/1099363259.db2.gz MQWIYDAATPKBDC-IBGZPJMESA-N 2 0 367.537 4.449 20 0 FIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000437083791 1099588876 /nfs/dbraw/zinc/58/88/76/1099588876.db2.gz JDDREDCXJUCMKR-OKYOBFRVSA-N 2 0 354.460 4.464 20 0 FIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000437083790 1099589460 /nfs/dbraw/zinc/58/94/60/1099589460.db2.gz JDDREDCXJUCMKR-MKXGPGLRSA-N 2 0 354.460 4.464 20 0 FIADRP COc1ccc2c(c1)[C@H]([N@@H+](Cc1ccccc1)CC1CC[NH2+]CC1)CCO2 ZINC000261678638 1099638515 /nfs/dbraw/zinc/63/85/15/1099638515.db2.gz IDQBNMCQRXEYNV-JOCHJYFZSA-N 2 0 366.505 4.021 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]CCC(=O)Nc2cccc(F)c2C)c1 ZINC000516645196 1099679368 /nfs/dbraw/zinc/67/93/68/1099679368.db2.gz OKXUIYSWLSQXAY-UHFFFAOYSA-N 2 0 371.500 4.094 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccccc1F ZINC000508692887 1099827420 /nfs/dbraw/zinc/82/74/20/1099827420.db2.gz BPZUNCCJIVRRJS-WSTZPKSXSA-N 2 0 356.485 4.093 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508698489 1099831367 /nfs/dbraw/zinc/83/13/67/1099831367.db2.gz OPJHTDOSPOBOBW-UGKGYDQZSA-N 2 0 352.522 4.046 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)c1 ZINC000162547352 1099837126 /nfs/dbraw/zinc/83/71/26/1099837126.db2.gz QCDYRCUITISPJG-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(OC(F)F)c1 ZINC000162558422 1099842167 /nfs/dbraw/zinc/84/21/67/1099842167.db2.gz HXLCAIQSKWTQKH-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508702247 1099856843 /nfs/dbraw/zinc/85/68/43/1099856843.db2.gz VZBCVXKACOATEQ-GBAAUQCPSA-N 3 0 371.613 4.245 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(-n2ccnc2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703639 1099857654 /nfs/dbraw/zinc/85/76/54/1099857654.db2.gz ZEWFWECILGOBCE-MZKRTTBSSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713917 1099886264 /nfs/dbraw/zinc/88/62/64/1099886264.db2.gz GOOBVPBIKZZVJD-PMOQBDJRSA-N 2 0 352.522 4.000 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711706 1099902533 /nfs/dbraw/zinc/90/25/33/1099902533.db2.gz OZVDSXUEROQNBC-MZKRTTBSSA-N 2 0 366.549 4.374 20 0 FIADRP C[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508711774 1099903565 /nfs/dbraw/zinc/90/35/65/1099903565.db2.gz PDVKWNNWWQQBIQ-MJGOQNOKSA-N 2 0 369.578 4.065 20 0 FIADRP C[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508719421 1099909371 /nfs/dbraw/zinc/90/93/71/1099909371.db2.gz PMBGZVHOMMMZBP-IEBWSBKVSA-N 2 0 371.594 4.483 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000516905214 1099915494 /nfs/dbraw/zinc/91/54/94/1099915494.db2.gz SUEFBQWBFQRFTD-INIZCTEOSA-N 2 0 357.361 4.283 20 0 FIADRP C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722251 1099940258 /nfs/dbraw/zinc/94/02/58/1099940258.db2.gz WWZUFQXBUHBYPC-UYAOXDASSA-N 2 0 352.497 4.358 20 0 FIADRP C/C(=C\c1ccccc1)C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000536665587 1100138826 /nfs/dbraw/zinc/13/88/26/1100138826.db2.gz RXBPCMQCBJQHID-XUTLUUPISA-N 2 0 369.597 4.218 20 0 FIADRP Cc1nc2scc(C3CC3)n2c1C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000459420601 1100138890 /nfs/dbraw/zinc/13/88/90/1100138890.db2.gz YFWKKMMTTAJFNJ-UHFFFAOYSA-N 2 0 372.513 4.072 20 0 FIADRP CC[C@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Oc1cccc(Cl)c1 ZINC000459447974 1100185479 /nfs/dbraw/zinc/18/54/79/1100185479.db2.gz VRTBFCLACOJNTB-LJQANCHMSA-N 2 0 359.901 4.151 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCc2ccc(F)cc21 ZINC000536713246 1100214259 /nfs/dbraw/zinc/21/42/59/1100214259.db2.gz MCZWFHSEWKMLTB-QFIPXVFZSA-N 2 0 353.485 4.447 20 0 FIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000438116805 1100442068 /nfs/dbraw/zinc/44/20/68/1100442068.db2.gz KCRUERIFKQSUOZ-GGAORHGYSA-N 2 0 356.554 4.074 20 0 FIADRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426025596 1100685703 /nfs/dbraw/zinc/68/57/03/1100685703.db2.gz XIHHRLGZCXAWTB-KKSFZXQISA-N 2 0 368.912 4.450 20 0 FIADRP Cc1ccc2cc([C@@H](C)[NH2+]CC3(N4CCCCC4)CC[NH+](C)CC3)oc2c1 ZINC000426071395 1100779896 /nfs/dbraw/zinc/77/98/96/1100779896.db2.gz HUJVDWPEYLAOTH-LJQANCHMSA-N 2 0 369.553 4.342 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC[NH2+]1 ZINC000414955340 1100925358 /nfs/dbraw/zinc/92/53/58/1100925358.db2.gz UCBTVDKIRBWRQE-STQMWFEESA-N 2 0 365.340 4.408 20 0 FIADRP Cc1cnn(-c2cc[nH+]cc2N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000518236803 1101035977 /nfs/dbraw/zinc/03/59/77/1101035977.db2.gz ZSYDPMBQPJPBAP-AZUAARDMSA-N 2 0 361.493 4.041 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1)c1ccc(Cl)cc1 ZINC000414974498 1101078046 /nfs/dbraw/zinc/07/80/46/1101078046.db2.gz NPUAVGJKFULOKZ-LJQANCHMSA-N 2 0 371.912 4.214 20 0 FIADRP CC1(C)Cc2ccc(Br)cc2[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000426335054 1101288336 /nfs/dbraw/zinc/28/83/36/1101288336.db2.gz NKPOUSQBKFKIPI-RYRKJORJSA-N 2 0 363.343 4.289 20 0 FIADRP c1[nH]c(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)nc1-c1ccccc1 ZINC000194260517 1101309608 /nfs/dbraw/zinc/30/96/08/1101309608.db2.gz NUUMGQPLJZRGBY-UHFFFAOYSA-N 2 0 360.505 4.079 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459706667 1101325205 /nfs/dbraw/zinc/32/52/05/1101325205.db2.gz HZTZKLQUKRBFDY-IPJUCJBFSA-N 2 0 350.497 4.496 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001168149103 1101343879 /nfs/dbraw/zinc/34/38/79/1101343879.db2.gz KCPHLAAJBMZSQF-OAHLLOKOSA-N 2 0 366.958 4.449 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000536962032 1101359193 /nfs/dbraw/zinc/35/91/93/1101359193.db2.gz YEDWOPWMMICEHT-GOSISDBHSA-N 2 0 351.332 4.146 20 0 FIADRP CSc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)s1 ZINC000518623038 1101364562 /nfs/dbraw/zinc/36/45/62/1101364562.db2.gz OYQIMNCZSFVDJR-UHFFFAOYSA-N 2 0 362.564 4.233 20 0 FIADRP Cc1nc2ccc(C[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)cc2s1 ZINC000426357473 1101364951 /nfs/dbraw/zinc/36/49/51/1101364951.db2.gz QPKCIQBUPMTTHG-UHFFFAOYSA-N 2 0 366.534 4.348 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013843 1101393110 /nfs/dbraw/zinc/39/31/10/1101393110.db2.gz SKVHNSHPAWIEIK-BHDDXSALSA-N 2 0 360.517 4.024 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)C1 ZINC000537014669 1101395212 /nfs/dbraw/zinc/39/52/12/1101395212.db2.gz WJARBFWHJIKNLO-UZLBHIALSA-N 2 0 359.514 4.188 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC1 ZINC000537193199 1101527750 /nfs/dbraw/zinc/52/77/50/1101527750.db2.gz VLUGPMJSRORYHB-ZLNRFVROSA-N 2 0 356.554 4.275 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCc3cc(F)ccc31)c1ccccc1O2 ZINC000537190024 1101541357 /nfs/dbraw/zinc/54/13/57/1101541357.db2.gz OFRYIDNGDILHQC-NHCUHLMSSA-N 2 0 366.480 4.391 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000415001248 1101551396 /nfs/dbraw/zinc/55/13/96/1101551396.db2.gz KSALZNMZULKSPC-DOTOQJQBSA-N 2 0 371.912 4.199 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]C[C@H]2CCCOC2)c1 ZINC000537242042 1101581305 /nfs/dbraw/zinc/58/13/05/1101581305.db2.gz PRGNUWRCOSKZCX-OAQYLSRUSA-N 2 0 364.533 4.466 20 0 FIADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3ccnc3C)c(F)c2)cc1 ZINC000181997309 1101602074 /nfs/dbraw/zinc/60/20/74/1101602074.db2.gz LSWVGUGDKOPWPO-CQSZACIVSA-N 2 0 366.440 4.129 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000537293673 1101615573 /nfs/dbraw/zinc/61/55/73/1101615573.db2.gz ABRWAARVWNPBON-WIYYLYMNSA-N 2 0 363.565 4.166 20 0 FIADRP C[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)Cc1cccs1 ZINC000537312956 1101644035 /nfs/dbraw/zinc/64/40/35/1101644035.db2.gz WUADSSIMVAWISE-SFHVURJKSA-N 2 0 371.594 4.247 20 0 FIADRP CC[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CCO1 ZINC000648446708 1101706926 /nfs/dbraw/zinc/70/69/26/1101706926.db2.gz PQTKYSUARUHPTN-RTBURBONSA-N 2 0 350.934 4.099 20 0 FIADRP C[NH+]1CCC(N2CC[C@@H]([NH2+][C@@H]3CC=C(c4ccc(Cl)cc4)CC3)C2)CC1 ZINC000648450467 1101718776 /nfs/dbraw/zinc/71/87/76/1101718776.db2.gz NJXYQCCGHPEASS-NHCUHLMSSA-N 2 0 373.972 4.034 20 0 FIADRP COc1ccccc1CC1([NH3+])CC[NH+]([C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168168768 1101831304 /nfs/dbraw/zinc/83/13/04/1101831304.db2.gz VJCIWJPNOQJPER-QGZVFWFLSA-N 2 0 372.940 4.316 20 0 FIADRP Fc1ccccc1COc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000248771090 1101891303 /nfs/dbraw/zinc/89/13/03/1101891303.db2.gz QXFQTKUSFIJWAM-PMACEKPBSA-N 2 0 354.469 4.121 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2ccc(OC)c(SC(F)(F)F)c2)CC1 ZINC000262005517 1102014725 /nfs/dbraw/zinc/01/47/25/1102014725.db2.gz RIYJBHKYZDKHKS-UHFFFAOYSA-N 2 0 362.461 4.129 20 0 FIADRP Fc1ccc(C2([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)cc1 ZINC000643467816 1102182153 /nfs/dbraw/zinc/18/21/53/1102182153.db2.gz UANDURNAVOHFBR-TZIWHRDSSA-N 2 0 352.453 4.050 20 0 FIADRP Fc1ccc(C2([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)cc1 ZINC000643467813 1102182753 /nfs/dbraw/zinc/18/27/53/1102182753.db2.gz UANDURNAVOHFBR-CTNGQTDRSA-N 2 0 352.453 4.050 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000467399098 1102230357 /nfs/dbraw/zinc/23/03/57/1102230357.db2.gz CYLUZKLHCNGIGD-APWZRJJASA-N 2 0 372.475 4.240 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000120582756 1102235884 /nfs/dbraw/zinc/23/58/84/1102235884.db2.gz CCUNYXMXTUPKRI-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP CN1CC[C@H]([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000550796836 1102328756 /nfs/dbraw/zinc/32/87/56/1102328756.db2.gz CXTJJYSDAPWWDG-MLCQCVOFSA-N 2 0 350.506 4.189 20 0 FIADRP CN1CC[C@@H]([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000550796833 1102329314 /nfs/dbraw/zinc/32/93/14/1102329314.db2.gz CXTJJYSDAPWWDG-AFXVXQJMSA-N 2 0 350.506 4.189 20 0 FIADRP CN(Cc1cnc(C(C)(C)C)s1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000537632829 1102329485 /nfs/dbraw/zinc/32/94/85/1102329485.db2.gz UKJHUOIBCMLWKH-SFHVURJKSA-N 2 0 357.567 4.395 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1 ZINC000532446324 1102336868 /nfs/dbraw/zinc/33/68/68/1102336868.db2.gz FTYFJNNBCHUJQI-CKEIUWERSA-N 2 0 353.348 4.045 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000532447321 1102339120 /nfs/dbraw/zinc/33/91/20/1102339120.db2.gz BFAQJRJXEYZZSD-SFHVURJKSA-N 2 0 371.956 4.328 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000519540572 1102367642 /nfs/dbraw/zinc/36/76/42/1102367642.db2.gz LPIUDSLAYWCMMO-QZTJIDSGSA-N 2 0 365.521 4.011 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCCN(C)C2)CCC3)cc1 ZINC000532507026 1102434547 /nfs/dbraw/zinc/43/45/47/1102434547.db2.gz LAKPLADTRYVWQC-SJLPKXTDSA-N 2 0 355.551 4.427 20 0 FIADRP CC(C)C[C@@H](CC(=O)OC(C)(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167973088 1102524931 /nfs/dbraw/zinc/52/49/31/1102524931.db2.gz GGUIROJFWSUPFJ-UMQXSMKFSA-N 2 0 364.574 4.128 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1C(F)(F)F ZINC000122348042 1102561682 /nfs/dbraw/zinc/56/16/82/1102561682.db2.gz VTGYJDOMVHSSQG-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000122300591 1102561740 /nfs/dbraw/zinc/56/17/40/1102561740.db2.gz RZWOJQBHBWOMFD-IBGZPJMESA-N 2 0 374.912 4.284 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000122368128 1102568630 /nfs/dbraw/zinc/56/86/30/1102568630.db2.gz KKPUYQNSRHHPMK-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)cc12 ZINC001648986124 1102586102 /nfs/dbraw/zinc/58/61/02/1102586102.db2.gz PEMWQHRJIXYMIJ-UHFFFAOYSA-N 2 0 364.493 4.197 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001168251493 1102648349 /nfs/dbraw/zinc/64/83/49/1102648349.db2.gz KGCKBYAYEGITHZ-QFIPXVFZSA-N 2 0 356.554 4.044 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000550881720 1102652066 /nfs/dbraw/zinc/65/20/66/1102652066.db2.gz BFOHWTZCDGSBII-BLLLJJGKSA-N 2 0 373.766 4.310 20 0 FIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cnc(-c3ccc(C)cc3)s2)C1 ZINC000537649018 1102688825 /nfs/dbraw/zinc/68/88/25/1102688825.db2.gz BHSOWANPNQXUCR-IBGZPJMESA-N 2 0 373.566 4.051 20 0 FIADRP C[C@@H](c1cnccn1)[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837038 1102697007 /nfs/dbraw/zinc/69/70/07/1102697007.db2.gz YYANQLCFTMVPCB-PGRDOPGGSA-N 2 0 364.537 4.160 20 0 FIADRP COc1ccccc1CC(C)(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167978121 1102728699 /nfs/dbraw/zinc/72/86/99/1102728699.db2.gz JKWQJWHBXKXJIB-SEJPIABJSA-N 2 0 356.554 4.259 20 0 FIADRP Brc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)s1 ZINC001167978268 1102742173 /nfs/dbraw/zinc/74/21/73/1102742173.db2.gz NPNAGGCSSMSAFB-GOOCMWNKSA-N 2 0 369.372 4.048 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@]1(C)CCCO1 ZINC000550999416 1102758378 /nfs/dbraw/zinc/75/83/78/1102758378.db2.gz QKGFAPCJOWRYRY-WZONZLPQSA-N 2 0 352.522 4.462 20 0 FIADRP COc1ccc(CCC[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1OC ZINC000551007858 1102759678 /nfs/dbraw/zinc/75/96/78/1102759678.db2.gz SDUIRPOQLQZBRG-LEWJYISDSA-N 2 0 368.521 4.062 20 0 FIADRP C[C@H](NC1CC[NH+](C[C@H]2CCCO2)CC1)c1cc(Cl)ccc1Cl ZINC000655755971 1102765221 /nfs/dbraw/zinc/76/52/21/1102765221.db2.gz JUXIFKXEJXLNKI-XJKSGUPXSA-N 2 0 357.325 4.287 20 0 FIADRP CSC1(C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)CC[NH+](C)CC1 ZINC000519569824 1102779498 /nfs/dbraw/zinc/77/94/98/1102779498.db2.gz AYQQUDOPUQXXDE-KRWDZBQOSA-N 2 0 368.974 4.279 20 0 FIADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550269989 1102895101 /nfs/dbraw/zinc/89/51/01/1102895101.db2.gz DSIXPJMPYNOAPN-AKIFATBCSA-N 2 0 370.581 4.331 20 0 FIADRP Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)CCC2 ZINC000359892379 1102901064 /nfs/dbraw/zinc/90/10/64/1102901064.db2.gz BGIUMOSVYZZDAZ-KSSFIOAISA-N 2 0 359.539 4.120 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000506867265 1102919278 /nfs/dbraw/zinc/91/92/78/1102919278.db2.gz MAPFRNARNPOPCB-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000506912147 1102949694 /nfs/dbraw/zinc/94/96/94/1102949694.db2.gz ZBAPQBOENZAYQO-UHFFFAOYSA-N 2 0 366.553 4.304 20 0 FIADRP C[C@@H](C(=O)N(C)c1ccccc1)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000476985650 1103003678 /nfs/dbraw/zinc/00/36/78/1103003678.db2.gz OJTFPMZTAADFNR-PMACEKPBSA-N 2 0 371.569 4.014 20 0 FIADRP CC1(C)Cc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)ccc2O1 ZINC000729678531 1103027918 /nfs/dbraw/zinc/02/79/18/1103027918.db2.gz LNBUFTYBWWODPN-UHFFFAOYSA-N 2 0 350.506 4.286 20 0 FIADRP CC1(C)Cc2cc(C[NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)ccc2O1 ZINC000729679683 1103042320 /nfs/dbraw/zinc/04/23/20/1103042320.db2.gz OGLYSBWRZSXPRJ-OAQYLSRUSA-N 2 0 364.533 4.054 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)ccc1O ZINC000459378913 1103045249 /nfs/dbraw/zinc/04/52/49/1103045249.db2.gz RTVURDLTDYZWBW-GOSISDBHSA-N 2 0 368.521 4.455 20 0 FIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[C@H](O)Cc1ccccc1 ZINC000551316879 1103073307 /nfs/dbraw/zinc/07/33/07/1103073307.db2.gz NVQNQYWHZUNPAX-DLQXEOFGSA-N 2 0 366.549 4.011 20 0 FIADRP Cc1cc(Cl)ccc1OCCC[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459381168 1103096986 /nfs/dbraw/zinc/09/69/86/1103096986.db2.gz AIQUSXOXTORPHH-UHFFFAOYSA-N 2 0 359.901 4.071 20 0 FIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000459382340 1103098480 /nfs/dbraw/zinc/09/84/80/1103098480.db2.gz DHSDRHOKKYZLMP-CEYISNLHSA-N 2 0 362.517 4.495 20 0 FIADRP Cc1noc(C)c1C[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652436 1103310066 /nfs/dbraw/zinc/31/00/66/1103310066.db2.gz CSYDHKLPYCEYCN-KQLYMOGASA-N 2 0 353.510 4.008 20 0 FIADRP COc1ncc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC000551539828 1103318357 /nfs/dbraw/zinc/31/83/57/1103318357.db2.gz HBBSMKMJCUFRLK-OWCLPIDISA-N 2 0 353.938 4.152 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccc(F)cc2)cc1 ZINC000507428969 1103380922 /nfs/dbraw/zinc/38/09/22/1103380922.db2.gz MMGFOLLBXPNYCZ-OAQYLSRUSA-N 2 0 356.485 4.245 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000507430749 1103383634 /nfs/dbraw/zinc/38/36/34/1103383634.db2.gz UKCYZHZXGOSJJN-QRWLVFNGSA-N 2 0 362.439 4.147 20 0 FIADRP C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551574820 1103385646 /nfs/dbraw/zinc/38/56/46/1103385646.db2.gz RXMWAXSTFWIOJO-HNNXBMFYSA-N 2 0 358.448 4.370 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCCOC1 ZINC000507469523 1103416439 /nfs/dbraw/zinc/41/64/39/1103416439.db2.gz KNYJZZJHIBIXIK-AVRDEDQJSA-N 2 0 352.522 4.320 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(n2cc(Cl)cn2)CC1 ZINC000507719582 1103634927 /nfs/dbraw/zinc/63/49/27/1103634927.db2.gz BIBIFXYQWTYQLO-UHFFFAOYSA-N 2 0 374.960 4.332 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000551790578 1103662760 /nfs/dbraw/zinc/66/27/60/1103662760.db2.gz CQJVYHWXZICHQU-TZYHBYERSA-N 2 0 374.569 4.284 20 0 FIADRP C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551817231 1103676127 /nfs/dbraw/zinc/67/61/27/1103676127.db2.gz OQXDBXUPQXKHRJ-GLYQVZKVSA-N 2 0 364.533 4.441 20 0 FIADRP Cc1ccsc1[C@@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000519780541 1103865156 /nfs/dbraw/zinc/86/51/56/1103865156.db2.gz XTGHCXZOPGZLER-SOAGJPPSSA-N 2 0 358.551 4.123 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3c2ccc(OC)c3F)cc1 ZINC000519841010 1103894876 /nfs/dbraw/zinc/89/48/76/1103894876.db2.gz BTLBJEPPXGEWLW-FQEVSTJZSA-N 2 0 356.485 4.453 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)C1 ZINC000520391827 1104321323 /nfs/dbraw/zinc/32/13/23/1104321323.db2.gz SLPPMXFEFROAIU-QFIPXVFZSA-N 2 0 352.522 4.130 20 0 FIADRP c1cc(SC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)ccn1 ZINC001167994832 1104484858 /nfs/dbraw/zinc/48/48/58/1104484858.db2.gz QOBDVFNKEHHYRK-DFNIBXOVSA-N 2 0 357.567 4.044 20 0 FIADRP C[C@H]1C[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC[C@@]1(C)c1cccc(O)c1 ZINC001167994646 1104497018 /nfs/dbraw/zinc/49/70/18/1104497018.db2.gz IQIPLOBACVEFTO-AYDDWDILSA-N 2 0 368.565 4.397 20 0 FIADRP C[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000507772680 1104959702 /nfs/dbraw/zinc/95/97/02/1104959702.db2.gz HPUMJZGQGSOTLP-GOSISDBHSA-N 2 0 370.512 4.017 20 0 FIADRP Fc1ccc2c(c1)c1c(n2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C[NH2+]CC1 ZINC001168002174 1104970647 /nfs/dbraw/zinc/97/06/47/1104970647.db2.gz PBJNIKALDXTTMA-JWTNVVGKSA-N 2 0 353.485 4.004 20 0 FIADRP CC[C@@H]1C[C@@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCO1 ZINC000507792727 1105081166 /nfs/dbraw/zinc/08/11/66/1105081166.db2.gz GAXXTPCLVXJCIS-FCHUYYIVSA-N 2 0 356.554 4.180 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152396364 1105082560 /nfs/dbraw/zinc/08/25/60/1105082560.db2.gz CIESYYXQQVODRH-ZFWWWQNUSA-N 2 0 359.514 4.393 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(N(C)C)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008141 1105168202 /nfs/dbraw/zinc/16/82/02/1105168202.db2.gz CVOUUWYVUFHJQD-JHDGKUDLSA-N 2 0 365.565 4.326 20 0 FIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000067450052 1105173085 /nfs/dbraw/zinc/17/30/85/1105173085.db2.gz YGTPWUZTRDLMRL-UHFFFAOYSA-N 2 0 362.521 4.311 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000152426559 1105173776 /nfs/dbraw/zinc/17/37/76/1105173776.db2.gz CRSFCTZBWZCCCZ-KSSFIOAISA-N 2 0 371.525 4.401 20 0 FIADRP COc1ccccc1CC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168008514 1105194538 /nfs/dbraw/zinc/19/45/38/1105194538.db2.gz XHGSAFGJQXQTJI-RTBURBONSA-N 2 0 352.522 4.269 20 0 FIADRP Clc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000665234010 1105227471 /nfs/dbraw/zinc/22/74/71/1105227471.db2.gz VNRZJFRYTGJECL-PIKOESSRSA-N 2 0 361.961 4.067 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](CCC(=O)Nc2cccc3ccccc32)CC1 ZINC000507967526 1105283467 /nfs/dbraw/zinc/28/34/67/1105283467.db2.gz POSLPLOEZKIDQP-UHFFFAOYSA-N 2 0 367.537 4.222 20 0 FIADRP c1cc(-c2ccccc2)sc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530249875 1106930234 /nfs/dbraw/zinc/93/02/34/1106930234.db2.gz ZOQWXPONEPMTCG-IBGZPJMESA-N 2 0 356.535 4.006 20 0 FIADRP COc1cc(C[NH+]2CCC(CF)CC2)cc(C[NH+]2CCC(CF)CC2)c1 ZINC000451399640 1107074082 /nfs/dbraw/zinc/07/40/82/1107074082.db2.gz ZPPIYDLXIOPNKZ-UHFFFAOYSA-N 2 0 366.496 4.058 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475543935 1107714959 /nfs/dbraw/zinc/71/49/59/1107714959.db2.gz BCLSEKIPPVQSPY-RPCJCACASA-N 2 0 357.542 4.134 20 0 FIADRP CCc1nc(C)c(CN2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)o1 ZINC000428366701 1107898897 /nfs/dbraw/zinc/89/88/97/1107898897.db2.gz YWLBLOUMVNMRIY-PMACEKPBSA-N 2 0 353.510 4.032 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000531677182 1108065752 /nfs/dbraw/zinc/06/57/52/1108065752.db2.gz CIUJAMKDMXNHML-HMXCVIKNSA-N 2 0 359.558 4.049 20 0 FIADRP Cn1nccc1-c1ccccc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508504552 1108066131 /nfs/dbraw/zinc/06/61/31/1108066131.db2.gz NASUXRGCXLCIAG-OAQYLSRUSA-N 2 0 374.532 4.041 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccc(-c3ccsc3)cc2)CCN1C1CC[NH+](C)CC1 ZINC000444679793 1108081391 /nfs/dbraw/zinc/08/13/91/1108081391.db2.gz CIZSLLITWHMVTK-GOSISDBHSA-N 2 0 369.578 4.015 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCc4ccccc43)CC2)cc1 ZINC000531738323 1108107319 /nfs/dbraw/zinc/10/73/19/1108107319.db2.gz JVQSUDARVUVZTK-XMMPIXPASA-N 2 0 364.533 4.335 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC(C[NH+](C)C(C)C)CC2)cc1)C(C)C ZINC000523422323 1108208956 /nfs/dbraw/zinc/20/89/56/1108208956.db2.gz NWCALEUTAUDOMX-UHFFFAOYSA-N 2 0 373.585 4.109 20 0 FIADRP CC[C@@H](c1ccc(F)cc1F)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000523440565 1108225831 /nfs/dbraw/zinc/22/58/31/1108225831.db2.gz PDYHRSZWKDEDKU-MRUHUIDDSA-N 2 0 366.496 4.237 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2sccc21 ZINC000453197025 1108267738 /nfs/dbraw/zinc/26/77/38/1108267738.db2.gz MSFCCULGYPBWHB-LKUPVBHCSA-N 2 0 370.562 4.433 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453214562 1108284318 /nfs/dbraw/zinc/28/43/18/1108284318.db2.gz DNAFQOZSMDACHO-FUHWJXTLSA-N 2 0 356.535 4.167 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncn1 ZINC000453231312 1108304023 /nfs/dbraw/zinc/30/40/23/1108304023.db2.gz XTVHCCYALQEPPH-VLCCKYJDSA-N 2 0 370.928 4.395 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944984 1108388880 /nfs/dbraw/zinc/38/88/80/1108388880.db2.gz PDXVSOGYFUOHMB-QGZVFWFLSA-N 2 0 368.525 4.129 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCOC3(CCC3)C2)CC1 ZINC000453321989 1108414036 /nfs/dbraw/zinc/41/40/36/1108414036.db2.gz QCOWUSCDQGQZFF-HWELCPFYSA-N 2 0 356.554 4.369 20 0 FIADRP CCC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000531965237 1108461147 /nfs/dbraw/zinc/46/11/47/1108461147.db2.gz DKSJZAXDHVRPAC-GOTSBHOMSA-N 2 0 351.538 4.106 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)C1 ZINC000531970628 1108478379 /nfs/dbraw/zinc/47/83/79/1108478379.db2.gz YSALLGHHCLDMPB-QGZVFWFLSA-N 2 0 358.476 4.050 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CC(C)(C)OC1(C)C ZINC000531980901 1108496131 /nfs/dbraw/zinc/49/61/31/1108496131.db2.gz FZBHREFOYWYALR-HXUWFJFHSA-N 2 0 356.510 4.347 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H](c1ccc(Br)s1)C1CC1)C1CC1 ZINC000453420452 1108545217 /nfs/dbraw/zinc/54/52/17/1108545217.db2.gz ZOHMIRVJPJLFSN-INIZCTEOSA-N 2 0 357.361 4.426 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000532192542 1108702135 /nfs/dbraw/zinc/70/21/35/1108702135.db2.gz UXSKRKNOLPITTE-IBGZPJMESA-N 2 0 354.542 4.343 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc21 ZINC000532214180 1108715844 /nfs/dbraw/zinc/71/58/44/1108715844.db2.gz ZIEZTFWGBDNVFD-VEXUSMLFSA-N 2 0 363.549 4.203 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000532215508 1108717795 /nfs/dbraw/zinc/71/77/95/1108717795.db2.gz BFIZLBVIFCTQDK-QZTJIDSGSA-N 2 0 355.501 4.379 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)CCCC2)cc1C ZINC000532249247 1108727810 /nfs/dbraw/zinc/72/78/10/1108727810.db2.gz ROTPBWMSZQUJSY-SVFBPWRDSA-N 2 0 371.569 4.121 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428451633 1109313621 /nfs/dbraw/zinc/31/36/21/1109313621.db2.gz DBPXCDOFHYGIPL-OEMFJLHTSA-N 2 0 369.597 4.140 20 0 FIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446889431 1109378136 /nfs/dbraw/zinc/37/81/36/1109378136.db2.gz WYTRQNQZGFFNGU-LLHWWHOWSA-N 2 0 356.554 4.427 20 0 FIADRP Fc1ccc(COc2cccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)c2)cc1 ZINC000446885134 1109382110 /nfs/dbraw/zinc/38/21/10/1109382110.db2.gz UEOQOYOJNRONNQ-UHFFFAOYSA-N 2 0 368.496 4.369 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OC ZINC000446886034 1109382770 /nfs/dbraw/zinc/38/27/70/1109382770.db2.gz DDXVQFVDELGBTH-UHFFFAOYSA-N 2 0 366.933 4.101 20 0 FIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446884635 1109382780 /nfs/dbraw/zinc/38/27/80/1109382780.db2.gz PTIZRVZDUISCJU-HNNXBMFYSA-N 2 0 354.460 4.491 20 0 FIADRP FC(F)(F)c1ccc(C2CC([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000446885360 1109382940 /nfs/dbraw/zinc/38/29/40/1109382940.db2.gz VVGQVEAGOVCCDV-UHFFFAOYSA-N 2 0 352.444 4.415 20 0 FIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887031 1109383104 /nfs/dbraw/zinc/38/31/04/1109383104.db2.gz NAKUBCFYNPFRAN-UHFFFAOYSA-N 2 0 350.506 4.326 20 0 FIADRP CCC1(C[NH2+][C@H](C)c2nccnc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000446924581 1109391006 /nfs/dbraw/zinc/39/10/06/1109391006.db2.gz HSHWKAQMBUYYFO-LJQANCHMSA-N 2 0 352.526 4.128 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c(C)o1 ZINC000447543379 1109574139 /nfs/dbraw/zinc/57/41/39/1109574139.db2.gz RXSGRZYEZGNEMS-KURKYZTESA-N 2 0 356.510 4.356 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CC2)s1 ZINC000447570473 1109577633 /nfs/dbraw/zinc/57/76/33/1109577633.db2.gz TVIDTDOIIYHHSV-QGZVFWFLSA-N 2 0 369.372 4.426 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2c(-c3ccccc3)nc3ccccn32)C[C@H]1C ZINC000448097866 1109723607 /nfs/dbraw/zinc/72/36/07/1109723607.db2.gz RCPLERQPWSQHOT-QUCCMNQESA-N 2 0 362.521 4.306 20 0 FIADRP COc1cccc([C@H](C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)OC)c1 ZINC000527732916 1109813853 /nfs/dbraw/zinc/81/38/53/1109813853.db2.gz BOGCHZXLPSRYPP-ZEYPLWLESA-N 2 0 368.521 4.025 20 0 FIADRP Cc1cc(N2CCC([NH2+][C@H]3CCc4cc(F)c(Cl)cc43)CC2)nc(C)n1 ZINC000527870835 1109844955 /nfs/dbraw/zinc/84/49/55/1109844955.db2.gz OQYDTOKZCCYAKI-IBGZPJMESA-N 2 0 374.891 4.132 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC(Nc2cccc(C[NH+](C)C)c2)CC1 ZINC000449040106 1109963056 /nfs/dbraw/zinc/96/30/56/1109963056.db2.gz GILHLXFAIBXXBI-LJQANCHMSA-N 2 0 351.538 4.256 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(-n3ccnc3)c2)CC1 ZINC000449059562 1109964967 /nfs/dbraw/zinc/96/49/67/1109964967.db2.gz QFVHDKMAOZGRBE-FQEVSTJZSA-N 2 0 374.532 4.058 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCc2ccc(O)cc2)CC1 ZINC000449138770 1109984380 /nfs/dbraw/zinc/98/43/80/1109984380.db2.gz DFRIHPLRVWRPRF-IBGZPJMESA-N 2 0 352.522 4.010 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000449156183 1109987010 /nfs/dbraw/zinc/98/70/10/1109987010.db2.gz CWDJVSXOEGBEPS-FQEVSTJZSA-N 2 0 364.533 4.253 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)CC1 ZINC000449188019 1109991079 /nfs/dbraw/zinc/99/10/79/1109991079.db2.gz FNRPMCNEUAZUKA-NQIIRXRSSA-N 2 0 368.631 4.310 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2n2cccn2)CC1 ZINC000449188602 1109995065 /nfs/dbraw/zinc/99/50/65/1109995065.db2.gz SMYCPGZMJPIHBH-OIBXWCBGSA-N 2 0 366.553 4.052 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2COc3ccccc32)CC1 ZINC000449204384 1109995121 /nfs/dbraw/zinc/99/51/21/1109995121.db2.gz JACAFEWVUXJAFG-MSYCTHLASA-N 2 0 364.533 4.236 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000449201593 1109997891 /nfs/dbraw/zinc/99/78/91/1109997891.db2.gz IRRQBDLIDMBEKO-UHFFFAOYSA-N 2 0 365.493 4.298 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cnc(CCc3ccccc3)s2)c1 ZINC000449218838 1109999984 /nfs/dbraw/zinc/99/99/84/1109999984.db2.gz LFFSEGLEEGIJIF-UHFFFAOYSA-N 2 0 365.546 4.280 20 0 FIADRP Cc1csc([C@@H](C)C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)n1 ZINC000449239609 1110009249 /nfs/dbraw/zinc/00/92/49/1110009249.db2.gz WGAQVWMJMMSPBK-FUHWJXTLSA-N 2 0 357.567 4.240 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC23CCOCC3)CC1 ZINC000449308250 1110023113 /nfs/dbraw/zinc/02/31/13/1110023113.db2.gz VSYOKUFCYZIZHF-DENIHFKCSA-N 2 0 356.554 4.021 20 0 FIADRP CSC1(C[NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH+](C)CC1 ZINC000449339734 1110042537 /nfs/dbraw/zinc/04/25/37/1110042537.db2.gz UZISPJASNCXWPP-SJLPKXTDSA-N 2 0 352.975 4.393 20 0 FIADRP CC1(C)C[N@H+](Cc2cncs2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413884 1110055849 /nfs/dbraw/zinc/05/58/49/1110055849.db2.gz KNFRCVCXQJYZOR-HXUWFJFHSA-N 2 0 355.551 4.266 20 0 FIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cnc(-c2c(F)cccc2F)s1 ZINC000449527298 1110099868 /nfs/dbraw/zinc/09/98/68/1110099868.db2.gz HJUQUDOAHXCZRD-UHFFFAOYSA-N 2 0 353.482 4.298 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)cc2)cs1 ZINC000449527606 1110100015 /nfs/dbraw/zinc/10/00/15/1110100015.db2.gz JSKOQECJVQKUQD-UHFFFAOYSA-N 2 0 361.555 4.241 20 0 FIADRP COc1ccc(Oc2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)cc1 ZINC000449560013 1110110398 /nfs/dbraw/zinc/11/03/98/1110110398.db2.gz FBGAGZXXVCVCAL-YQQQUEKLSA-N 2 0 352.478 4.202 20 0 FIADRP COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000449619379 1110127372 /nfs/dbraw/zinc/12/73/72/1110127372.db2.gz PGVLMAIIYGCTMK-AWDZXFJFSA-N 2 0 364.533 4.441 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2)c1 ZINC000538709423 1111255969 /nfs/dbraw/zinc/25/59/69/1111255969.db2.gz JHOFVRWLPMMRDG-XMMPIXPASA-N 2 0 365.565 4.010 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ncc(C)c(OC)c2C)CC1)CC1CC1 ZINC000538948638 1111356028 /nfs/dbraw/zinc/35/60/28/1111356028.db2.gz IVQLVHXBCUUVME-UHFFFAOYSA-N 2 0 359.558 4.041 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000539063651 1111408811 /nfs/dbraw/zinc/40/88/11/1111408811.db2.gz PQRSJOFMZFBLGB-VAMGGRTRSA-N 2 0 370.562 4.246 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)ccn1 ZINC000539047291 1111411555 /nfs/dbraw/zinc/41/15/55/1111411555.db2.gz MZZJQYOSLHKFCQ-FQEVSTJZSA-N 2 0 373.928 4.233 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCCO2 ZINC000539046297 1111411673 /nfs/dbraw/zinc/41/16/73/1111411673.db2.gz HYFIAMJKWQWAKA-QHGAOEGBSA-N 2 0 358.526 4.152 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2ccccc2-c2ccc(Cn3cccn3)cc2)CC1 ZINC000462026129 1111461886 /nfs/dbraw/zinc/46/18/86/1111461886.db2.gz HMTRDFYDIJEIJW-UHFFFAOYSA-N 2 0 374.532 4.172 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000539202040 1111469478 /nfs/dbraw/zinc/46/94/78/1111469478.db2.gz JNJRQDKMMPVQBV-JOCHJYFZSA-N 2 0 356.485 4.397 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC1 ZINC000462030690 1111474039 /nfs/dbraw/zinc/47/40/39/1111474039.db2.gz ICXAZMNIIMSXNP-UHFFFAOYSA-N 2 0 374.532 4.172 20 0 FIADRP Clc1ccc2c(c1)OCCC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539311933 1111508250 /nfs/dbraw/zinc/50/82/50/1111508250.db2.gz GBIBBDDKMRTFPB-HXUWFJFHSA-N 2 0 371.912 4.455 20 0 FIADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000552056186 1111559819 /nfs/dbraw/zinc/55/98/19/1111559819.db2.gz VWGDNNFWMGWYJE-GMKZXUHWSA-N 2 0 363.549 4.213 20 0 FIADRP Cc1ccc2nc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)cn2c1 ZINC000552060360 1111561951 /nfs/dbraw/zinc/56/19/51/1111561951.db2.gz PSGJAXPCIBJRCB-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C[C@H]4CCC5(CCCC5)O4)C3)C2)cc1 ZINC000552156932 1111595660 /nfs/dbraw/zinc/59/56/60/1111595660.db2.gz CJWDRZLQARPWLJ-FGZHOGPDSA-N 2 0 354.538 4.076 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000477918425 1111609325 /nfs/dbraw/zinc/60/93/25/1111609325.db2.gz PPTKAJSQWDWRBQ-SFHVURJKSA-N 2 0 366.505 4.498 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC000552266427 1111642214 /nfs/dbraw/zinc/64/22/14/1111642214.db2.gz MCXDBVRUASHWAI-QFIPXVFZSA-N 2 0 367.537 4.086 20 0 FIADRP COCCC[C@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Cl)cc1 ZINC000552319720 1111667360 /nfs/dbraw/zinc/66/73/60/1111667360.db2.gz OWVUHRUIUFIBNZ-LJQANCHMSA-N 2 0 364.961 4.314 20 0 FIADRP CCC[N@H+](C)[C@@H](CNC1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000552325373 1111670144 /nfs/dbraw/zinc/67/01/44/1111670144.db2.gz UDAWHMOMADYRRQ-FQEVSTJZSA-N 2 0 351.966 4.185 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000478387881 1111765355 /nfs/dbraw/zinc/76/53/55/1111765355.db2.gz SHSNAYHSLMBOEI-UHFFFAOYSA-N 2 0 370.512 4.295 20 0 FIADRP Clc1ccccc1COc1cccc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000097287795 1111935756 /nfs/dbraw/zinc/93/57/56/1111935756.db2.gz HWRCDAXXTNGMMA-GOSISDBHSA-N 2 0 370.924 4.493 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc(F)ccc1F ZINC000479364083 1112001381 /nfs/dbraw/zinc/00/13/81/1112001381.db2.gz VUHHYMZSHVRVSD-OAQYLSRUSA-N 2 0 362.464 4.392 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000479463029 1112033478 /nfs/dbraw/zinc/03/34/78/1112033478.db2.gz HUWVMKYEFSKFQQ-CTNGQTDRSA-N 2 0 366.505 4.021 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000479491366 1112044818 /nfs/dbraw/zinc/04/48/18/1112044818.db2.gz PYDCPJXRKNYDQI-HTWSVDAQSA-N 2 0 356.407 4.208 20 0 FIADRP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)C1 ZINC000553715924 1112064506 /nfs/dbraw/zinc/06/45/06/1112064506.db2.gz MUMSLNUMWDOWPN-WPYKKVEZSA-N 2 0 369.597 4.107 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000479561270 1112072795 /nfs/dbraw/zinc/07/27/95/1112072795.db2.gz TWTQGFRGGVNRRM-UHFFFAOYSA-N 2 0 367.537 4.359 20 0 FIADRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1ccc(OCc2ccccn2)cc1 ZINC000479793062 1112144557 /nfs/dbraw/zinc/14/45/57/1112144557.db2.gz OYYYTWCLACBRAO-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)[C@H](C)C1 ZINC000479875398 1112173889 /nfs/dbraw/zinc/17/38/89/1112173889.db2.gz QHTBCKWFIUQCRM-GJYPPUQNSA-N 2 0 372.475 4.493 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2C[NH+](C)C)cc1 ZINC000554727669 1112457059 /nfs/dbraw/zinc/45/70/59/1112457059.db2.gz RGUGYQSFHJXLJN-UHFFFAOYSA-N 2 0 353.510 4.232 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000480608967 1112499235 /nfs/dbraw/zinc/49/92/35/1112499235.db2.gz IJQLPHNNTZOJAP-FUPPJEDESA-N 2 0 357.586 4.141 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000480610232 1112500572 /nfs/dbraw/zinc/50/05/72/1112500572.db2.gz NBFNZZLQBIIIBR-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000480612387 1112501065 /nfs/dbraw/zinc/50/10/65/1112501065.db2.gz LRTLBKCIECLMEP-QFBILLFUSA-N 2 0 371.491 4.162 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480615030 1112502352 /nfs/dbraw/zinc/50/23/52/1112502352.db2.gz SWDVXKBRPRGKQP-DLBZAZTESA-N 2 0 357.542 4.079 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000480630549 1112510040 /nfs/dbraw/zinc/51/00/40/1112510040.db2.gz JZGFTFADSQPVNL-HOTGVXAUSA-N 2 0 352.494 4.006 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3CCCCc4ccccc43)c2)CCO1 ZINC000481542798 1112973659 /nfs/dbraw/zinc/97/36/59/1112973659.db2.gz DEDGWAJFFYCYLA-CYFREDJKSA-N 2 0 364.533 4.465 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000481546458 1112977488 /nfs/dbraw/zinc/97/74/88/1112977488.db2.gz QGJMBVZGSMRGBX-QFIPXVFZSA-N 2 0 350.506 4.184 20 0 FIADRP C[N@@H+]1CCCC12CCN(c1cc[nH+]c3cc(OC(F)(F)F)ccc31)CC2 ZINC000899878850 1113042907 /nfs/dbraw/zinc/04/29/07/1113042907.db2.gz YEVTWALYECAKFE-UHFFFAOYSA-N 2 0 365.399 4.198 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)o1 ZINC000481718895 1113046721 /nfs/dbraw/zinc/04/67/21/1113046721.db2.gz CBTYSRUXFIRGJC-QGZVFWFLSA-N 2 0 356.510 4.413 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000481943034 1113136151 /nfs/dbraw/zinc/13/61/51/1113136151.db2.gz DYASQBIGVUHUCK-CEMLEFRQSA-N 2 0 369.553 4.163 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851406 1113144604 /nfs/dbraw/zinc/14/46/04/1113144604.db2.gz GQSJXLIVJHLZKP-HSZRJFAPSA-N 2 0 363.549 4.035 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCCO3)cc1 ZINC000482127664 1113184066 /nfs/dbraw/zinc/18/40/66/1113184066.db2.gz ORJIPHNLNIBYTG-VGSWGCGISA-N 2 0 350.506 4.108 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000482341718 1113229946 /nfs/dbraw/zinc/22/99/46/1113229946.db2.gz CBWHIBFTILUASH-QHCPKHFHSA-N 2 0 370.512 4.440 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(OC)c1 ZINC000482434947 1113253713 /nfs/dbraw/zinc/25/37/13/1113253713.db2.gz HGGDXCWGMARFSB-REWPJTCUSA-N 2 0 352.522 4.301 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482445207 1113258791 /nfs/dbraw/zinc/25/87/91/1113258791.db2.gz AQDWNMJARJFAAJ-TZIWHRDSSA-N 2 0 352.522 4.301 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000482497523 1113276058 /nfs/dbraw/zinc/27/60/58/1113276058.db2.gz AJVKXTHCVGZBSF-PXNSSMCTSA-N 2 0 351.966 4.044 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(C(C)(C)C)cs1 ZINC000482541179 1113288548 /nfs/dbraw/zinc/28/85/48/1113288548.db2.gz DZXPGHMBLOFKOT-IEBWSBKVSA-N 2 0 371.594 4.483 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482549802 1113291381 /nfs/dbraw/zinc/29/13/81/1113291381.db2.gz DYCJRWGYKPLHIH-AUSIDOKSSA-N 2 0 367.537 4.156 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482549809 1113291513 /nfs/dbraw/zinc/29/15/13/1113291513.db2.gz DYCJRWGYKPLHIH-CVDCTZTESA-N 2 0 367.537 4.156 20 0 FIADRP CC[NH+](CC)[C@H](C(=O)Nc1cc(C[NH+](C)C)ccc1C)c1ccccc1 ZINC000482579653 1113301807 /nfs/dbraw/zinc/30/18/07/1113301807.db2.gz IFKOUSOCXAGXQE-NRFANRHFSA-N 2 0 353.510 4.078 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483183257 1113458902 /nfs/dbraw/zinc/45/89/02/1113458902.db2.gz JFHQAMIMBAFLJD-VQIMIIECSA-N 2 0 362.562 4.234 20 0 FIADRP Cc1ccc(CCC[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000668713684 1113680929 /nfs/dbraw/zinc/68/09/29/1113680929.db2.gz XXAVZDQBDQEDGB-HSZRJFAPSA-N 2 0 363.549 4.215 20 0 FIADRP CCC[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1)c1ccccc1 ZINC000488329246 1113909416 /nfs/dbraw/zinc/90/94/16/1113909416.db2.gz WLQRJODWOCVJRK-DENIHFKCSA-N 2 0 373.585 4.086 20 0 FIADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000489887922 1114182675 /nfs/dbraw/zinc/18/26/75/1114182675.db2.gz WIIIOVVRYXNGDL-SFHVURJKSA-N 2 0 367.493 4.011 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccc(F)cn1 ZINC000490134753 1114223046 /nfs/dbraw/zinc/22/30/46/1114223046.db2.gz CTPODWNBGWNKGV-NRFANRHFSA-N 2 0 371.500 4.182 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000490961373 1114355899 /nfs/dbraw/zinc/35/58/99/1114355899.db2.gz BRHDVZLQKYXIAV-HYBUGGRVSA-N 2 0 369.597 4.192 20 0 FIADRP CN1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C[C@H]1c1ccccc1 ZINC000572370810 1114638356 /nfs/dbraw/zinc/63/83/56/1114638356.db2.gz APHQHDBWHPSVPP-ZEQRLZLVSA-N 2 0 363.549 4.208 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000589837430 1114847481 /nfs/dbraw/zinc/84/74/81/1114847481.db2.gz ULLWOBQPXIEOGO-RTBURBONSA-N 2 0 354.542 4.233 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2ccccc2F)CC1 ZINC000589998756 1114872369 /nfs/dbraw/zinc/87/23/69/1114872369.db2.gz IOPUPAGZSAXPOI-UHFFFAOYSA-N 2 0 356.485 4.049 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000590009933 1114874124 /nfs/dbraw/zinc/87/41/24/1114874124.db2.gz QSGCMBNSHHSQBA-UHFFFAOYSA-N 2 0 365.606 4.003 20 0 FIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)o2)cc1 ZINC000590787247 1114973986 /nfs/dbraw/zinc/97/39/86/1114973986.db2.gz WIUXBWLLLIZGDT-QGZVFWFLSA-N 2 0 356.514 4.158 20 0 FIADRP Cc1c(Cl)cccc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590787056 1114974361 /nfs/dbraw/zinc/97/43/61/1114974361.db2.gz RCUVRNOHGDEYFV-MRXNPFEDSA-N 2 0 365.949 4.028 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000591708110 1115125624 /nfs/dbraw/zinc/12/56/24/1115125624.db2.gz NSKMGDKOSFNYAI-UHFFFAOYSA-N 2 0 362.521 4.237 20 0 FIADRP CCC1CCC(c2ccc(-c3noc(CC4([NH3+])CC[NH2+]CC4)n3)cc2)CC1 ZINC001212168888 1115129004 /nfs/dbraw/zinc/12/90/04/1115129004.db2.gz NMCSIMKVSPDJCD-UHFFFAOYSA-N 2 0 368.525 4.044 20 0 FIADRP C[N@@H+]1CC[C@H](NC2CC[NH+](C3CCCCC3)CC2)C[C@H]1c1ccccc1 ZINC000574624091 1115429519 /nfs/dbraw/zinc/42/95/19/1115429519.db2.gz HOQPEPGMJRQEHT-GMAHTHKFSA-N 2 0 355.570 4.209 20 0 FIADRP COC(=O)c1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c(C)o1 ZINC000594600912 1115463131 /nfs/dbraw/zinc/46/31/31/1115463131.db2.gz OBDZTYSDHTUFNN-INIZCTEOSA-N 2 0 370.493 4.039 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000594784336 1115481853 /nfs/dbraw/zinc/48/18/53/1115481853.db2.gz DIOKFAUJDVPLDB-SFHVURJKSA-N 2 0 358.913 4.350 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](Cc2ccccc2Cl)C2CC2)C[C@@H](C)O1 ZINC000575110136 1115546188 /nfs/dbraw/zinc/54/61/88/1115546188.db2.gz RETBSCKXQAFOQG-CBGDNZLLSA-N 2 0 364.961 4.140 20 0 FIADRP CC(C)(C)[N@@H+]1CCCN(c2ccnc3ccc(Br)cc32)CC1 ZINC000601513876 1115644281 /nfs/dbraw/zinc/64/42/81/1115644281.db2.gz MFVWWAOJHXTCPB-UHFFFAOYSA-N 2 0 362.315 4.308 20 0 FIADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000669614553 1115667920 /nfs/dbraw/zinc/66/79/20/1115667920.db2.gz YLSRVWJVXMPCTO-REWPJTCUSA-N 2 0 364.533 4.227 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000606470824 1115948307 /nfs/dbraw/zinc/94/83/07/1115948307.db2.gz YDSZUUDRBPPFQQ-GGAORHGYSA-N 2 0 352.522 4.128 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CC(C)(C)N3CC[NH+](C)CC3)cc2)c1 ZINC000608053418 1116081840 /nfs/dbraw/zinc/08/18/40/1116081840.db2.gz PWKCVAWXRDOGSE-UHFFFAOYSA-N 2 0 365.565 4.086 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1 ZINC000534064661 1116151571 /nfs/dbraw/zinc/15/15/71/1116151571.db2.gz YKMYDLIEXXDRED-BHDDXSALSA-N 2 0 354.538 4.110 20 0 FIADRP C[N@H+](CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1)Cc1ccccc1 ZINC000534354018 1116188115 /nfs/dbraw/zinc/18/81/15/1116188115.db2.gz XCCIWSHIFYVRDX-GGAORHGYSA-N 2 0 352.522 4.266 20 0 FIADRP CC(C)CSCCC[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000535184310 1116277703 /nfs/dbraw/zinc/27/77/03/1116277703.db2.gz CWUCDZVDCFMUGL-UHFFFAOYSA-N 2 0 363.615 4.086 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)c1 ZINC000535416004 1116305710 /nfs/dbraw/zinc/30/57/10/1116305710.db2.gz YASJSIRKQWWTGL-QFIPXVFZSA-N 2 0 365.521 4.050 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000539544897 1116341781 /nfs/dbraw/zinc/34/17/81/1116341781.db2.gz LCEBJNYLDAREGM-UHFFFAOYSA-N 2 0 372.944 4.175 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000539547883 1116342090 /nfs/dbraw/zinc/34/20/90/1116342090.db2.gz WZCIINHMQTUNPU-UHFFFAOYSA-N 2 0 374.887 4.410 20 0 FIADRP Cc1nc2ccccn2c1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000539824309 1116383905 /nfs/dbraw/zinc/38/39/05/1116383905.db2.gz DJIGJGRPWJFPIV-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP Cc1cccn2c(C[NH+]3CCC(CC[N@H+]4CCCC[C@H]4C)CC3)cnc12 ZINC000539825394 1116384037 /nfs/dbraw/zinc/38/40/37/1116384037.db2.gz RIGJBXUSJNORQH-LJQANCHMSA-N 2 0 354.542 4.119 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000462677152 1116389932 /nfs/dbraw/zinc/38/99/32/1116389932.db2.gz FDUCMNJLELIUHI-UHFFFAOYSA-N 2 0 374.960 4.436 20 0 FIADRP COc1ccc(F)cc1C[NH2+][C@@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000462783169 1117765149 /nfs/dbraw/zinc/76/51/49/1117765149.db2.gz JVUJAMRTFAWBPV-FQEVSTJZSA-N 2 0 353.441 4.179 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1 ZINC000462794752 1117777179 /nfs/dbraw/zinc/77/71/79/1117777179.db2.gz WSUXSNOIUHGVFF-UHFFFAOYSA-N 2 0 368.521 4.383 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000462797162 1117778611 /nfs/dbraw/zinc/77/86/11/1117778611.db2.gz BIDSUPHJHMVTOO-SFHVURJKSA-N 2 0 354.542 4.294 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000462796802 1117779500 /nfs/dbraw/zinc/77/95/00/1117779500.db2.gz XFXBTHRUISUTPR-DNVJHFABSA-N 2 0 356.554 4.357 20 0 FIADRP Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CCC2 ZINC000462809515 1117780565 /nfs/dbraw/zinc/78/05/65/1117780565.db2.gz BMQVQCLULBSVGP-HSZRJFAPSA-N 2 0 366.505 4.034 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000462799655 1117783941 /nfs/dbraw/zinc/78/39/41/1117783941.db2.gz VUJJHADUGPWFDS-BAGYTPMASA-N 2 0 374.569 4.092 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000462799656 1117784047 /nfs/dbraw/zinc/78/40/47/1117784047.db2.gz VUJJHADUGPWFDS-CEMLEFRQSA-N 2 0 374.569 4.092 20 0 FIADRP CCn1cc(C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)cn1 ZINC000462808131 1117788913 /nfs/dbraw/zinc/78/89/13/1117788913.db2.gz GXFSUVSAJNWYHJ-QFIPXVFZSA-N 2 0 372.532 4.385 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000462848254 1117818287 /nfs/dbraw/zinc/81/82/87/1117818287.db2.gz OMYZPCTXEUQOQE-GUDVDZBRSA-N 2 0 362.558 4.404 20 0 FIADRP CCc1nc2ccccc2n1C1CC[NH+](CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000540056396 1117845884 /nfs/dbraw/zinc/84/58/84/1117845884.db2.gz RMTHCXBXIVDKEV-SFHVURJKSA-N 2 0 354.542 4.110 20 0 FIADRP CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)[nH+]c3ccc(OC(F)F)cc32)C1 ZINC000462942322 1117871155 /nfs/dbraw/zinc/87/11/55/1117871155.db2.gz LAUWMCJQWUVIJM-HNNXBMFYSA-N 2 0 363.452 4.313 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000540135689 1117900418 /nfs/dbraw/zinc/90/04/18/1117900418.db2.gz ACJJJRKYYGJQFF-JOCHJYFZSA-N 2 0 365.521 4.418 20 0 FIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCCCn2c(C)nc3ccccc32)C1 ZINC000463095692 1117963995 /nfs/dbraw/zinc/96/39/95/1117963995.db2.gz FRYSAOOWNQBWKB-FQEVSTJZSA-N 2 0 356.558 4.179 20 0 FIADRP CC(C)[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000540300706 1117976078 /nfs/dbraw/zinc/97/60/78/1117976078.db2.gz CJUVRYRJAYNFGX-FQEVSTJZSA-N 2 0 359.514 4.476 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]C2CCN(CCc3ccccc3)CC2)C1 ZINC000463138805 1117986554 /nfs/dbraw/zinc/98/65/54/1117986554.db2.gz QNHXXXICBDOJMF-VXKWHMMOSA-N 2 0 371.613 4.041 20 0 FIADRP CCC[NH+](CCC)CCCN[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540460144 1118065989 /nfs/dbraw/zinc/06/59/89/1118065989.db2.gz BPEFDXGGZISTLM-NRFANRHFSA-N 2 0 373.585 4.076 20 0 FIADRP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc3c(c2)ncn3C)CCN1Cc1ccccc1 ZINC000540482646 1118081966 /nfs/dbraw/zinc/08/19/66/1118081966.db2.gz AXFIFSDFLDTXFF-WIYYLYMNSA-N 2 0 362.521 4.058 20 0 FIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000541156169 1118404437 /nfs/dbraw/zinc/40/44/37/1118404437.db2.gz VQPDGJGNFJMHDZ-LAUBAEHRSA-N 2 0 363.977 4.187 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000464070165 1118429993 /nfs/dbraw/zinc/42/99/93/1118429993.db2.gz VEPOOGZYNURJNL-UHFFFAOYSA-N 2 0 374.960 4.428 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000541849109 1118669790 /nfs/dbraw/zinc/66/97/90/1118669790.db2.gz QPTQKLNCWGCLPY-OAQYLSRUSA-N 2 0 357.542 4.137 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000541913874 1118699234 /nfs/dbraw/zinc/69/92/34/1118699234.db2.gz ATIINYFGIMHEOC-RPWUZVMVSA-N 2 0 364.533 4.274 20 0 FIADRP c1cn(-c2csc(C[NH2+][C@H]3CCCc4cn(C5CCCC5)nc43)c2)cn1 ZINC000542309029 1118896538 /nfs/dbraw/zinc/89/65/38/1118896538.db2.gz DIHHLIMZGHRDGT-IBGZPJMESA-N 2 0 367.522 4.413 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000173364835 1119035393 /nfs/dbraw/zinc/03/53/93/1119035393.db2.gz WGRKDADGUTWAOT-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000542464840 1119337959 /nfs/dbraw/zinc/33/79/59/1119337959.db2.gz LYGFYHVOCKXAJJ-BTYIYWSLSA-N 2 0 350.441 4.298 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178281206 1119382110 /nfs/dbraw/zinc/38/21/10/1119382110.db2.gz OGIYYMSMRBPDJO-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000178284075 1119382149 /nfs/dbraw/zinc/38/21/49/1119382149.db2.gz XXZZRQSQWJLYOR-GOSISDBHSA-N 2 0 358.551 4.470 20 0 FIADRP Fc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000311991671 1119397406 /nfs/dbraw/zinc/39/74/06/1119397406.db2.gz ONTYLSHAPOCPJO-MRXNPFEDSA-N 2 0 366.402 4.456 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000312097300 1119399887 /nfs/dbraw/zinc/39/98/87/1119399887.db2.gz CLCASANTGZJMEO-XMMPIXPASA-N 2 0 365.565 4.324 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2ccccc2Cl)c1 ZINC000493252184 1119435798 /nfs/dbraw/zinc/43/57/98/1119435798.db2.gz VRBXVHGFKFTEOM-OAQYLSRUSA-N 2 0 372.940 4.093 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000186130771 1119707610 /nfs/dbraw/zinc/70/76/10/1119707610.db2.gz DNUIPVCOYMQCGZ-ZACQAIPSSA-N 2 0 374.550 4.217 20 0 FIADRP Brc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000190909570 1119953324 /nfs/dbraw/zinc/95/33/24/1119953324.db2.gz AFWZMAZULNRVPZ-UHFFFAOYSA-N 2 0 369.328 4.105 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cnn1C(C)(C)C ZINC000191133295 1119962303 /nfs/dbraw/zinc/96/23/03/1119962303.db2.gz LNPHGSNSRQRQBB-KRWDZBQOSA-N 2 0 354.542 4.393 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC000191851750 1119998590 /nfs/dbraw/zinc/99/85/90/1119998590.db2.gz BIMMNVMREMGHJA-VLSUOOLDSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]1COCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000192466846 1120063538 /nfs/dbraw/zinc/06/35/38/1120063538.db2.gz HWEPLVXNWGXFMH-CYFREDJKSA-N 2 0 364.533 4.464 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192929396 1120090388 /nfs/dbraw/zinc/09/03/88/1120090388.db2.gz QMIPIENNOAASIZ-QFIPXVFZSA-N 2 0 374.532 4.101 20 0 FIADRP FC(F)(F)C1CCC(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000192918735 1120090637 /nfs/dbraw/zinc/09/06/37/1120090637.db2.gz LOMIJWLJOGXIHK-AVAKVYKDSA-N 2 0 354.460 4.467 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000195132588 1120119618 /nfs/dbraw/zinc/11/96/18/1120119618.db2.gz TYQIFNHIGDIPTK-ICSRJNTNSA-N 2 0 368.521 4.185 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000195139646 1120120553 /nfs/dbraw/zinc/12/05/53/1120120553.db2.gz IXRMNANMJYPRGC-ZWKOTPCHSA-N 2 0 355.551 4.195 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000193951606 1120218800 /nfs/dbraw/zinc/21/88/00/1120218800.db2.gz CEGWRPYRVFXIQB-OAQYLSRUSA-N 2 0 358.913 4.413 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000193951595 1120218878 /nfs/dbraw/zinc/21/88/78/1120218878.db2.gz CEGWRPYRVFXIQB-NRFANRHFSA-N 2 0 358.913 4.413 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000494989444 1120414699 /nfs/dbraw/zinc/41/46/99/1120414699.db2.gz SSUSNMGBXGCANO-HXUWFJFHSA-N 2 0 358.432 4.229 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000495017133 1120424437 /nfs/dbraw/zinc/42/44/37/1120424437.db2.gz LPCIRUUPNDZUKV-DLBZAZTESA-N 2 0 354.485 4.493 20 0 FIADRP C[C@H]([NH2+]CCOc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542532759 1120429716 /nfs/dbraw/zinc/42/97/16/1120429716.db2.gz PTCHHTCADZOSSH-JKSUJKDBSA-N 2 0 370.459 4.327 20 0 FIADRP CC(C)[NH+](CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C(C)C ZINC000495075738 1120458857 /nfs/dbraw/zinc/45/88/57/1120458857.db2.gz USSAZMGRCCJULG-RXVVDRJESA-N 2 0 350.522 4.392 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ncc(Br)cc1F ZINC000250125585 1120477162 /nfs/dbraw/zinc/47/71/62/1120477162.db2.gz WCQOLIVQUUFHNC-ZIAGYGMSSA-N 2 0 372.326 4.146 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495431939 1120817048 /nfs/dbraw/zinc/81/70/48/1120817048.db2.gz GALCVQMOGDVRFX-MIZPHKNDSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H]3CCCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000495547033 1120882307 /nfs/dbraw/zinc/88/23/07/1120882307.db2.gz KTJZRJXPKCGOMJ-KHCICDEESA-N 2 0 364.533 4.463 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2)C[C@H](C)O1 ZINC000237621956 1120980276 /nfs/dbraw/zinc/98/02/76/1120980276.db2.gz IRVMEVAEDKZYQN-CALCHBBNSA-N 2 0 358.913 4.239 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(Cl)c2)C[C@H](C)O1 ZINC000237623198 1120980532 /nfs/dbraw/zinc/98/05/32/1120980532.db2.gz QOSPTRDBFVITFY-CALCHBBNSA-N 2 0 358.913 4.239 20 0 FIADRP Cc1c(C[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)sc2nc(C)nc(C)c12 ZINC000915678475 1121019404 /nfs/dbraw/zinc/01/94/04/1121019404.db2.gz NRVOKYYLPLVFLE-OKILXGFUSA-N 2 0 360.571 4.074 20 0 FIADRP CC(C)[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397484659 1121185629 /nfs/dbraw/zinc/18/56/29/1121185629.db2.gz AKAXMQKRJGHJGR-QFIPXVFZSA-N 2 0 352.522 4.000 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000397504566 1121197843 /nfs/dbraw/zinc/19/78/43/1121197843.db2.gz HTGVJSQNEWIKAF-GOSISDBHSA-N 2 0 366.505 4.021 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC000397556114 1121218616 /nfs/dbraw/zinc/21/86/16/1121218616.db2.gz MGTVTOWIBWHHPR-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CSc2ccccc21 ZINC000398014183 1121334074 /nfs/dbraw/zinc/33/40/74/1121334074.db2.gz FKSMNHSAZSLHGV-LMNJBCLMSA-N 2 0 352.547 4.376 20 0 FIADRP C[C@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)CC1CCCCC1 ZINC001649060603 1121432626 /nfs/dbraw/zinc/43/26/26/1121432626.db2.gz PZGVUEGRNITQCH-REWPJTCUSA-N 2 0 357.586 4.171 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000108428097 1121541873 /nfs/dbraw/zinc/54/18/73/1121541873.db2.gz HVPHRVZUZFMAKK-QGZVFWFLSA-N 2 0 366.534 4.032 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)c1 ZINC000123729449 1121627254 /nfs/dbraw/zinc/62/72/54/1121627254.db2.gz DNELAHSAMYKAMU-IBGZPJMESA-N 2 0 364.411 4.424 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[C@H]2CCC[C@@H]21 ZINC000671740214 1121642264 /nfs/dbraw/zinc/64/22/64/1121642264.db2.gz TXSPYKUIHGZFPZ-GHRCFYLDSA-N 2 0 372.397 4.358 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c1 ZINC000123913165 1121644549 /nfs/dbraw/zinc/64/45/49/1121644549.db2.gz LQMVQLKVMOVEMD-MRXNPFEDSA-N 2 0 365.521 4.219 20 0 FIADRP C[N@@H+]1CC[C@@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1(C)C ZINC001649090726 1121717093 /nfs/dbraw/zinc/71/70/93/1121717093.db2.gz KKKUSNTUEOQRGJ-HSZRJFAPSA-N 3 0 371.613 4.184 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(OC)c(OC)cc2-c2ccccc2)C1 ZINC000063917500 1121727655 /nfs/dbraw/zinc/72/76/55/1121727655.db2.gz SPZPNAFJHDEXEQ-GOSISDBHSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000671759911 1121785451 /nfs/dbraw/zinc/78/54/51/1121785451.db2.gz UWRGRCYEJTXCID-TXPKVOOTSA-N 2 0 365.477 4.095 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC000125872522 1121856908 /nfs/dbraw/zinc/85/69/08/1121856908.db2.gz CBIMCBMPNFGQTO-LJQANCHMSA-N 2 0 363.977 4.014 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3CC[NH+](C)CC3)s2)cc1 ZINC000126343612 1121946880 /nfs/dbraw/zinc/94/68/80/1121946880.db2.gz COWJNNISTYQFMD-AWEZNQCLSA-N 2 0 359.539 4.120 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(-c3ccccc3)c2C)c1 ZINC000765775975 1121971415 /nfs/dbraw/zinc/97/14/15/1121971415.db2.gz OKQXXULIWJQNCG-GOSISDBHSA-N 2 0 362.521 4.483 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2c(F)cccc2F)cc1 ZINC000917008331 1122000790 /nfs/dbraw/zinc/00/07/90/1122000790.db2.gz JQNNPQFWRIUWJD-IIBYNOLFSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3F)cc2)C1 ZINC000917009120 1122002165 /nfs/dbraw/zinc/00/21/65/1122002165.db2.gz XXUBUMVOUICRDY-ZHRRBRCNSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+](Cc3ccccc3)C[C@H](C)C[NH3+])CCO2)cc1 ZINC001168615492 1122070043 /nfs/dbraw/zinc/07/00/43/1122070043.db2.gz OFDINLDFYPIIFB-JZWVFAODSA-N 2 0 368.521 4.012 20 0 FIADRP CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)CCC2 ZINC000765813140 1122103236 /nfs/dbraw/zinc/10/32/36/1122103236.db2.gz BOLNXNPLWJIMPG-UTKZUKDTSA-N 2 0 370.541 4.133 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)CCO2)cc1 ZINC001168617149 1122125941 /nfs/dbraw/zinc/12/59/41/1122125941.db2.gz SZMKVYOQLUCYSZ-GMAHTHKFSA-N 2 0 372.553 4.017 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168626997 1122187605 /nfs/dbraw/zinc/18/76/05/1122187605.db2.gz ZVRJXQBEBCIYRH-VMBXEPDQSA-N 2 0 360.542 4.143 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C2CCC2)o1 ZINC000542680639 1122268905 /nfs/dbraw/zinc/26/89/05/1122268905.db2.gz CZSNNGDBWXJHHX-GMAHTHKFSA-N 2 0 368.521 4.176 20 0 FIADRP C[C@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCC[NH2+]C1 ZINC000262640638 1122269446 /nfs/dbraw/zinc/26/94/46/1122269446.db2.gz KASOZLHTUOAVST-MOPGFXCFSA-N 2 0 371.569 4.415 20 0 FIADRP CS[C@H]1CCC[C@H]([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000129307819 1122567614 /nfs/dbraw/zinc/56/76/14/1122567614.db2.gz BOYMVNILFJBRNV-PMACEKPBSA-N 2 0 350.547 4.096 20 0 FIADRP CN1CC[C@@H]([NH2+]CCc2c[nH]c3ccc(F)cc23)C[C@H]1c1ccccc1 ZINC000556094301 1122648281 /nfs/dbraw/zinc/64/82/81/1122648281.db2.gz WNMUSVOIXOZIFD-KNQAVFIVSA-N 2 0 351.469 4.275 20 0 FIADRP COc1ccccc1CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556233268 1122750668 /nfs/dbraw/zinc/75/06/68/1122750668.db2.gz MELPBFBOPYENFS-UHFFFAOYSA-N 2 0 352.522 4.271 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCC34CCCC4)C3(C2)CCOCC3)cc1 ZINC000556234333 1122751239 /nfs/dbraw/zinc/75/12/39/1122751239.db2.gz WRGZNKUTMNQGIG-VXKWHMMOSA-N 2 0 368.565 4.228 20 0 FIADRP Cc1ccccc1C[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556429638 1122886565 /nfs/dbraw/zinc/88/65/65/1122886565.db2.gz DSHNEPXRZWFJPO-LJQANCHMSA-N 2 0 352.522 4.189 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCN(Cc2ccccc2Cl)CC1 ZINC000131275470 1123021895 /nfs/dbraw/zinc/02/18/95/1123021895.db2.gz SMQZABSIAINJKX-SFHVURJKSA-N 2 0 365.993 4.405 20 0 FIADRP CC(C)(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cc2ccccc2o1 ZINC000498942658 1123093740 /nfs/dbraw/zinc/09/37/40/1123093740.db2.gz MWIDGRKIZOCQBH-NQIIRXRSSA-N 2 0 358.526 4.347 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)[C@@H]2CCC[C@H]21 ZINC000556870152 1123151972 /nfs/dbraw/zinc/15/19/72/1123151972.db2.gz DAOWEFUOAKGFJA-ZSYWTGECSA-N 2 0 350.453 4.128 20 0 FIADRP Cc1cccc2ncc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)n21 ZINC000556883622 1123158104 /nfs/dbraw/zinc/15/81/04/1123158104.db2.gz RNMFHEVHGDCDGL-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP COCCC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(Br)cc1 ZINC000132129808 1123221586 /nfs/dbraw/zinc/22/15/86/1123221586.db2.gz RUFOFEPBKPZLDR-KRWDZBQOSA-N 2 0 371.363 4.094 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)CC[N@@H+]1C ZINC000556914520 1123223438 /nfs/dbraw/zinc/22/34/38/1123223438.db2.gz JILBKYHSFUCFQH-QWHCGFSZSA-N 2 0 357.361 4.005 20 0 FIADRP CCC(CC)(CNC(=O)C1CC[NH+](C(C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000073648393 1123236639 /nfs/dbraw/zinc/23/66/39/1123236639.db2.gz FFXHHOJCXUGZMV-LJQANCHMSA-N 2 0 373.585 4.133 20 0 FIADRP COc1ccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499140168 1123281934 /nfs/dbraw/zinc/28/19/34/1123281934.db2.gz GMVYQAYSNNZQQT-WBDAEOGXSA-N 2 0 364.533 4.413 20 0 FIADRP COc1ccc(CCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499140164 1123282302 /nfs/dbraw/zinc/28/23/02/1123282302.db2.gz GMVYQAYSNNZQQT-NUNAXRQHSA-N 2 0 364.533 4.413 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N(C)c1ccccc1 ZINC000499141000 1123283850 /nfs/dbraw/zinc/28/38/50/1123283850.db2.gz IYKOJDCQSDIOSP-LPHRJVMESA-N 2 0 363.549 4.297 20 0 FIADRP Fc1ccc(OCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499143829 1123286413 /nfs/dbraw/zinc/28/64/13/1123286413.db2.gz BHSNAPQNHHQWTP-KOUNCHBCSA-N 2 0 368.496 4.380 20 0 FIADRP Fc1cc(F)cc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499156469 1123289621 /nfs/dbraw/zinc/28/96/21/1123289621.db2.gz MAHICXZFWGMUIY-KOUNCHBCSA-N 2 0 356.460 4.293 20 0 FIADRP C[C@@H]1CCC[C@@H](C)[NH+]1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499152533 1123294701 /nfs/dbraw/zinc/29/47/01/1123294701.db2.gz OWMDJYOIAWOYHL-WMAOBNEYSA-N 2 0 355.570 4.035 20 0 FIADRP CC[C@@H]1CCCC[N@@H+]1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499214781 1123331125 /nfs/dbraw/zinc/33/11/25/1123331125.db2.gz CUZVSYPRKASBPL-ODAXIHTASA-N 2 0 355.570 4.036 20 0 FIADRP CC(C)[NH+](CCCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000499237450 1123349608 /nfs/dbraw/zinc/34/96/08/1123349608.db2.gz MZOIJGFTXIAOKN-WBDAEOGXSA-N 2 0 357.586 4.281 20 0 FIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133154949 1123436652 /nfs/dbraw/zinc/43/66/52/1123436652.db2.gz OXSAUGUVPZFKHB-UXHICEINSA-N 2 0 374.569 4.263 20 0 FIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cn1 ZINC000133397157 1123483287 /nfs/dbraw/zinc/48/32/87/1123483287.db2.gz VYHWLPBCVVOETB-SFHVURJKSA-N 2 0 362.521 4.482 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000237076057 1123592958 /nfs/dbraw/zinc/59/29/58/1123592958.db2.gz UJSPUORPKSDQAI-HXUWFJFHSA-N 2 0 374.532 4.279 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2cc(F)ccc2C)c1 ZINC000079307380 1123874198 /nfs/dbraw/zinc/87/41/98/1123874198.db2.gz WRGYQTMOPWHTMI-QGZVFWFLSA-N 2 0 371.500 4.093 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)C1CCC(C(F)(F)F)CC1 ZINC000474473564 1124172453 /nfs/dbraw/zinc/17/24/53/1124172453.db2.gz QKLKYGUBGRXEGU-ZLPCBKJTSA-N 2 0 372.475 4.474 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ncc(Br)s1 ZINC000245696290 1124205555 /nfs/dbraw/zinc/20/55/55/1124205555.db2.gz VPFAMMABDYGWGD-HZSPNIEDSA-N 2 0 374.392 4.314 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NC2CC[NH+](C4CCCC4)CC2)C3)cc1 ZINC000245706068 1124211128 /nfs/dbraw/zinc/21/11/28/1124211128.db2.gz MKZGEVNTEUQMQT-ULPXVVAUSA-N 2 0 367.581 4.179 20 0 FIADRP CO[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245733519 1124227740 /nfs/dbraw/zinc/22/77/40/1124227740.db2.gz QOBJSBLGUCDSKF-GPJHCHHRSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245750747 1124239645 /nfs/dbraw/zinc/23/96/45/1124239645.db2.gz TZHHCWDQVWYPKN-CAUSLRQDSA-N 3 0 369.597 4.284 20 0 FIADRP CN(C)[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccs1 ZINC000245754494 1124241724 /nfs/dbraw/zinc/24/17/24/1124241724.db2.gz UPDBWZHKOGZTQE-PLACYPQZSA-N 2 0 369.578 4.136 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(F)c1F ZINC000245852343 1124263757 /nfs/dbraw/zinc/26/37/57/1124263757.db2.gz GOUXMEQDWBYYNZ-BRWVUGGUSA-N 2 0 374.475 4.425 20 0 FIADRP CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)CCO1 ZINC000245942062 1124293457 /nfs/dbraw/zinc/29/34/57/1124293457.db2.gz JXXSDKJJJJQIHW-AGHHOFFYSA-N 2 0 362.558 4.261 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000108428242 1124317233 /nfs/dbraw/zinc/31/72/33/1124317233.db2.gz JYJRFIURESUACV-KRWDZBQOSA-N 2 0 371.912 4.024 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000246122261 1124362854 /nfs/dbraw/zinc/36/28/54/1124362854.db2.gz QTCCDLVACTZMRF-NJDAHSKKSA-N 2 0 362.945 4.149 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1OC(F)F ZINC000246313897 1124442440 /nfs/dbraw/zinc/44/24/40/1124442440.db2.gz DVJCTGBNIQSERQ-HZPDHXFCSA-N 2 0 370.484 4.315 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2Cl ZINC000542848568 1124449236 /nfs/dbraw/zinc/44/92/36/1124449236.db2.gz RWLYHQQSGKKLPQ-AVRDEDQJSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1F ZINC000246560891 1124533561 /nfs/dbraw/zinc/53/35/61/1124533561.db2.gz KMOANTAJSZZGLZ-FGTMMUONSA-N 2 0 356.485 4.286 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CC1 ZINC000247054707 1124585898 /nfs/dbraw/zinc/58/58/98/1124585898.db2.gz PCLNNGMTQLGYMA-DYESRHJHSA-N 2 0 369.940 4.267 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCc1cccc2ccccc21 ZINC000247110437 1124591275 /nfs/dbraw/zinc/59/12/75/1124591275.db2.gz QLXRRCHLYQRHOL-NTKDMRAZSA-N 2 0 359.517 4.278 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248403056 1124762259 /nfs/dbraw/zinc/76/22/59/1124762259.db2.gz OBDOUBSSFBSIHD-BJLQDIEVSA-N 2 0 360.542 4.015 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCCO2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248403845 1124762641 /nfs/dbraw/zinc/76/26/41/1124762641.db2.gz PGCFDOKNDJNRLX-SCTDSRPQSA-N 2 0 358.526 4.152 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(Cl)c1 ZINC000248437065 1124767951 /nfs/dbraw/zinc/76/79/51/1124767951.db2.gz GTAHHHLIVBMCPU-KKSFZXQISA-N 2 0 358.913 4.148 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccs1 ZINC000248443177 1124769117 /nfs/dbraw/zinc/76/91/17/1124769117.db2.gz LIGITNKMTSMPKS-WOJBJXKFSA-N 2 0 358.551 4.192 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc(Cl)c1 ZINC000248462777 1124774113 /nfs/dbraw/zinc/77/41/13/1124774113.db2.gz YMQZQPUCSFKTNP-NHCUHLMSSA-N 2 0 358.913 4.148 20 0 FIADRP Clc1ccc(N2CCC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c(Cl)c1 ZINC000248961374 1124830832 /nfs/dbraw/zinc/83/08/32/1124830832.db2.gz BEBPRBNURUORCJ-YESZJQIVSA-N 2 0 368.352 4.179 20 0 FIADRP Cc1nn(-c2ccccc2Cl)cc1CN(C)C1CC[NH+](C(C)C)CC1 ZINC000656247693 1124833105 /nfs/dbraw/zinc/83/31/05/1124833105.db2.gz BYBQIJWKZJLRMB-UHFFFAOYSA-N 2 0 360.933 4.139 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccsc1 ZINC000249120537 1124845452 /nfs/dbraw/zinc/84/54/52/1124845452.db2.gz TWULWQJTIDCKCS-SFTDATJTSA-N 2 0 358.551 4.336 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(F)c1 ZINC000249205523 1124850339 /nfs/dbraw/zinc/85/03/39/1124850339.db2.gz VRWZETWYIYLZKB-FCHUYYIVSA-N 2 0 356.485 4.023 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000089215713 1124891241 /nfs/dbraw/zinc/89/12/41/1124891241.db2.gz SACIWUPPQZAQRJ-OAHLLOKOSA-N 2 0 361.436 4.250 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1SC ZINC000089214845 1124891317 /nfs/dbraw/zinc/89/13/17/1124891317.db2.gz BUPFJEOKELKWMC-INIZCTEOSA-N 2 0 371.550 4.379 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OC1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000090027699 1124976273 /nfs/dbraw/zinc/97/62/73/1124976273.db2.gz LETDRECDBAKFHV-GOSISDBHSA-N 2 0 368.521 4.409 20 0 FIADRP CC(C)COc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000090523883 1125001633 /nfs/dbraw/zinc/00/16/33/1125001633.db2.gz DAWHEUAAUNYBGT-TZYHBYERSA-N 2 0 374.569 4.140 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C)c1 ZINC000091310347 1125064615 /nfs/dbraw/zinc/06/46/15/1125064615.db2.gz ZUPWPJJEFASTEQ-KRWDZBQOSA-N 2 0 350.510 4.264 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCO[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000672601494 1125191786 /nfs/dbraw/zinc/19/17/86/1125191786.db2.gz HKYLOFAFWQEYOC-OALUTQOASA-N 2 0 370.459 4.118 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2ccccc2s1 ZINC000092821343 1125245251 /nfs/dbraw/zinc/24/52/51/1125245251.db2.gz XOFFCFUCYIMPEP-UHFFFAOYSA-N 2 0 366.534 4.430 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000093006877 1125257843 /nfs/dbraw/zinc/25/78/43/1125257843.db2.gz WGMUPLXUMINMCU-UHFFFAOYSA-N 2 0 355.551 4.365 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)OCO3)ccc1OC ZINC000182192307 1125284517 /nfs/dbraw/zinc/28/45/17/1125284517.db2.gz NKPKJHXETLVMEO-MRXNPFEDSA-N 2 0 370.493 4.117 20 0 FIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000182376676 1125440349 /nfs/dbraw/zinc/44/03/49/1125440349.db2.gz QSEHEKCIXZMVOZ-UGSOOPFHSA-N 2 0 352.494 4.453 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCN[C@H]1CC[NH+](Cc2ccccc2)C2(CC2)C1 ZINC000563120073 568224819 /nfs/dbraw/zinc/22/48/19/568224819.db2.gz QNZOPSGHSADHDO-IRLDBZIGSA-N 2 0 355.570 4.038 20 0 FIADRP C[NH+](C)CC1CC[NH+](CC/C=C\c2ccc(Br)cc2)CC1 ZINC000604997967 568508194 /nfs/dbraw/zinc/50/81/94/568508194.db2.gz WZBAGUHHFFPHCV-HYXAFXHYSA-N 2 0 351.332 4.126 20 0 FIADRP Cc1cc2[nH]ccc2c(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)[nH+]1 ZINC001164995526 722201908 /nfs/dbraw/zinc/20/19/08/722201908.db2.gz NYCROGQOYDDIRW-QFIPXVFZSA-N 2 0 364.468 4.255 20 0 FIADRP C[C@@H](C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1)C[NH+]1CCCC1 ZINC000544828746 1079612228 /nfs/dbraw/zinc/61/22/28/1079612228.db2.gz ZFWNFUJOHKJCEY-UWJYYQICSA-N 2 0 357.929 4.340 20 0 FIADRP Brc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000063551864 1079614194 /nfs/dbraw/zinc/61/41/94/1079614194.db2.gz GGFJOIMWODYYBW-UHFFFAOYSA-N 2 0 373.338 4.451 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000183179780 1125766817 /nfs/dbraw/zinc/76/68/17/1125766817.db2.gz MUFORNKVWYUWEZ-MRXNPFEDSA-N 2 0 371.481 4.296 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000643546983 1079666896 /nfs/dbraw/zinc/66/68/96/1079666896.db2.gz XWMPACQCOUXEAX-PBHICJAKSA-N 2 0 371.550 4.452 20 0 FIADRP COCc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC ZINC000183187183 1125773101 /nfs/dbraw/zinc/77/31/01/1125773101.db2.gz WYVYEGCWLRLGKD-JENIJYKNSA-N 2 0 360.542 4.145 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1C(F)(F)F ZINC000067249712 1080081429 /nfs/dbraw/zinc/08/14/29/1080081429.db2.gz YGMDBLUWNQFDAS-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000037409783 1080497679 /nfs/dbraw/zinc/49/76/79/1080497679.db2.gz HZMFGDQKZMYGHZ-UHFFFAOYSA-N 2 0 351.332 4.158 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc2ccccc2c1 ZINC000180642186 1080532129 /nfs/dbraw/zinc/53/21/29/1080532129.db2.gz VMMHKDSPCDHYHF-UUOWRZLLSA-N 2 0 360.501 4.257 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)c1 ZINC000123628543 1080608991 /nfs/dbraw/zinc/60/89/91/1080608991.db2.gz GFVASGVURSVKII-UHFFFAOYSA-N 2 0 371.956 4.156 20 0 FIADRP C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683347306 1080700018 /nfs/dbraw/zinc/70/00/18/1080700018.db2.gz OBRMVIJNJREULN-NTYOPAKOSA-N 2 0 358.570 4.470 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](C[C@H]3[C@H](c4ccccc4)C3(F)F)C2)CC1 ZINC001167255142 1080914071 /nfs/dbraw/zinc/91/40/71/1080914071.db2.gz DVYUJJPTSLZWKM-JBACZVJFSA-N 2 0 362.508 4.479 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547826050 1080941262 /nfs/dbraw/zinc/94/12/62/1080941262.db2.gz MVBYCJQOGOUMRR-ZNEWLNCYSA-N 2 0 364.533 4.264 20 0 FIADRP C[C@@H]([NH2+]CCc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830568 1080944510 /nfs/dbraw/zinc/94/45/10/1080944510.db2.gz POBKGUAXAYGCOT-CRAIPNDOSA-N 2 0 362.439 4.147 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(C)cc1 ZINC000397501193 1081003946 /nfs/dbraw/zinc/00/39/46/1081003946.db2.gz YIYVAIMKZHXTMB-JOCHJYFZSA-N 2 0 352.522 4.063 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2cccc3c[nH]nc32)C1 ZINC001648808360 1081111520 /nfs/dbraw/zinc/11/15/20/1081111520.db2.gz MEOWCRHFKBSXRW-ROUUACIJSA-N 2 0 362.521 4.331 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000655825920 1081233679 /nfs/dbraw/zinc/23/36/79/1081233679.db2.gz OPWCTTDXTQCHPG-UHGJSFDGSA-N 2 0 374.532 4.028 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(CO)c1 ZINC000121235735 1081240935 /nfs/dbraw/zinc/24/09/35/1081240935.db2.gz AEDTZSVKENXPTR-IBGZPJMESA-N 2 0 352.522 4.262 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)C1 ZINC001648828687 1081265713 /nfs/dbraw/zinc/26/57/13/1081265713.db2.gz PTEQMVHCNYRYRS-OUZREKFBSA-N 2 0 350.506 4.210 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397613210 1081322341 /nfs/dbraw/zinc/32/23/41/1081322341.db2.gz SIAWWVFQGFFYDN-QHCPKHFHSA-N 2 0 366.549 4.391 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4cnc5ccccc5c4)C[C@@H]3C2)cc1 ZINC000312640001 1081500376 /nfs/dbraw/zinc/50/03/76/1081500376.db2.gz IHBTXHZSRPHQLS-GOTSBHOMSA-N 2 0 357.501 4.189 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)c2ccccc21 ZINC000580218710 1081757309 /nfs/dbraw/zinc/75/73/09/1081757309.db2.gz UOSXUTKFOHCQBA-FGZHOGPDSA-N 2 0 370.537 4.165 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCc2c(Cl)cccc21 ZINC000580857168 1082190919 /nfs/dbraw/zinc/19/09/19/1082190919.db2.gz YMCYEONSFZURCF-HXUWFJFHSA-N 2 0 373.928 4.233 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc(C(C)(C)C)nc2)cc1 ZINC000580897936 1082211518 /nfs/dbraw/zinc/21/15/18/1082211518.db2.gz JJSSYXQLEGCUNG-GOSISDBHSA-N 2 0 366.553 4.438 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc(C(C)(C)C)nc2)cc1 ZINC000580897942 1082211669 /nfs/dbraw/zinc/21/16/69/1082211669.db2.gz JJSSYXQLEGCUNG-SFHVURJKSA-N 2 0 366.553 4.438 20 0 FIADRP Cc1cccc2c1OC[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC000581101571 1082315153 /nfs/dbraw/zinc/31/51/53/1082315153.db2.gz MIZVAHPDPPJFQF-BXXSPATCSA-N 2 0 362.517 4.084 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(F)c(F)c1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548157570 1082419717 /nfs/dbraw/zinc/41/97/17/1082419717.db2.gz PBBBBICGJHWWHK-MAUKXSAKSA-N 2 0 362.439 4.147 20 0 FIADRP [NH3+]C[C@@H](Cc1ccccc1)[C@@H]1CCCC[N@@H+]1Cc1scnc1C1CC1 ZINC000581429535 1082572468 /nfs/dbraw/zinc/57/24/68/1082572468.db2.gz PQYOHUZEVONNKQ-MOPGFXCFSA-N 2 0 355.551 4.193 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000581611357 1082708351 /nfs/dbraw/zinc/70/83/51/1082708351.db2.gz XJYIYZXQPZRITH-UHFFFAOYSA-N 2 0 367.518 4.040 20 0 FIADRP Cc1ccccc1-n1cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cn1 ZINC000647170029 1082739440 /nfs/dbraw/zinc/73/94/40/1082739440.db2.gz KWZCLLXGYDYSFW-UHFFFAOYSA-N 2 0 360.505 4.066 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccccc3OC(F)F)CC2)C1 ZINC000471781752 1082983396 /nfs/dbraw/zinc/98/33/96/1082983396.db2.gz RJKYSDFLFMYQJB-VQIMIIECSA-N 2 0 366.496 4.463 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccc(F)cc1 ZINC000090971304 1083096510 /nfs/dbraw/zinc/09/65/10/1083096510.db2.gz WKQXCVAPQKVHKP-GOSISDBHSA-N 2 0 367.512 4.209 20 0 FIADRP Cc1ccncc1CCC[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000581970795 1083116366 /nfs/dbraw/zinc/11/63/66/1083116366.db2.gz SXNOOEAXZVCTQA-UHFFFAOYSA-N 2 0 351.538 4.167 20 0 FIADRP Brc1ccccc1C1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000426325187 1083210254 /nfs/dbraw/zinc/21/02/54/1083210254.db2.gz UMODVYFKWBLHCM-JKSUJKDBSA-N 2 0 363.343 4.087 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)[C@H]3CCCc4ccccc43)CC2)CC1 ZINC000430950837 1083250734 /nfs/dbraw/zinc/25/07/34/1083250734.db2.gz JDQKSCBCRUAIJX-DEOSSOPVSA-N 2 0 369.597 4.192 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CC[C@H]3C3CCC3)CC2)cc1 ZINC000510745887 1083286951 /nfs/dbraw/zinc/28/69/51/1083286951.db2.gz BCZCFSAYIPZEKG-XZOQPEGZSA-N 2 0 356.554 4.226 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccc(Br)cc32)C1 ZINC000510754588 1083292078 /nfs/dbraw/zinc/29/20/78/1083292078.db2.gz ULFYJZKXKRRMJY-RDTXWAMCSA-N 2 0 351.332 4.146 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000091317607 1083331641 /nfs/dbraw/zinc/33/16/41/1083331641.db2.gz IGNMLXAARXLXDT-JOCHJYFZSA-N 2 0 360.542 4.017 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCOCC1 ZINC000658319912 1083406188 /nfs/dbraw/zinc/40/61/88/1083406188.db2.gz JSEDNDRBDVPYFL-FGZHOGPDSA-N 2 0 356.554 4.084 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)[C@H]2CCCO[C@H]21 ZINC000658320203 1083406309 /nfs/dbraw/zinc/40/63/09/1083406309.db2.gz RDLCAJRDBZVETR-GXRSIYKFSA-N 2 0 368.565 4.082 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c(C)n1 ZINC000658319529 1083406342 /nfs/dbraw/zinc/40/63/42/1083406342.db2.gz FIZIQTSLLZKOMY-UWJYYQICSA-N 2 0 364.537 4.046 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCOCC1 ZINC000658319914 1083406871 /nfs/dbraw/zinc/40/68/71/1083406871.db2.gz JSEDNDRBDVPYFL-YADHBBJMSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(CO)c1 ZINC000658320352 1083408241 /nfs/dbraw/zinc/40/82/41/1083408241.db2.gz SPAGBBHRCUASOG-XXBNENTESA-N 2 0 364.533 4.132 20 0 FIADRP COc1cccc(C2([NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)CCC2)c1 ZINC000658323463 1083409817 /nfs/dbraw/zinc/40/98/17/1083409817.db2.gz LNNVMJQVXACKFF-SFHVURJKSA-N 2 0 368.521 4.366 20 0 FIADRP C[C@H](O)[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000658358939 1083429511 /nfs/dbraw/zinc/42/95/11/1083429511.db2.gz BBEDRGGYTHCJFC-DVVHHAQGSA-N 2 0 352.522 4.141 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2ccccc2n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483247 1083460097 /nfs/dbraw/zinc/46/00/97/1083460097.db2.gz LDZMCXSEAWMRSX-DENIHFKCSA-N 2 0 359.517 4.278 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000192682722 1083510076 /nfs/dbraw/zinc/51/00/76/1083510076.db2.gz PZZCAJAKUOAZEQ-HSZRJFAPSA-N 2 0 367.537 4.444 20 0 FIADRP Oc1cccc2c(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)cc[nH+]c12 ZINC000684593754 1083618623 /nfs/dbraw/zinc/61/86/23/1083618623.db2.gz LFOUMUNUQWSRCY-UHFFFAOYSA-N 2 0 365.399 4.158 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccc(F)c2)s1 ZINC000535807968 1083693745 /nfs/dbraw/zinc/69/37/45/1083693745.db2.gz KKAUJRGCUBGBLF-YZGWKJHDSA-N 2 0 374.525 4.238 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccc(F)cc2)s1 ZINC000535809146 1083697203 /nfs/dbraw/zinc/69/72/03/1083697203.db2.gz IPALIYXZJKTHTM-MISYRCLQSA-N 2 0 374.525 4.238 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000181323660 1083866388 /nfs/dbraw/zinc/86/63/88/1083866388.db2.gz QPOXMXQRYIWFIJ-KKSFZXQISA-N 2 0 372.484 4.331 20 0 FIADRP Cc1cn2c(C[NH2+]Cc3cccc(C[N@@H+](C)C(C)C)c3)c(C)nc2s1 ZINC000236667693 1083900627 /nfs/dbraw/zinc/90/06/27/1083900627.db2.gz YWUSPMIONOWVAB-UHFFFAOYSA-N 2 0 356.539 4.143 20 0 FIADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc4c(c3)OCO4)CCCCC2)CC1(C)C ZINC001648924661 1083931808 /nfs/dbraw/zinc/93/18/08/1083931808.db2.gz MAVIIYYKFCHCBL-GOSISDBHSA-N 2 0 358.526 4.080 20 0 FIADRP c1cn(-c2csc(C[NH2+]C[C@H]3CCCO[C@H]3c3ccccc3)c2)cn1 ZINC001648924804 1084002829 /nfs/dbraw/zinc/00/28/29/1084002829.db2.gz SPEDUVFSSVZBLX-XLIONFOSSA-N 2 0 353.491 4.191 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2cccc(Cl)c2)c1 ZINC000511016172 1084186889 /nfs/dbraw/zinc/18/68/89/1084186889.db2.gz ONKFVTFWJKTIDB-MRXNPFEDSA-N 2 0 373.928 4.299 20 0 FIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511020377 1084205516 /nfs/dbraw/zinc/20/55/16/1084205516.db2.gz XOBAAASKWNGHEQ-PKOBYXMFSA-N 2 0 358.476 4.398 20 0 FIADRP C[C@@H](NC(C)(C)C[NH2+]Cc1ccccc1-c1ccnn1C)c1ccccc1 ZINC000511023627 1084228254 /nfs/dbraw/zinc/22/82/54/1084228254.db2.gz AWCDBEBWSMJORN-GOSISDBHSA-N 2 0 362.521 4.306 20 0 FIADRP CCn1nc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c2ccccc21 ZINC000472080839 1084265129 /nfs/dbraw/zinc/26/51/29/1084265129.db2.gz UJUJCMSKYXSPBX-SEJPIABJSA-N 2 0 374.532 4.341 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000537972721 1084437618 /nfs/dbraw/zinc/43/76/18/1084437618.db2.gz ZGGIXZSMAIWYDK-SUMWQHHRSA-N 2 0 351.332 4.460 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@H]4CCC[C@H](C)C4)CC3)CC2)c1 ZINC000582032414 1084494343 /nfs/dbraw/zinc/49/43/43/1084494343.db2.gz HGLIODLLXXBCKC-RXVVDRJESA-N 2 0 356.554 4.360 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N(CC(C)C)C2CC[NH+](C)CC2)cc1 ZINC000511058723 1084515312 /nfs/dbraw/zinc/51/53/12/1084515312.db2.gz ZFSQOCSHZJSDQP-UHFFFAOYSA-N 2 0 373.585 4.111 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(CN3CCOCC3)c2)cc1 ZINC000173331461 1084614841 /nfs/dbraw/zinc/61/48/41/1084614841.db2.gz VGFPRZFJDLCSLT-KRWDZBQOSA-N 2 0 356.535 4.092 20 0 FIADRP Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000657336991 1084626495 /nfs/dbraw/zinc/62/64/95/1084626495.db2.gz DDZGEXHDXQIXOO-UHFFFAOYSA-N 2 0 366.553 4.353 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414161710 1084718209 /nfs/dbraw/zinc/71/82/09/1084718209.db2.gz CBYSIYVMNARVKI-KRWDZBQOSA-N 2 0 372.266 4.100 20 0 FIADRP Brc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414162152 1084719562 /nfs/dbraw/zinc/71/95/62/1084719562.db2.gz DBRBBYCVOBDAMF-SFHVURJKSA-N 2 0 356.267 4.264 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000582208813 1084761700 /nfs/dbraw/zinc/76/17/00/1084761700.db2.gz NVXSPBDMHRHVHW-CBGDNZLLSA-N 2 0 369.553 4.265 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000414184557 1084762155 /nfs/dbraw/zinc/76/21/55/1084762155.db2.gz NZDMNHRDGNXDMQ-UWJYYQICSA-N 2 0 357.929 4.340 20 0 FIADRP COc1ccc([C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccc(F)cc2)cc1 ZINC000414191421 1084775808 /nfs/dbraw/zinc/77/58/08/1084775808.db2.gz RWYKEDIKKRPDBM-HTAPYJJXSA-N 2 0 356.485 4.245 20 0 FIADRP C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(Cl)cc1 ZINC000657377422 1084799956 /nfs/dbraw/zinc/79/99/56/1084799956.db2.gz TWPKMHGRWIWOQP-JSNMRZPZSA-N 2 0 352.869 4.408 20 0 FIADRP Oc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CCC2 ZINC000563309600 1084902989 /nfs/dbraw/zinc/90/29/89/1084902989.db2.gz BFBCMOUHQQEOIJ-NRFANRHFSA-N 2 0 356.535 4.333 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)C2CCC2)o1 ZINC000414305129 1085010934 /nfs/dbraw/zinc/01/09/34/1085010934.db2.gz NGIUNXLAMCPAKV-QFIPXVFZSA-N 2 0 368.521 4.046 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Br)c2)C[C@@H]1C ZINC000539821442 1085045709 /nfs/dbraw/zinc/04/57/09/1085045709.db2.gz UKZVOTMMSLJZBD-MPGHIAIKSA-N 2 0 353.348 4.357 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@H]([NH3+])c1ccccc1)C1CCCCC1 ZINC000237167052 1085097325 /nfs/dbraw/zinc/09/73/25/1085097325.db2.gz JSJAHWJTQCCTFW-NRFANRHFSA-N 2 0 365.521 4.480 20 0 FIADRP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CO1 ZINC000657462084 1085123140 /nfs/dbraw/zinc/12/31/40/1085123140.db2.gz CKHFXPKFQKGDLR-GGWAWNLDSA-N 2 0 362.945 4.411 20 0 FIADRP CC(C)(C)[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657534720 1085448962 /nfs/dbraw/zinc/44/89/62/1085448962.db2.gz CTUAXVUYEPWCRE-VQTJNVASSA-N 2 0 350.591 4.462 20 0 FIADRP c1cc(C2CCCC2)ccc1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000657537529 1085454995 /nfs/dbraw/zinc/45/49/95/1085454995.db2.gz NTVFGAFJMDIROX-UHFFFAOYSA-N 2 0 356.554 4.325 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3cccc(C4CCCC4)c3)cc2)C1 ZINC000657594577 1085659231 /nfs/dbraw/zinc/65/92/31/1085659231.db2.gz BVDMVLYVOVKIHK-DEOSSOPVSA-N 2 0 364.533 4.201 20 0 FIADRP c1cncc([C@H]2CCC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)c1 ZINC000657613728 1085699171 /nfs/dbraw/zinc/69/91/71/1085699171.db2.gz PYLJUQIYBFOHJW-GMAHTHKFSA-N 2 0 364.537 4.005 20 0 FIADRP Cc1ccc2[nH]c(C[NH+]3CCC(C[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)cc2c1C ZINC000473132654 1085732084 /nfs/dbraw/zinc/73/20/84/1085732084.db2.gz NWQPBJMXNWHYGM-QZTJIDSGSA-N 2 0 369.553 4.106 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000652172280 1085739982 /nfs/dbraw/zinc/73/99/82/1085739982.db2.gz SCKDZAMWHHXTMU-FQEVSTJZSA-N 2 0 359.489 4.038 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c(C)n1 ZINC000164501633 1085797792 /nfs/dbraw/zinc/79/77/92/1085797792.db2.gz GPOSJPJAGNEDMH-INIZCTEOSA-N 2 0 364.493 4.169 20 0 FIADRP COc1cc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)cc(C(F)(F)F)c1 ZINC001143517465 1085808876 /nfs/dbraw/zinc/80/88/76/1085808876.db2.gz MCVUULIRLHBXPD-UHFFFAOYSA-N 2 0 370.459 4.268 20 0 FIADRP Brc1cccc(C[NH+]2CCC(C[NH2+][C@H]3C[C@H]4C[C@H]4C3)CC2)c1 ZINC001167913165 1085919792 /nfs/dbraw/zinc/91/97/92/1085919792.db2.gz MKDKTYGAFVWHSC-DZFIZOCASA-N 2 0 363.343 4.049 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC000652348695 1085924026 /nfs/dbraw/zinc/92/40/26/1085924026.db2.gz NVZVQCSMMNRVLT-YTFSRNRJSA-N 2 0 356.554 4.453 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000511904870 1085936855 /nfs/dbraw/zinc/93/68/55/1085936855.db2.gz DJNLSKCWVDEFEV-GZTJUZNOSA-N 2 0 356.485 4.227 20 0 FIADRP C[C@@H]([NH2+]CC1(C[NH2+][C@@H](C)C2CCC(F)CC2)COC1)C1CCC(F)CC1 ZINC000662001798 1086002097 /nfs/dbraw/zinc/00/20/97/1086002097.db2.gz OTVYNXLZLSZXGW-GTAKNVHYSA-N 2 0 372.544 4.016 20 0 FIADRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(OC(F)F)cc1 ZINC000582994543 1086005126 /nfs/dbraw/zinc/00/51/26/1086005126.db2.gz GXRWCZQGSQHVTI-INIZCTEOSA-N 2 0 358.498 4.156 20 0 FIADRP c1ccc(C(OCCN2CC[C@@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000150762565 1086245852 /nfs/dbraw/zinc/24/58/52/1086245852.db2.gz ZCNZBOCWEMNTRM-NRFANRHFSA-N 2 0 364.533 4.210 20 0 FIADRP Brc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000063551923 1086309464 /nfs/dbraw/zinc/30/94/64/1086309464.db2.gz TUKACYDAORVRGR-UHFFFAOYSA-N 2 0 373.338 4.451 20 0 FIADRP CC[C@@H](C(=O)OC(C)(C)C)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC001167658180 1086375124 /nfs/dbraw/zinc/37/51/24/1086375124.db2.gz CIRPTGXYDUSHSU-HKUYNNGSSA-N 2 0 352.563 4.083 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@H](C(=O)OC(C)(C)C)C2CC2)CC1 ZINC001167658709 1086387332 /nfs/dbraw/zinc/38/73/32/1086387332.db2.gz KOWORSNPDQJQNL-XLIONFOSSA-N 2 0 364.574 4.083 20 0 FIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc(OC(F)(F)F)c1 ZINC000662281080 1086390035 /nfs/dbraw/zinc/39/00/35/1086390035.db2.gz IDPLNHWYVBDGRN-ZDUSSCGKSA-N 2 0 350.384 4.082 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000511234445 1086392826 /nfs/dbraw/zinc/39/28/26/1086392826.db2.gz LWLKRVFTNXQOHE-GOSISDBHSA-N 2 0 364.489 4.338 20 0 FIADRP Clc1cccc(-c2cnc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)o2)c1 ZINC000662290965 1086396734 /nfs/dbraw/zinc/39/67/34/1086396734.db2.gz AQMDFIKOKFZHMF-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP COc1cccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000662291149 1086397348 /nfs/dbraw/zinc/39/73/48/1086397348.db2.gz BVXGAQIGBSBRGO-GOSISDBHSA-N 2 0 371.550 4.030 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc3c(s2)CC[NH2+]C3)cc1 ZINC000662389020 1086428874 /nfs/dbraw/zinc/42/88/74/1086428874.db2.gz WRCHBDFNNRWMCD-HNNXBMFYSA-N 2 0 369.534 4.021 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@H](O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000052210049 1086456898 /nfs/dbraw/zinc/45/68/98/1086456898.db2.gz MOEGMZDKJFENQF-IBGZPJMESA-N 2 0 372.475 4.183 20 0 FIADRP CC(C)[C@H](O)[C@@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccccc1 ZINC000657745662 1086465781 /nfs/dbraw/zinc/46/57/81/1086465781.db2.gz JOYMRONJULOLSS-ZEQRLZLVSA-N 2 0 366.549 4.041 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2c(C)nn(Cc3ccccc3)c2Cl)CC1 ZINC000236791034 1086485126 /nfs/dbraw/zinc/48/51/26/1086485126.db2.gz VLMLUIKXZBYTPZ-UHFFFAOYSA-N 2 0 374.960 4.105 20 0 FIADRP CC[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(Br)cc1 ZINC000152827724 1086519486 /nfs/dbraw/zinc/51/94/86/1086519486.db2.gz GUKREIRRWVXMLP-KRWDZBQOSA-N 2 0 362.315 4.265 20 0 FIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511989782 1086583509 /nfs/dbraw/zinc/58/35/09/1086583509.db2.gz MEOUPPNUBBRVBC-OWQUAZCHSA-N 2 0 356.460 4.478 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2ccc(F)c(-c3cccs3)c2)CCCO1 ZINC000432355964 1086655143 /nfs/dbraw/zinc/65/51/43/1086655143.db2.gz AMYOTLIXTKZROU-INIZCTEOSA-N 2 0 362.514 4.145 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126712273 1086698201 /nfs/dbraw/zinc/69/82/01/1086698201.db2.gz HETGRUDAHXQOTK-QVKFZJNVSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126712488 1086703408 /nfs/dbraw/zinc/70/34/08/1086703408.db2.gz HETGRUDAHXQOTK-BTYIYWSLSA-N 2 0 371.475 4.055 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432418033 1086744362 /nfs/dbraw/zinc/74/43/62/1086744362.db2.gz YCRXEVQBDMFSSX-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)CCCO2 ZINC000432426090 1086754344 /nfs/dbraw/zinc/75/43/44/1086754344.db2.gz YACSNAJLEVTGSM-RXVVDRJESA-N 2 0 360.542 4.114 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717947 1086797323 /nfs/dbraw/zinc/79/73/23/1086797323.db2.gz RJBAYRSPLCJMOT-UHFFFAOYSA-N 2 0 369.303 4.059 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1 ZINC000650720325 1086809683 /nfs/dbraw/zinc/80/96/83/1086809683.db2.gz LMOMDGDIESXKMF-UHFFFAOYSA-N 2 0 374.410 4.105 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2cccc(Oc3ccccc3)c2)C1 ZINC000650722084 1086827296 /nfs/dbraw/zinc/82/72/96/1086827296.db2.gz KJIWZUBCGMBAHX-UEVCKROQSA-N 2 0 366.505 4.340 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000583588195 1086827845 /nfs/dbraw/zinc/82/78/45/1086827845.db2.gz TXXJYLXQMWARLS-OAQYLSRUSA-N 2 0 373.928 4.306 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncc(F)c1 ZINC000657773405 1086833150 /nfs/dbraw/zinc/83/31/50/1086833150.db2.gz RIDPVZYOPUJODQ-YLJYHZDGSA-N 2 0 353.485 4.174 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)CNC1CC([NH+]2CCCCC2)C1 ZINC000583663142 1086905861 /nfs/dbraw/zinc/90/58/61/1086905861.db2.gz PJBPREIITWWJTG-PTNGSMBKSA-N 2 0 350.453 4.298 20 0 FIADRP c1cc2cccc(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)c2s1 ZINC000650741074 1086915800 /nfs/dbraw/zinc/91/58/00/1086915800.db2.gz XFOGQYLMWBGZAI-WIYYLYMNSA-N 2 0 350.487 4.247 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC1 ZINC000650747027 1086933964 /nfs/dbraw/zinc/93/39/64/1086933964.db2.gz PNGAWELJGYFXJA-INIZCTEOSA-N 2 0 362.315 4.026 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)c(F)c1 ZINC000650754168 1086960284 /nfs/dbraw/zinc/96/02/84/1086960284.db2.gz CEPCMURNPCSMPE-GOSISDBHSA-N 2 0 363.274 4.288 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)sc1Br ZINC000650756103 1086965014 /nfs/dbraw/zinc/96/50/14/1086965014.db2.gz URVSDABBAQTBNR-JTQLQIEISA-N 2 0 357.292 4.268 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CCC2CC[NH2+]CC2)c2cnc3ccccc3c2)cc1 ZINC000650762879 1086992145 /nfs/dbraw/zinc/99/21/45/1086992145.db2.gz MVGXRDFFYRZIOY-HSZRJFAPSA-N 2 0 363.480 4.443 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)c2ccc(F)cc2)CC1 ZINC000583879549 1087008971 /nfs/dbraw/zinc/00/89/71/1087008971.db2.gz LHFYNMLCGNFYRQ-HSZRJFAPSA-N 3 0 373.560 4.230 20 0 FIADRP Cc1ccc(-c2nc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cs2)cc1 ZINC000657812827 1087084630 /nfs/dbraw/zinc/08/46/30/1087084630.db2.gz GKWWUQJUWCUESD-UHFFFAOYSA-N 2 0 355.551 4.330 20 0 FIADRP c1nc(CCc2ccccc2)sc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657816538 1087099129 /nfs/dbraw/zinc/09/91/29/1087099129.db2.gz WXUBQLIDPSIEDU-UHFFFAOYSA-N 2 0 369.578 4.140 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc3cccnc32)CC1 ZINC000151795434 1087259418 /nfs/dbraw/zinc/25/94/18/1087259418.db2.gz GJXXVDLSYMHQPB-UHFFFAOYSA-N 2 0 374.532 4.057 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657841628 1087278676 /nfs/dbraw/zinc/27/86/76/1087278676.db2.gz PXTGCWTVAXBEPX-HNNXBMFYSA-N 2 0 355.507 4.088 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000089515660 1087395678 /nfs/dbraw/zinc/39/56/78/1087395678.db2.gz OGRXDRSSHPUZKG-QGZVFWFLSA-N 2 0 362.583 4.420 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1cc2cnccc2o1 ZINC000657862007 1087423999 /nfs/dbraw/zinc/42/39/99/1087423999.db2.gz XULHUHNCYDKQMG-HZPDHXFCSA-N 2 0 355.507 4.452 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000091285116 1087427007 /nfs/dbraw/zinc/42/70/07/1087427007.db2.gz SKECYHDIPUVNRB-LJQANCHMSA-N 2 0 372.384 4.308 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000091317661 1087427897 /nfs/dbraw/zinc/42/78/97/1087427897.db2.gz DTDVKYASNWIWQA-IBGZPJMESA-N 2 0 370.459 4.247 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000657886880 1087536307 /nfs/dbraw/zinc/53/63/07/1087536307.db2.gz CEFGKXXSJYCFAW-URVUXULASA-N 2 0 372.597 4.468 20 0 FIADRP FC(F)(F)c1cscc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000685619926 1087645719 /nfs/dbraw/zinc/64/57/19/1087645719.db2.gz MSBGJCBHXZDEFR-UHFFFAOYSA-N 2 0 355.429 4.168 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(F)cc(Br)c1 ZINC000657936534 1087663286 /nfs/dbraw/zinc/66/32/86/1087663286.db2.gz FSECQCUQVLROKZ-QGZVFWFLSA-N 2 0 355.295 4.137 20 0 FIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067171 1087709718 /nfs/dbraw/zinc/70/97/18/1087709718.db2.gz LBCLZQGDULUNQE-HNNXBMFYSA-N 2 0 365.587 4.117 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc2c(c1)CCCC2 ZINC000658069057 1087710768 /nfs/dbraw/zinc/71/07/68/1087710768.db2.gz KLRMETFNJZRNFD-SFHVURJKSA-N 2 0 356.554 4.107 20 0 FIADRP Clc1cccc(C2CC([NH2+]CC3CC[NH+](C4CCOCC4)CC3)C2)c1 ZINC000658070837 1087710886 /nfs/dbraw/zinc/71/08/86/1087710886.db2.gz RUWRURNAJMZVQB-UHFFFAOYSA-N 2 0 362.945 4.067 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000658070494 1087711313 /nfs/dbraw/zinc/71/13/13/1087711313.db2.gz WDOXBNBCZPAUSG-OAHLLOKOSA-N 2 0 370.459 4.247 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC23CCOCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000548859488 1087713388 /nfs/dbraw/zinc/71/33/88/1087713388.db2.gz KUVLIACHKDMIJC-OAQYLSRUSA-N 2 0 356.554 4.228 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(Cl)c1 ZINC000658144496 1087736396 /nfs/dbraw/zinc/73/63/96/1087736396.db2.gz MHNLDRQTEAYSBZ-LEWJYISDSA-N 2 0 358.913 4.148 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCS2 ZINC000658163709 1087758541 /nfs/dbraw/zinc/75/85/41/1087758541.db2.gz ABXXCRGGORZPET-HXUWFJFHSA-N 2 0 371.525 4.259 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1Cl ZINC000658163770 1087759080 /nfs/dbraw/zinc/75/90/80/1087759080.db2.gz AXMNJBUMWOTXLO-HNNXBMFYSA-N 2 0 361.892 4.437 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658164887 1087760240 /nfs/dbraw/zinc/76/02/40/1087760240.db2.gz GMTPSDBNDORTIZ-IBGZPJMESA-N 2 0 367.537 4.432 20 0 FIADRP c1ccc([C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccn2)cc1 ZINC000658166346 1087762082 /nfs/dbraw/zinc/76/20/82/1087762082.db2.gz NVOVUGXBQIQXSB-DEOSSOPVSA-N 2 0 372.516 4.068 20 0 FIADRP CC[C@H](Cc1ccc(C)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166195 1087763152 /nfs/dbraw/zinc/76/31/52/1087763152.db2.gz MYVFEBDZDWJWJE-HSZRJFAPSA-N 2 0 351.538 4.213 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc(OCC[NH+](C)C)c1 ZINC000658172507 1087766427 /nfs/dbraw/zinc/76/64/27/1087766427.db2.gz WEZVUXBSNGDUEZ-INIZCTEOSA-N 2 0 372.484 4.158 20 0 FIADRP C[C@H]([NH2+][C@@H]1CSCc2ccc(Br)cc21)C1CC[NH+](C)CC1 ZINC000658189402 1087778974 /nfs/dbraw/zinc/77/89/74/1087778974.db2.gz RWBRVFGMAMTYGD-YVEFUNNKSA-N 2 0 369.372 4.057 20 0 FIADRP CCC1(C[NH2+][C@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)CC[NH+](Cc2ccccc2)CC1 ZINC000424274776 1087908411 /nfs/dbraw/zinc/90/84/11/1087908411.db2.gz ABFOAPYPWXZECU-YSVGVQOKSA-N 2 0 370.581 4.472 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1 ZINC000424373451 1087962554 /nfs/dbraw/zinc/96/25/54/1087962554.db2.gz GXCHFHZDOMNSHZ-SFHVURJKSA-N 2 0 350.506 4.326 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CN[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000423233538 1088077136 /nfs/dbraw/zinc/07/71/36/1088077136.db2.gz DQCXVFRYTRLTEQ-DNVJHFABSA-N 2 0 351.538 4.235 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414815583 1088244107 /nfs/dbraw/zinc/24/41/07/1088244107.db2.gz XQNOTESQFHJGOY-LBPRGKRZSA-N 2 0 365.340 4.481 20 0 FIADRP CC(C)c1ccc([C@@H](N)C[NH2+]Cc2c[nH]nc2-c2ccccc2F)cc1 ZINC000414821970 1088287648 /nfs/dbraw/zinc/28/76/48/1088287648.db2.gz DCFOOIPEVOEVFP-FQEVSTJZSA-N 2 0 352.457 4.129 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)ccc1OCc1ccc(Cl)cc1 ZINC000414834725 1088391556 /nfs/dbraw/zinc/39/15/56/1088391556.db2.gz QSUOKZDFEGALJU-MRXNPFEDSA-N 2 0 374.912 4.017 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CNC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000414842678 1088498456 /nfs/dbraw/zinc/49/84/56/1088498456.db2.gz IYPBFRHGMAXXIZ-HSZRJFAPSA-N 2 0 351.538 4.064 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000514082569 1088722725 /nfs/dbraw/zinc/72/27/25/1088722725.db2.gz HSRFRUJKJLFKIV-UHFFFAOYSA-N 2 0 354.542 4.051 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCCN2CCc3ccccc3C2)c(C)c1OC ZINC000514084828 1088725358 /nfs/dbraw/zinc/72/53/58/1088725358.db2.gz RWMHCVWASUUIMG-GOSISDBHSA-N 2 0 368.521 4.111 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1OC ZINC000514089123 1088735552 /nfs/dbraw/zinc/73/55/52/1088735552.db2.gz OOVRJZPASMYSRC-SFHVURJKSA-N 2 0 368.521 4.459 20 0 FIADRP COCc1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000514093340 1088742977 /nfs/dbraw/zinc/74/29/77/1088742977.db2.gz JAJRGIYZKPRTPY-UHFFFAOYSA-N 2 0 352.522 4.366 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000514097756 1088768665 /nfs/dbraw/zinc/76/86/65/1088768665.db2.gz AUEJDGLTQHWANE-PPDQVPDSSA-N 2 0 360.546 4.084 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000514243610 1088938099 /nfs/dbraw/zinc/93/80/99/1088938099.db2.gz VMNVBXXQXYFPQI-UHFFFAOYSA-N 2 0 350.384 4.317 20 0 FIADRP C[N@@H+]1CC[C@]2(CC[NH+](CC(c3ccc(F)cc3)c3ccc(F)cc3)C2)C1 ZINC000430117393 1089005373 /nfs/dbraw/zinc/00/53/73/1089005373.db2.gz CPOPSKWHBYDQPI-QFIPXVFZSA-N 2 0 356.460 4.124 20 0 FIADRP c1ccc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)cn2)cc1 ZINC000613644867 1089040243 /nfs/dbraw/zinc/04/02/43/1089040243.db2.gz SSMGSDYFYJQPJV-UHFFFAOYSA-N 2 0 364.537 4.232 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000415018989 1089045050 /nfs/dbraw/zinc/04/50/50/1089045050.db2.gz VDDLTXWESCTSMQ-HNNXBMFYSA-N 2 0 359.901 4.199 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000415029247 1089058491 /nfs/dbraw/zinc/05/84/91/1089058491.db2.gz ZZGCILMFNBAHES-LJQANCHMSA-N 2 0 362.521 4.124 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cn1 ZINC000415050571 1089086915 /nfs/dbraw/zinc/08/69/15/1089086915.db2.gz IMLZAHYTNSHQGV-QFIPXVFZSA-N 2 0 360.505 4.419 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Br)c(F)c1)c1ccccc1 ZINC000415044660 1089090575 /nfs/dbraw/zinc/09/05/75/1089090575.db2.gz ATXLDGLGPPJIQD-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415046353 1089091002 /nfs/dbraw/zinc/09/10/02/1089091002.db2.gz VACKBGXOHKJGQP-SWLSCSKDSA-N 2 0 357.361 4.167 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415045253 1089091207 /nfs/dbraw/zinc/09/12/07/1089091207.db2.gz BGGVIQNDQVIHLZ-WIYYLYMNSA-N 2 0 353.510 4.090 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(Cl)c1 ZINC000415045800 1089091656 /nfs/dbraw/zinc/09/16/56/1089091656.db2.gz BUDGEFZZBNYKGD-QFBILLFUSA-N 2 0 373.928 4.435 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc(Cl)c1OC ZINC000415063187 1089113788 /nfs/dbraw/zinc/11/37/88/1089113788.db2.gz HAMDVCOZXODFGS-SFHVURJKSA-N 2 0 362.901 4.317 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)ccc1OC1CCCC1 ZINC000415084801 1089134513 /nfs/dbraw/zinc/13/45/13/1089134513.db2.gz PXHQLQPNDGEASD-SLFFLAALSA-N 2 0 358.526 4.027 20 0 FIADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)Sc1ccc(Br)cc1 ZINC000415081853 1089138371 /nfs/dbraw/zinc/13/83/71/1089138371.db2.gz CKWJEVLRWSZWDP-DNOWBOINSA-N 2 0 357.361 4.037 20 0 FIADRP C[C@H](C[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000415116476 1089175580 /nfs/dbraw/zinc/17/55/80/1089175580.db2.gz BJSLARBBAWLQMZ-ZMYBRWDISA-N 2 0 370.459 4.027 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)c1 ZINC000415117147 1089177423 /nfs/dbraw/zinc/17/74/23/1089177423.db2.gz BTNFINSPIUISRM-LADGPHEKSA-N 2 0 364.533 4.380 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414863738 1089204145 /nfs/dbraw/zinc/20/41/45/1089204145.db2.gz YBHPQVLMNHKONJ-ZYHUDNBSSA-N 2 0 354.338 4.202 20 0 FIADRP CCOC[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549235837 1089313779 /nfs/dbraw/zinc/31/37/79/1089313779.db2.gz OYWGTUJRHNWNGU-SIOWJKJVSA-N 2 0 350.934 4.269 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549235995 1089314155 /nfs/dbraw/zinc/31/41/55/1089314155.db2.gz TYVMBANGISUOPS-JFTIXFDTSA-N 2 0 364.533 4.059 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(-c2ccnn2C)c1 ZINC000549250700 1089417102 /nfs/dbraw/zinc/41/71/02/1089417102.db2.gz HKSBWHPAMPILAZ-LJQANCHMSA-N 2 0 354.542 4.140 20 0 FIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCCC3CCOCC3)C2)s1 ZINC000514865069 1089555214 /nfs/dbraw/zinc/55/52/14/1089555214.db2.gz FKWPVLIWYXJXTQ-LJQANCHMSA-N 2 0 350.572 4.017 20 0 FIADRP C[C@@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311980292 1089726820 /nfs/dbraw/zinc/72/68/20/1089726820.db2.gz MQDDGMXLLGFDIG-JPYJTQIMSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C(C)(C)[NH+]2CCCCC2)cc1 ZINC001625891500 1089768607 /nfs/dbraw/zinc/76/86/07/1089768607.db2.gz KMCYONFIJLDWLX-SFHVURJKSA-N 2 0 357.542 4.264 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000163781907 1089783441 /nfs/dbraw/zinc/78/34/41/1089783441.db2.gz YNOXVWFEPUOHCI-SSOJOUAXSA-N 2 0 358.551 4.117 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000236806946 1089965152 /nfs/dbraw/zinc/96/51/52/1089965152.db2.gz AXRWWUJUPPKNLF-ZDUSSCGKSA-N 2 0 355.309 4.091 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CCC(C[NH3+])CC2)CCC3)cc1 ZINC000515346387 1089976443 /nfs/dbraw/zinc/97/64/43/1089976443.db2.gz PNZFHUBRZWONCF-PVARCSIZSA-N 2 0 371.550 4.303 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CCC(C[NH3+])CC2)CCC3)cc1 ZINC000515346386 1089976830 /nfs/dbraw/zinc/97/68/30/1089976830.db2.gz PNZFHUBRZWONCF-JFUPDXTOSA-N 2 0 371.550 4.303 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)NCC(C)(C)[NH2+][C@H](C)c1ccccc1 ZINC000415949832 1090026627 /nfs/dbraw/zinc/02/66/27/1090026627.db2.gz GQLZBQLYHUIIBW-QGZVFWFLSA-N 2 0 368.525 4.047 20 0 FIADRP CC(C)C[C@@H](CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000415968597 1090050911 /nfs/dbraw/zinc/05/09/11/1090050911.db2.gz CPHPYCKSNUWDLJ-UWJYYQICSA-N 2 0 368.525 4.032 20 0 FIADRP CSc1cc(Br)ccc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511536323 1090055497 /nfs/dbraw/zinc/05/54/97/1090055497.db2.gz JHGOGUCNZOFZQZ-UHFFFAOYSA-N 2 0 371.388 4.335 20 0 FIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000584552518 1090085533 /nfs/dbraw/zinc/08/55/33/1090085533.db2.gz GIFGFTSBNFSMCH-HXUWFJFHSA-N 2 0 356.485 4.452 20 0 FIADRP C[C@@H]([NH2+]CCn1ccnc1)c1ccc(Br)cc1C(F)(F)F ZINC000188097760 1090169704 /nfs/dbraw/zinc/16/97/04/1090169704.db2.gz MYNQNOMFFVPBNP-SNVBAGLBSA-N 2 0 362.193 4.015 20 0 FIADRP CCC[N@@H+]1CC[C@@H](CNCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000236817112 1090265025 /nfs/dbraw/zinc/26/50/25/1090265025.db2.gz RVGMKBHMPIOAMS-HNNXBMFYSA-N 2 0 355.507 4.378 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(NC(C)=O)cc2)cc1 ZINC000181924049 1090317420 /nfs/dbraw/zinc/31/74/20/1090317420.db2.gz VURQSLKQMFZJJY-KRWDZBQOSA-N 2 0 353.510 4.338 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000312148360 1090320382 /nfs/dbraw/zinc/32/03/82/1090320382.db2.gz DCBKYDQGTJQECS-GGPKGHCWSA-N 2 0 371.525 4.237 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]C1CCN(c2ccccn2)CC1 ZINC000545456776 1090383133 /nfs/dbraw/zinc/38/31/33/1090383133.db2.gz VECRCXMEBXUVMR-QRWLVFNGSA-N 2 0 359.901 4.070 20 0 FIADRP CC[C@H](c1ccccc1)[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)CC(C)C ZINC000511555975 1090396514 /nfs/dbraw/zinc/39/65/14/1090396514.db2.gz DUQUFJAXEHABQP-JOCHJYFZSA-N 2 0 373.585 4.085 20 0 FIADRP c1c(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)onc1C1CC1 ZINC000660151421 1090658294 /nfs/dbraw/zinc/65/82/94/1090658294.db2.gz ZTIBYAWRKIODPI-UHFFFAOYSA-N 2 0 351.494 4.040 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312429935 1090718636 /nfs/dbraw/zinc/71/86/36/1090718636.db2.gz IBQRLTRSVLGVAN-FDDCHVKYSA-N 2 0 365.521 4.208 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000584873700 1090965423 /nfs/dbraw/zinc/96/54/23/1090965423.db2.gz WGTPXSCFHUJQKB-UHFFFAOYSA-N 2 0 368.431 4.234 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000511766246 1091651541 /nfs/dbraw/zinc/65/15/41/1091651541.db2.gz DGSYISHTLVXBEG-CEXWTWQISA-N 2 0 357.542 4.262 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000467850532 1091978380 /nfs/dbraw/zinc/97/83/80/1091978380.db2.gz JJWVRGJORIOIJO-MDZRGWNJSA-N 2 0 372.475 4.493 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512317912 1092028878 /nfs/dbraw/zinc/02/88/78/1092028878.db2.gz HDSVJUKWNIPNKW-NLWGTHIKSA-N 2 0 352.526 4.176 20 0 FIADRP Clc1ccc(C[C@@]2([NH2+]Cc3ccc(-n4ccnc4)cc3)CCOC2)cc1 ZINC000500525857 1092187560 /nfs/dbraw/zinc/18/75/60/1092187560.db2.gz IRMHCUXNMALWIU-NRFANRHFSA-N 2 0 367.880 4.017 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@@H]2Cc3ccccc3O2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011931 1092308779 /nfs/dbraw/zinc/30/87/79/1092308779.db2.gz UJFDDQINVYCORQ-HMFYCAOWSA-N 2 0 350.506 4.021 20 0 FIADRP Cc1ccccc1OCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168012158 1092344475 /nfs/dbraw/zinc/34/44/75/1092344475.db2.gz XBGWBVAVNLVPBA-WOJBJXKFSA-N 2 0 352.522 4.405 20 0 FIADRP COC(=O)c1cc([C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)oc1C ZINC000432781798 1092350304 /nfs/dbraw/zinc/35/03/04/1092350304.db2.gz TWVZWXLJZYAIKV-MRXNPFEDSA-N 2 0 362.514 4.024 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000521272303 1092614495 /nfs/dbraw/zinc/61/44/95/1092614495.db2.gz XIWRYGOYFZTGEZ-SQNIBIBYSA-N 2 0 356.432 4.033 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000521312891 1092635956 /nfs/dbraw/zinc/63/59/56/1092635956.db2.gz JAFJTTOFWLCFTG-LAUBAEHRSA-N 2 0 364.518 4.254 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000521312888 1092635994 /nfs/dbraw/zinc/63/59/94/1092635994.db2.gz JAFJTTOFWLCFTG-DYESRHJHSA-N 2 0 364.518 4.254 20 0 FIADRP CN(Cc1c(-c2ccccc2)nc2ccccn21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512542185 1092690335 /nfs/dbraw/zinc/69/03/35/1092690335.db2.gz LWFNMLGEWJFZKX-YOFSQIOKSA-N 2 0 360.505 4.058 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cncc(Br)c1 ZINC000521464044 1092708610 /nfs/dbraw/zinc/70/86/10/1092708610.db2.gz IVTWBGWDRATURH-OAHLLOKOSA-N 2 0 354.336 4.151 20 0 FIADRP COc1ccc(F)c(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000549711148 1092711069 /nfs/dbraw/zinc/71/10/69/1092711069.db2.gz JSNDUFCGBSOKLZ-KRWDZBQOSA-N 2 0 356.485 4.356 20 0 FIADRP COCc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000549733400 1092731090 /nfs/dbraw/zinc/73/10/90/1092731090.db2.gz GGFASNTYVPNQJQ-UHFFFAOYSA-N 2 0 364.533 4.321 20 0 FIADRP FC(F)C1CCC([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CC1 ZINC000442775514 1092757323 /nfs/dbraw/zinc/75/73/23/1092757323.db2.gz FYZPVAMCQWPCQE-UHFFFAOYSA-N 2 0 365.512 4.002 20 0 FIADRP C[C@@H]1CC[C@@H](C)[NH+]1Cc1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000443088345 1092932068 /nfs/dbraw/zinc/93/20/68/1092932068.db2.gz AKYNLNMRQOPBLA-IAGOWNOFSA-N 2 0 354.498 4.095 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000474056063 1093159409 /nfs/dbraw/zinc/15/94/09/1093159409.db2.gz MGBRHMLRTQVCSR-NRFANRHFSA-N 2 0 368.521 4.148 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000474057474 1093163171 /nfs/dbraw/zinc/16/31/71/1093163171.db2.gz MWVZESWLOBHPDZ-FDFHNCONSA-N 2 0 374.569 4.092 20 0 FIADRP CC(C)(C)c1cc(CN2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)no1 ZINC000433055086 1093166905 /nfs/dbraw/zinc/16/69/05/1093166905.db2.gz DFEQGUZLYFGRLZ-UHFFFAOYSA-N 2 0 367.537 4.460 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CCc2ccccc2)CC1)C1CCC(F)(F)CC1 ZINC000474073799 1093188465 /nfs/dbraw/zinc/18/84/65/1093188465.db2.gz PDXVQXKOHHFRJK-QGZVFWFLSA-N 2 0 350.497 4.497 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)cn1 ZINC001168020122 1093198449 /nfs/dbraw/zinc/19/84/49/1093198449.db2.gz KQKCFZOIYVEUAJ-JHDGKUDLSA-N 2 0 351.538 4.354 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168021914 1093256559 /nfs/dbraw/zinc/25/65/59/1093256559.db2.gz QXZBNNVFXNGRBW-ROUUACIJSA-N 2 0 365.521 4.176 20 0 FIADRP Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000443587545 1093287942 /nfs/dbraw/zinc/28/79/42/1093287942.db2.gz GQGSJXXOZQESFD-HXUWFJFHSA-N 2 0 371.569 4.218 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC000469789833 1093344835 /nfs/dbraw/zinc/34/48/35/1093344835.db2.gz ZXBVJITWILYULD-LPHOPBHVSA-N 2 0 370.990 4.159 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CCc3ccccc3[C@@H]2O)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023855 1093367286 /nfs/dbraw/zinc/36/72/86/1093367286.db2.gz YLNJTDWMRZWJHR-IMWWXNSKSA-N 2 0 364.533 4.066 20 0 FIADRP Brc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918262 1093385546 /nfs/dbraw/zinc/38/55/46/1093385546.db2.gz RTVPEKRIBVVZRB-PIIMJCKOSA-N 2 0 363.343 4.049 20 0 FIADRP Brc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918258 1093385875 /nfs/dbraw/zinc/38/58/75/1093385875.db2.gz RTVPEKRIBVVZRB-BCDXTJNWSA-N 2 0 363.343 4.049 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CCCCC4CCOCC4)C[C@@H]3C2)cc1 ZINC000389160270 1093479367 /nfs/dbraw/zinc/47/93/67/1093479367.db2.gz YNNLUGBLTUQPNA-XZOQPEGZSA-N 2 0 356.554 4.037 20 0 FIADRP COC1(C(F)(F)F)CC[NH+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC000419296576 1093481060 /nfs/dbraw/zinc/48/10/60/1093481060.db2.gz DOFKWIPXKIYYRU-UHFFFAOYSA-N 2 0 370.459 4.216 20 0 FIADRP COc1ccc(Oc2ccc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)cc2)cc1 ZINC000544183380 1093511864 /nfs/dbraw/zinc/51/18/64/1093511864.db2.gz FDUVRURZVFMUFQ-SFHVURJKSA-N 2 0 352.478 4.061 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ncc(C(F)(F)F)s3)CC2)CC1 ZINC000433344195 1093598195 /nfs/dbraw/zinc/59/81/95/1093598195.db2.gz QQNQSQACSUXXNX-UHFFFAOYSA-N 2 0 361.477 4.295 20 0 FIADRP COc1ccc(NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1C[NH3+] ZINC001168031702 1093650032 /nfs/dbraw/zinc/65/00/32/1093650032.db2.gz BJZXSJNWPXEIQW-IRXDYDNUSA-N 2 0 353.510 4.007 20 0 FIADRP COc1ccc(NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1C[NH3+] ZINC001168031701 1093650379 /nfs/dbraw/zinc/65/03/79/1093650379.db2.gz BJZXSJNWPXEIQW-IAGOWNOFSA-N 2 0 353.510 4.007 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)Cc2ccncc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031738 1093654759 /nfs/dbraw/zinc/65/47/59/1093654759.db2.gz DSOXRJBOHYDKNL-HATOLVCRSA-N 2 0 351.538 4.434 20 0 FIADRP C[C@H]1CC([NH2+]CC2(c3ccc(F)cn3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032151 1093656229 /nfs/dbraw/zinc/65/62/29/1093656229.db2.gz FOUIWGDMTPTRGO-ROUUACIJSA-N 2 0 367.512 4.284 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000513019864 1093665494 /nfs/dbraw/zinc/66/54/94/1093665494.db2.gz INYIQCBNHFAVCB-VMPFUQBJSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2(CC3CC3)CCOCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168033384 1093714780 /nfs/dbraw/zinc/71/47/80/1093714780.db2.gz KZFUCQKWWILEJX-HATOLVCRSA-N 2 0 356.554 4.367 20 0 FIADRP Cc1ccnc(C2(C[NH2+]C3C[C@@H](C)[NH+](Cc4ccccc4)[C@H](C)C3)CC2)c1 ZINC001168034748 1093767860 /nfs/dbraw/zinc/76/78/60/1093767860.db2.gz RBTZODMTIBHGGD-WOJBJXKFSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2Cc3ccc(F)cc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168035088 1093792892 /nfs/dbraw/zinc/79/28/92/1093792892.db2.gz SNTIUPQRAOWIGE-TXKCWOHGSA-N 2 0 352.497 4.324 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000474468934 1093806021 /nfs/dbraw/zinc/80/60/21/1093806021.db2.gz FRQJFSCPWAICBZ-HXUWFJFHSA-N 2 0 351.538 4.487 20 0 FIADRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)[C@@H]1C ZINC000474466925 1093813283 /nfs/dbraw/zinc/81/32/83/1093813283.db2.gz BKXVWPBLHUPFNT-IWQHBPENSA-N 2 0 372.553 4.128 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)[C@@H](C)C1CCCCC1 ZINC000474473470 1093818150 /nfs/dbraw/zinc/81/81/50/1093818150.db2.gz JLQCVGALSGOCNX-MOPGFXCFSA-N 2 0 358.570 4.338 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000474483647 1093830463 /nfs/dbraw/zinc/83/04/63/1093830463.db2.gz BCNAJIMQALRZQG-UHFFFAOYSA-N 2 0 360.505 4.066 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccc(F)cc34)CC2)C1 ZINC000513233815 1094015177 /nfs/dbraw/zinc/01/51/77/1094015177.db2.gz OYDRFVJUGQTKOO-OXQOHEQNSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccc(F)cc34)CC2)C1 ZINC000513233816 1094015325 /nfs/dbraw/zinc/01/53/25/1094015325.db2.gz OYDRFVJUGQTKOO-UZLBHIALSA-N 2 0 357.517 4.482 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)c1 ZINC000430004695 1094026036 /nfs/dbraw/zinc/02/60/36/1094026036.db2.gz UELVJBHIOPTGJU-UHFFFAOYSA-N 2 0 358.913 4.480 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)[NH+]2CCCC2)o1 ZINC000513490390 1094158923 /nfs/dbraw/zinc/15/89/23/1094158923.db2.gz DXAXFZRWCQFUBI-BWAGFHJFSA-N 2 0 373.585 4.358 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)[NH+]2CCCC2)o1 ZINC000513495135 1094163511 /nfs/dbraw/zinc/16/35/11/1094163511.db2.gz ZXCQFUQPMAQSGS-COPCDDAFSA-N 2 0 373.585 4.358 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CC[NH+](C(C)(C)C)CC2)CC1 ZINC000513665161 1094272582 /nfs/dbraw/zinc/27/25/82/1094272582.db2.gz BWTYDDJTDISBBN-UHFFFAOYSA-N 3 0 357.586 4.282 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCc3ccccc3O2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036729 1094296415 /nfs/dbraw/zinc/29/64/15/1094296415.db2.gz WSGFMFAQRJFOAW-IYRWYFENSA-N 2 0 364.533 4.411 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(C)o1 ZINC000513696856 1094362645 /nfs/dbraw/zinc/36/26/45/1094362645.db2.gz FIFPJRSCQCZEAF-MQSCRBSSSA-N 2 0 367.537 4.114 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000501013540 1094431684 /nfs/dbraw/zinc/43/16/84/1094431684.db2.gz ZVOSGDMIEPTRNM-NRFANRHFSA-N 2 0 363.977 4.187 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccnn2-c2ccc(F)cc2)c1 ZINC000474623391 1094454359 /nfs/dbraw/zinc/45/43/59/1094454359.db2.gz PISPAFHXPKGYJR-UHFFFAOYSA-N 2 0 366.484 4.141 20 0 FIADRP CC[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1ccc(Cl)c(Cl)c1 ZINC000501075981 1094493859 /nfs/dbraw/zinc/49/38/59/1094493859.db2.gz IXVSOLURMMSURX-UHFFFAOYSA-N 2 0 372.384 4.231 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000467295216 1094569745 /nfs/dbraw/zinc/56/97/45/1094569745.db2.gz KNHNSYNGASRXCU-OAQYLSRUSA-N 2 0 356.485 4.452 20 0 FIADRP CC(C)[C@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1 ZINC000474799921 1094616951 /nfs/dbraw/zinc/61/69/51/1094616951.db2.gz JPWBTGJMUYKKQN-DEOSSOPVSA-N 2 0 366.549 4.173 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1OC ZINC000474793552 1094629905 /nfs/dbraw/zinc/62/99/05/1094629905.db2.gz DWCVPUAYNLHXEP-DLBZAZTESA-N 2 0 360.542 4.192 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000474809894 1094649170 /nfs/dbraw/zinc/64/91/70/1094649170.db2.gz KDZQZKBXWRPIJR-UHFFFAOYSA-N 2 0 366.553 4.313 20 0 FIADRP CCOC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000474815322 1094661167 /nfs/dbraw/zinc/66/11/67/1094661167.db2.gz FHJAKBYWFABVLU-IFMALSPDSA-N 2 0 356.510 4.206 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1OC ZINC000474818614 1094665083 /nfs/dbraw/zinc/66/50/83/1094665083.db2.gz UFSRATKZVORNJL-HOTGVXAUSA-N 2 0 374.500 4.186 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2ccccc2C[N@H+](C)C(C)C)CC1 ZINC000474894846 1094864455 /nfs/dbraw/zinc/86/44/55/1094864455.db2.gz JVBTVIHNDRNZFG-UHFFFAOYSA-N 2 0 360.542 4.128 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000420321413 1094881645 /nfs/dbraw/zinc/88/16/45/1094881645.db2.gz RFVRABUNELJADC-MOPGFXCFSA-N 2 0 354.542 4.186 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C[NH3+])c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000420364457 1094901431 /nfs/dbraw/zinc/90/14/31/1094901431.db2.gz CWRWOYWOUXKRRG-CRAIPNDOSA-N 2 0 364.436 4.080 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420397672 1094911790 /nfs/dbraw/zinc/91/17/90/1094911790.db2.gz XUTFNQAXFMYDPN-CDHAZOANSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420398874 1094911867 /nfs/dbraw/zinc/91/18/67/1094911867.db2.gz ZGIFIHOHJCFTAD-MRAWALMUSA-N 2 0 357.325 4.273 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000501790927 1094925589 /nfs/dbraw/zinc/92/55/89/1094925589.db2.gz PNOIHFKXWJHCKP-UHFFFAOYSA-N 2 0 366.933 4.055 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2cc(F)ccc2F)CC1 ZINC000501817300 1094934376 /nfs/dbraw/zinc/93/43/76/1094934376.db2.gz SJCPKLUNSCIYAX-INIZCTEOSA-N 2 0 354.485 4.096 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474943874 1094939043 /nfs/dbraw/zinc/93/90/43/1094939043.db2.gz OEHLVGQEIDGUOR-HYFFOGBASA-N 2 0 372.940 4.188 20 0 FIADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2cc3cc(Br)ccc3s2)C1 ZINC001205009540 1095256620 /nfs/dbraw/zinc/25/66/20/1095256620.db2.gz WJGQBHQGBVSCGZ-GFCCVEGCSA-N 2 0 353.329 4.095 20 0 FIADRP C[NH+](C)Cc1ccc(NC2CC[NH+](CCc3ccccc3)CC2)c(F)c1 ZINC000414494491 1095284504 /nfs/dbraw/zinc/28/45/04/1095284504.db2.gz DYEMNDPPDLEDQT-UHFFFAOYSA-N 2 0 355.501 4.006 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000502269723 1095287731 /nfs/dbraw/zinc/28/77/31/1095287731.db2.gz PMYMNMGSUUNNFZ-SFHVURJKSA-N 2 0 374.569 4.187 20 0 FIADRP C[N@@H+](Cc1cccc(OCc2ccc(F)cc2)c1)CC1CC[NH+](C)CC1 ZINC000513742448 1095329633 /nfs/dbraw/zinc/32/96/33/1095329633.db2.gz XOYOYPPMSUWAOL-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCO[C@]3(CCSC3)C2)CC1 ZINC000280953141 1095462891 /nfs/dbraw/zinc/46/28/91/1095462891.db2.gz IWLADRHVKYSOJF-JYAXOCDNSA-N 2 0 374.594 4.074 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cn(-c3ccccc3)nc2C(C)(C)C)CC1 ZINC000421367256 1095564699 /nfs/dbraw/zinc/56/46/99/1095564699.db2.gz DHRJVNDIIHVZFR-UHFFFAOYSA-N 2 0 354.542 4.132 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168051036 1095769193 /nfs/dbraw/zinc/76/91/93/1095769193.db2.gz FNWXLIYUFFVCMZ-NHCUHLMSSA-N 3 0 371.613 4.480 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000324585885 1095915446 /nfs/dbraw/zinc/91/54/46/1095915446.db2.gz YRZKDYPDKMPRKT-RBUKOAKNSA-N 2 0 372.384 4.306 20 0 FIADRP C[C@@H]1C[C@@H](N2CC[NH+](CC3CCCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053024 1095921607 /nfs/dbraw/zinc/92/16/07/1095921607.db2.gz LXDCLIPMIGPARO-RUMRUAAYSA-N 2 0 369.597 4.236 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000421879908 1095972742 /nfs/dbraw/zinc/97/27/42/1095972742.db2.gz PMGHUOSEHBHHFU-ABHNRTSZSA-N 2 0 351.332 4.363 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000414669332 1096396794 /nfs/dbraw/zinc/39/67/94/1096396794.db2.gz ZSWYVLHXHAIUND-GCJKJVERSA-N 2 0 360.505 4.017 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000414669335 1096397061 /nfs/dbraw/zinc/39/70/61/1096397061.db2.gz ZSWYVLHXHAIUND-PGRDOPGGSA-N 2 0 360.505 4.017 20 0 FIADRP FC(F)(F)COc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422730282 1096463867 /nfs/dbraw/zinc/46/38/67/1096463867.db2.gz JMGJMSYAPVHWDC-YESZJQIVSA-N 2 0 356.432 4.028 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422733107 1096465677 /nfs/dbraw/zinc/46/56/77/1096465677.db2.gz ATNQLPFCGUUVJE-ADHNUGBLSA-N 2 0 367.356 4.105 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1OC1CCCC1 ZINC000422716399 1096470593 /nfs/dbraw/zinc/47/05/93/1096470593.db2.gz UEPRABOCBSWOJD-VAMGGRTRSA-N 2 0 358.526 4.027 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)NCC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000422760731 1096476228 /nfs/dbraw/zinc/47/62/28/1096476228.db2.gz LFLUPUXOKWAHJG-QZTJIDSGSA-N 2 0 366.553 4.163 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000422742734 1096478391 /nfs/dbraw/zinc/47/83/91/1096478391.db2.gz HABDFOQNRSAFOW-JXFKEZNVSA-N 2 0 372.582 4.034 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1Cl ZINC000422742655 1096478466 /nfs/dbraw/zinc/47/84/66/1096478466.db2.gz GSFIVHSZTLUIOF-YCRPNKLZSA-N 2 0 374.960 4.236 20 0 FIADRP Clc1ccc(SCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422774444 1096487527 /nfs/dbraw/zinc/48/75/27/1096487527.db2.gz XAJDDXUBYBFJCP-AZUAARDMSA-N 2 0 374.937 4.278 20 0 FIADRP Clc1ccccc1OCc1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422776726 1096488640 /nfs/dbraw/zinc/48/86/40/1096488640.db2.gz DGOKHHHMIHPBPR-DFNIBXOVSA-N 2 0 356.897 4.292 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)oc21 ZINC000422780954 1096488701 /nfs/dbraw/zinc/48/87/01/1096488701.db2.gz HZOXIBAMRDQXPA-ZFWWWQNUSA-N 2 0 353.466 4.405 20 0 FIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1 ZINC000422778320 1096489206 /nfs/dbraw/zinc/48/92/06/1096489206.db2.gz DJOFLKXTKZBWHY-HJNYFJLDSA-N 2 0 354.469 4.368 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000503597845 1096490962 /nfs/dbraw/zinc/49/09/62/1096490962.db2.gz LJLLZHXVTDSZHU-UHFFFAOYSA-N 2 0 369.372 4.301 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422795382 1096492440 /nfs/dbraw/zinc/49/24/40/1096492440.db2.gz HLVNUWKFUDIKAF-MJGOQNOKSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc2cc(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422799495 1096493648 /nfs/dbraw/zinc/49/36/48/1096493648.db2.gz XAGDRFOHBXONAE-VWNXMTODSA-N 2 0 374.484 4.194 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422807139 1096496236 /nfs/dbraw/zinc/49/62/36/1096496236.db2.gz OMACGXJWFKTIBW-HLLQZAQXSA-N 2 0 374.431 4.195 20 0 FIADRP c1ccc2cc(OCC[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422804489 1096496248 /nfs/dbraw/zinc/49/62/48/1096496248.db2.gz FEAVQTUXDBBFPP-ISKFKSNPSA-N 2 0 374.484 4.064 20 0 FIADRP c1ccc2cc(OCC[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422804492 1096496338 /nfs/dbraw/zinc/49/63/38/1096496338.db2.gz FEAVQTUXDBBFPP-VWNXMTODSA-N 2 0 374.484 4.064 20 0 FIADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422791242 1096497928 /nfs/dbraw/zinc/49/79/28/1096497928.db2.gz PZAMDDABFCEMGN-OLZOCXBDSA-N 2 0 353.388 4.108 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)c(Cl)c1 ZINC000422831897 1096501830 /nfs/dbraw/zinc/50/18/30/1096501830.db2.gz FLSBEFUFSSFPCA-FHLIZLRMSA-N 2 0 371.352 4.018 20 0 FIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422838329 1096503046 /nfs/dbraw/zinc/50/30/46/1096503046.db2.gz OEFCWPBFAPSKKT-QHAWAJNXSA-N 2 0 374.594 4.147 20 0 FIADRP c1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422848723 1096504479 /nfs/dbraw/zinc/50/44/79/1096504479.db2.gz UESGEAJHHLZUEV-PWRODBHTSA-N 2 0 351.494 4.274 20 0 FIADRP c1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422848721 1096504636 /nfs/dbraw/zinc/50/46/36/1096504636.db2.gz UESGEAJHHLZUEV-NJDAHSKKSA-N 2 0 351.494 4.274 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000422846601 1096504724 /nfs/dbraw/zinc/50/47/24/1096504724.db2.gz FSTRLAYYZLRWQO-HIRMHNASSA-N 2 0 368.443 4.201 20 0 FIADRP COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)c(C)c2c1 ZINC000422855006 1096505447 /nfs/dbraw/zinc/50/54/47/1096505447.db2.gz BRVHELWRBWOSQM-UKRRQHHQSA-N 2 0 353.466 4.324 20 0 FIADRP CSCc1cc(F)ccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422866578 1096508307 /nfs/dbraw/zinc/50/83/07/1096508307.db2.gz QSFYSTFSJCAPTQ-PZJWPPBQSA-N 2 0 372.509 4.034 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000422884259 1096512090 /nfs/dbraw/zinc/51/20/90/1096512090.db2.gz WPYNXNRTNRDHQM-MLGOLLRUSA-N 2 0 367.946 4.176 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NC(C)(C)CCC[NH3+])C1CCCCC1 ZINC000414701609 1096512289 /nfs/dbraw/zinc/51/22/89/1096512289.db2.gz AKOCEALXAPXQAZ-UHFFFAOYSA-N 2 0 360.546 4.090 20 0 FIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422883989 1096512306 /nfs/dbraw/zinc/51/23/06/1096512306.db2.gz WDTYBXVIRFCHSV-ROUUACIJSA-N 2 0 371.352 4.291 20 0 FIADRP c1ccc(Sc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422891739 1096512509 /nfs/dbraw/zinc/51/25/09/1096512509.db2.gz WHQBWQPZMRKFKQ-PWRODBHTSA-N 2 0 368.546 4.085 20 0 FIADRP CC(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422891058 1096515468 /nfs/dbraw/zinc/51/54/68/1096515468.db2.gz UOVLJVKBDJUGOM-RJGXRXQPSA-N 2 0 370.581 4.369 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cn2)cc1 ZINC000422900922 1096519424 /nfs/dbraw/zinc/51/94/24/1096519424.db2.gz RBWLXIXHMFHPNG-VAMGGRTRSA-N 2 0 355.457 4.023 20 0 FIADRP c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)CCCCCC2)cc1 ZINC000422909589 1096521224 /nfs/dbraw/zinc/52/12/24/1096521224.db2.gz OJHUMEDVXJRCOL-BHDDXSALSA-N 2 0 356.554 4.025 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)cc1OC ZINC000422925467 1096525929 /nfs/dbraw/zinc/52/59/29/1096525929.db2.gz VILLQIJFXYRVAO-CPAJTMIGSA-N 2 0 374.912 4.306 20 0 FIADRP Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422964022 1096533779 /nfs/dbraw/zinc/53/37/79/1096533779.db2.gz KFWICMMXLXQLOH-RJGXRXQPSA-N 2 0 366.553 4.014 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000422965060 1096533845 /nfs/dbraw/zinc/53/38/45/1096533845.db2.gz NLPFZXKTWJLEMI-IBGZPJMESA-N 3 0 351.538 4.166 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423035611 1096556113 /nfs/dbraw/zinc/55/61/13/1096556113.db2.gz SADHWNIFUKZMTA-BEFAXECRSA-N 2 0 370.368 4.065 20 0 FIADRP C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CC[NH2+]C1 ZINC000423060772 1096560441 /nfs/dbraw/zinc/56/04/41/1096560441.db2.gz IWKSTLCEKACMIJ-JKOKRWQUSA-N 2 0 354.338 4.287 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@H](C)CCCC[NH3+])on1 ZINC000423050774 1096565427 /nfs/dbraw/zinc/56/54/27/1096565427.db2.gz ZIKFYZGOTJDKCD-OAHLLOKOSA-N 2 0 353.466 4.111 20 0 FIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000423093232 1096571976 /nfs/dbraw/zinc/57/19/76/1096571976.db2.gz GQNYMIZQFNBVMG-PYTWLRIVSA-N 2 0 355.295 4.084 20 0 FIADRP FC(F)(F)COc1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423096249 1096573039 /nfs/dbraw/zinc/57/30/39/1096573039.db2.gz OHLVEJJDIVZPAB-GBESFXJTSA-N 2 0 370.459 4.071 20 0 FIADRP CCCN(C)[C@@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(Cl)cc1 ZINC000423102696 1096576569 /nfs/dbraw/zinc/57/65/69/1096576569.db2.gz KKTRFOHYODPKFB-BTYIYWSLSA-N 2 0 374.960 4.236 20 0 FIADRP Fc1cc(C2CC2)ccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423123497 1096578538 /nfs/dbraw/zinc/57/85/38/1096578538.db2.gz DZWCBMMHAPJHEK-IFMALSPDSA-N 2 0 352.453 4.049 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112051 1096585527 /nfs/dbraw/zinc/58/55/27/1096585527.db2.gz XGZVPQVDHFNTRE-PAXLWEDBSA-N 2 0 354.519 4.315 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000423149191 1096587555 /nfs/dbraw/zinc/58/75/55/1096587555.db2.gz XLURGGXVBMJCRJ-ZDUSSCGKSA-N 2 0 365.399 4.087 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH+]1CCC(Cc2cc(F)ccc2F)CC1 ZINC000423164847 1096599853 /nfs/dbraw/zinc/59/98/53/1096599853.db2.gz TUICRSQWJMEPQV-OAHLLOKOSA-N 2 0 359.464 4.143 20 0 FIADRP CC[C@@H](C[N@H+](Cc1nccs1)[C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000414723838 1096615267 /nfs/dbraw/zinc/61/52/67/1096615267.db2.gz QNLWZIAEXPSEMJ-PKOBYXMFSA-N 2 0 355.551 4.281 20 0 FIADRP c1csc(CN(Cc2ccc(C3CC3)cc2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000414722440 1096617312 /nfs/dbraw/zinc/61/73/12/1096617312.db2.gz MHKZTWNRYYKUPV-IBGZPJMESA-N 2 0 353.535 4.165 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH3+])CC2)C(C)C)c(Br)c1 ZINC000423239035 1096617735 /nfs/dbraw/zinc/61/77/35/1096617735.db2.gz VWASVJNMQZZABY-FVKWTLKZSA-N 2 0 355.320 4.014 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423222139 1096621587 /nfs/dbraw/zinc/62/15/87/1096621587.db2.gz ZVNWLAHDLNGLHG-BPQIPLTHSA-N 2 0 355.551 4.474 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253298 1096630397 /nfs/dbraw/zinc/63/03/97/1096630397.db2.gz VSAWDNYXDZIKCE-BBRMVZONSA-N 2 0 361.942 4.430 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)CCC2 ZINC000423257414 1096631868 /nfs/dbraw/zinc/63/18/68/1096631868.db2.gz JHNQBOGCXZNSSO-WMLDXEAASA-N 2 0 359.514 4.306 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000423289714 1096635197 /nfs/dbraw/zinc/63/51/97/1096635197.db2.gz BQDUETIMCGDFDO-NWLLBJEDSA-N 3 0 351.538 4.239 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)c(Br)c1 ZINC000423291523 1096635995 /nfs/dbraw/zinc/63/59/95/1096635995.db2.gz ISGPRSVNYFXKHU-NWDGAFQWSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423317042 1096642227 /nfs/dbraw/zinc/64/22/27/1096642227.db2.gz BEVFFEHEIGQPBM-GFCCVEGCSA-N 2 0 351.288 4.236 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2Br)cc1 ZINC000423295693 1096644744 /nfs/dbraw/zinc/64/47/44/1096644744.db2.gz XFJYTGSOJVKXJZ-VXGBXAGGSA-N 2 0 351.263 4.459 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000423346803 1096646552 /nfs/dbraw/zinc/64/65/52/1096646552.db2.gz PQDYYGMSTJNKCT-LBPRGKRZSA-N 2 0 365.308 4.058 20 0 FIADRP CCOc1ccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423344101 1096646828 /nfs/dbraw/zinc/64/68/28/1096646828.db2.gz MPMWVPLDMRXDKM-NRFANRHFSA-N 2 0 356.897 4.337 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCc3cc(N)ccc32)CC1 ZINC000423354084 1096654113 /nfs/dbraw/zinc/65/41/13/1096654113.db2.gz CMYVVCQSTDWWMF-HOYKHHGWSA-N 2 0 363.549 4.331 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423368145 1096658565 /nfs/dbraw/zinc/65/85/65/1096658565.db2.gz DCLVBODYHQXFHF-GOSISDBHSA-N 2 0 357.295 4.138 20 0 FIADRP CC1CC[NH+](CCC[C@H](N[C@@H]2CC[NH2+][C@@H](C)C2)c2ccc(F)cc2)CC1 ZINC000423392992 1096665352 /nfs/dbraw/zinc/66/53/52/1096665352.db2.gz XZGCYOQZVXGOTK-BWAGFHJFSA-N 2 0 361.549 4.109 20 0 FIADRP Brc1ccc([C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423398136 1096667407 /nfs/dbraw/zinc/66/74/07/1096667407.db2.gz TZHIJWNHBAHMOD-LJQANCHMSA-N 2 0 357.295 4.293 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)CCC2 ZINC000423421954 1096669309 /nfs/dbraw/zinc/66/93/09/1096669309.db2.gz BGBXUJBVEJCGSE-KVSKMBFKSA-N 2 0 371.525 4.304 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000423416617 1096676081 /nfs/dbraw/zinc/67/60/81/1096676081.db2.gz CZXNLRASTXQJRJ-FIKGOQFSSA-N 2 0 357.929 4.374 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H](C)CCC[NH3+])nc1 ZINC000423450570 1096680224 /nfs/dbraw/zinc/68/02/24/1096680224.db2.gz HLXDOYVUKAQKSY-IERDGZPVSA-N 2 0 359.945 4.168 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000423459987 1096689384 /nfs/dbraw/zinc/68/93/84/1096689384.db2.gz APWLIRUCJPTCCI-FABXCBLPSA-N 2 0 355.295 4.146 20 0 FIADRP COCCC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423467622 1096691612 /nfs/dbraw/zinc/69/16/12/1096691612.db2.gz BMFUEOBRDBRVKV-MSOLQXFVSA-N 2 0 369.347 4.039 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000423465330 1096691770 /nfs/dbraw/zinc/69/17/70/1096691770.db2.gz HSVLPJCEADBUFJ-SGXKBVARSA-N 2 0 370.516 4.181 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)CCC2 ZINC000423472173 1096693970 /nfs/dbraw/zinc/69/39/70/1096693970.db2.gz MXOFFEUNFBIFOS-CGTJXYLNSA-N 2 0 373.541 4.205 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(C)c1 ZINC000423472248 1096694028 /nfs/dbraw/zinc/69/40/28/1096694028.db2.gz NBWWBYXMSBSRBT-SGXKBVARSA-N 2 0 356.485 4.187 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCS2 ZINC000423472389 1096694362 /nfs/dbraw/zinc/69/43/62/1096694362.db2.gz FUXOJKCSKPTHEA-UKRRQHHQSA-N 2 0 355.345 4.108 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000423482437 1096696693 /nfs/dbraw/zinc/69/66/93/1096696693.db2.gz XRMPACFEBABUFD-URHOCTSQSA-N 2 0 367.512 4.230 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000423493361 1096706208 /nfs/dbraw/zinc/70/62/08/1096706208.db2.gz BHQHDDSIPYGTCE-AUJRIZCKSA-N 2 0 362.489 4.493 20 0 FIADRP COc1cc(OC)c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1Cl ZINC000423496701 1096707383 /nfs/dbraw/zinc/70/73/83/1096707383.db2.gz FKDMDSNMELJTKH-KSSFIOAISA-N 2 0 362.901 4.488 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21)c1ccccc1 ZINC000423524475 1096712976 /nfs/dbraw/zinc/71/29/76/1096712976.db2.gz XBBBVLSNVCKOJZ-FGZHOGPDSA-N 2 0 360.505 4.320 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423537771 1096715606 /nfs/dbraw/zinc/71/56/06/1096715606.db2.gz DNCWBNYHSOGSJF-WQANXHIZSA-N 2 0 355.551 4.081 20 0 FIADRP CSC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000423538955 1096715821 /nfs/dbraw/zinc/71/58/21/1096715821.db2.gz HIPIVZHZWYOPBW-SRABZTEZSA-N 2 0 358.473 4.087 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1OCc1ccccc1 ZINC000423538715 1096715880 /nfs/dbraw/zinc/71/58/80/1096715880.db2.gz GYZJDXMSOJPNQZ-OYNPSCLESA-N 2 0 350.506 4.304 20 0 FIADRP C[C@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000423540677 1096716749 /nfs/dbraw/zinc/71/67/49/1096716749.db2.gz ABVALXZRAIULTC-SFHVURJKSA-N 2 0 363.505 4.077 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546838 1096718215 /nfs/dbraw/zinc/71/82/15/1096718215.db2.gz ZOFQAJPJBCFGAZ-SJKOYZFVSA-N 2 0 367.356 4.131 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423547814 1096718332 /nfs/dbraw/zinc/71/83/32/1096718332.db2.gz QGRRWKNNMFVPBQ-BURFUSLBSA-N 2 0 371.525 4.304 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423550589 1096719495 /nfs/dbraw/zinc/71/94/95/1096719495.db2.gz SWNURGWCDFOWTC-LIEJCIORSA-N 2 0 352.444 4.319 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000515591807 1098758809 /nfs/dbraw/zinc/75/88/09/1098758809.db2.gz AYROVRJGKKNTME-WIYYLYMNSA-N 2 0 354.542 4.078 20 0 FIADRP Fc1cccc2[nH]c(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)cc21 ZINC000436229619 1098836421 /nfs/dbraw/zinc/83/64/21/1098836421.db2.gz FLFOHCTWLIRJIM-UHFFFAOYSA-N 2 0 367.468 4.071 20 0 FIADRP Fc1cccc2[nH]c(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)cc21 ZINC000436275313 1098901638 /nfs/dbraw/zinc/90/16/38/1098901638.db2.gz ONISQZLELVMQAL-UHFFFAOYSA-N 2 0 351.469 4.309 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)cn1 ZINC000436275775 1098902437 /nfs/dbraw/zinc/90/24/37/1098902437.db2.gz QMBCKOOSTHAUNU-UHFFFAOYSA-N 2 0 353.510 4.145 20 0 FIADRP CC1(C)CCc2ccccc2[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C1 ZINC000436292354 1098907514 /nfs/dbraw/zinc/90/75/14/1098907514.db2.gz NACOURMXBPEFQM-GCJKJVERSA-N 2 0 356.554 4.181 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)C1 ZINC000436304957 1098917796 /nfs/dbraw/zinc/91/77/96/1098917796.db2.gz GBSZJCBHOMIWAY-YPAWHYETSA-N 2 0 356.554 4.058 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)ccc1OC ZINC000841762550 1098959419 /nfs/dbraw/zinc/95/94/19/1098959419.db2.gz XIUDIHMJAVEQBQ-VGSWGCGISA-N 2 0 368.521 4.459 20 0 FIADRP C[C@@H]1OCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000533362462 1098981252 /nfs/dbraw/zinc/98/12/52/1098981252.db2.gz XDUKHRVGQRRYRX-FDDCHVKYSA-N 2 0 350.506 4.216 20 0 FIADRP CCC1(C[NH2+]Cc2ccc3[nH]cnc3c2)CC[NH+](Cc2ccccc2)CC1 ZINC000533583753 1099198271 /nfs/dbraw/zinc/19/82/71/1099198271.db2.gz JEXJRYDESVKAKP-UHFFFAOYSA-N 2 0 362.521 4.345 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC001211996031 1099227550 /nfs/dbraw/zinc/22/75/50/1099227550.db2.gz QJHLCRMJIISESE-UHFFFAOYSA-N 2 0 367.537 4.147 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@@H]2CCC[C@@H]21 ZINC000516324644 1099371171 /nfs/dbraw/zinc/37/11/71/1099371171.db2.gz XWBHALNZIDQFTM-FUDKSRODSA-N 2 0 374.532 4.047 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cn1 ZINC000437132876 1099630109 /nfs/dbraw/zinc/63/01/09/1099630109.db2.gz HXHRUTIWBFJQBA-UHFFFAOYSA-N 2 0 352.526 4.013 20 0 FIADRP C[C@@H]([NH2+]CCc1nc2ccccc2s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508691804 1099824404 /nfs/dbraw/zinc/82/44/04/1099824404.db2.gz QEPKUATUQSQHRB-IEBWSBKVSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2cccnc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508700786 1099853950 /nfs/dbraw/zinc/85/39/50/1099853950.db2.gz RJNFXKMFCMUMDV-WMZHIEFXSA-N 2 0 359.517 4.278 20 0 FIADRP C[C@H](COc1ccc(F)cc1F)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702513 1099855429 /nfs/dbraw/zinc/85/54/29/1099855429.db2.gz ZILSBGHWGDQPLV-ZIFCJYIRSA-N 2 0 374.475 4.232 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000508708936 1099887674 /nfs/dbraw/zinc/88/76/74/1099887674.db2.gz FCXQGUBSRIBUKA-BAGYTPMASA-N 2 0 369.553 4.163 20 0 FIADRP C[C@H]([NH2+]CCCN(C)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721443 1099937251 /nfs/dbraw/zinc/93/72/51/1099937251.db2.gz USOMYRFZJVVIBK-RBBKRZOGSA-N 2 0 351.538 4.013 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)Cc1ccccc1 ZINC000508720921 1099939336 /nfs/dbraw/zinc/93/93/36/1099939336.db2.gz NWSOJSNYWGPJPN-AWRGLXIESA-N 2 0 365.565 4.007 20 0 FIADRP [NH3+]C1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000437783973 1100175282 /nfs/dbraw/zinc/17/52/82/1100175282.db2.gz JIIWGTITFMOURJ-UHFFFAOYSA-N 2 0 364.468 4.038 20 0 FIADRP c1sc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)nc1C1CCCCC1 ZINC000459451153 1100188510 /nfs/dbraw/zinc/18/85/10/1100188510.db2.gz ASCFWVNTMUTIIW-UHFFFAOYSA-N 2 0 370.566 4.387 20 0 FIADRP Cc1nn(-c2ccc(F)cc2)c(C)c1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000536696646 1100197089 /nfs/dbraw/zinc/19/70/89/1100197089.db2.gz ATJAMGQSFQGYIV-UHFFFAOYSA-N 2 0 372.532 4.182 20 0 FIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000536695428 1100197588 /nfs/dbraw/zinc/19/75/88/1100197588.db2.gz BDJOJENUHJIZMC-OAQYLSRUSA-N 2 0 374.532 4.189 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1OC ZINC000379625508 1100223520 /nfs/dbraw/zinc/22/35/20/1100223520.db2.gz FTKGDRYMPCTUHC-QZTJIDSGSA-N 2 0 356.510 4.265 20 0 FIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCCC[N@H+]3C[C@H]3CCOC3)CC2)cc1 ZINC000459517864 1100256983 /nfs/dbraw/zinc/25/69/83/1100256983.db2.gz GDGSFNVTLKZODY-GGAORHGYSA-N 2 0 356.554 4.180 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(C4CC4)cc3)cc2)CC1 ZINC000459519828 1100257745 /nfs/dbraw/zinc/25/77/45/1100257745.db2.gz HSMMIFNZRWUSDL-UHFFFAOYSA-N 2 0 350.506 4.327 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nnc(-c3ccccc3)o2)CC1)CC1CC1 ZINC000536736258 1100261962 /nfs/dbraw/zinc/26/19/62/1100261962.db2.gz FMBBKNRSFOJURR-UHFFFAOYSA-N 2 0 368.525 4.071 20 0 FIADRP Clc1ccc(OCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000459570762 1100318601 /nfs/dbraw/zinc/31/86/01/1100318601.db2.gz NTSITGTZQRGKIJ-UHFFFAOYSA-N 2 0 366.292 4.026 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)CC1 ZINC000459589243 1100330758 /nfs/dbraw/zinc/33/07/58/1100330758.db2.gz XYGFOMUQMWDAAY-QFIPXVFZSA-N 2 0 355.570 4.020 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536834946 1100346964 /nfs/dbraw/zinc/34/69/64/1100346964.db2.gz YUAWAHMAUFSGAA-ICSRJNTNSA-N 2 0 354.542 4.199 20 0 FIADRP Cc1ccn(-c2ccccc2C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000536847765 1100359873 /nfs/dbraw/zinc/35/98/73/1100359873.db2.gz WSZGXAUKEDUZDY-XXBNENTESA-N 2 0 374.532 4.181 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000425939192 1100362000 /nfs/dbraw/zinc/36/20/00/1100362000.db2.gz ZDZXFOUBSIDOLJ-NQIIRXRSSA-N 2 0 357.929 4.340 20 0 FIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000536856340 1100371909 /nfs/dbraw/zinc/37/19/09/1100371909.db2.gz FBMUOYAUHUYHBN-IKGGRYGDSA-N 2 0 372.475 4.115 20 0 FIADRP Brc1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000536861402 1100378335 /nfs/dbraw/zinc/37/83/35/1100378335.db2.gz CVKAMSAAHNCKCM-LJQANCHMSA-N 2 0 363.343 4.433 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(F)cc1 ZINC000536877411 1100399183 /nfs/dbraw/zinc/39/91/83/1100399183.db2.gz POBQPSQNADORFZ-LJQANCHMSA-N 2 0 355.501 4.079 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000438058004 1100401529 /nfs/dbraw/zinc/40/15/29/1100401529.db2.gz LEKUOXGMPFTXLO-KRWDZBQOSA-N 2 0 356.432 4.078 20 0 FIADRP Brc1cccc(C2CC([NH2+]Cc3ccc4c[nH+]cn4c3)C2)c1 ZINC000459659090 1100404463 /nfs/dbraw/zinc/40/44/63/1100404463.db2.gz LJOQGDOOPFFKTP-UHFFFAOYSA-N 2 0 356.267 4.133 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000517552793 1100478622 /nfs/dbraw/zinc/47/86/22/1100478622.db2.gz DAXJNSCCCKOEKG-UHFFFAOYSA-N 2 0 362.521 4.030 20 0 FIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414932710 1100695721 /nfs/dbraw/zinc/69/57/21/1100695721.db2.gz DESFIFFQVGKRAE-KDOFPFPSSA-N 2 0 360.933 4.046 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000517936818 1100803731 /nfs/dbraw/zinc/80/37/31/1100803731.db2.gz ZLVATJAOEJHQSI-MAUKXSAKSA-N 2 0 371.912 4.152 20 0 FIADRP CCOc1ncccc1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438831750 1100950694 /nfs/dbraw/zinc/95/06/94/1100950694.db2.gz ZQBITWZWMVKJPM-UHFFFAOYSA-N 2 0 353.510 4.013 20 0 FIADRP CN(C)c1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000438842595 1100951594 /nfs/dbraw/zinc/95/15/94/1100951594.db2.gz PACFAZCEWYIJOH-UHFFFAOYSA-N 2 0 351.538 4.285 20 0 FIADRP Brc1cccc(-c2ccc(C[NH2+]CCCCn3ccnc3)o2)c1 ZINC000518263405 1101048362 /nfs/dbraw/zinc/04/83/62/1101048362.db2.gz NIBLMBRUKJCPIK-UHFFFAOYSA-N 2 0 374.282 4.476 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccccc2Br)CCC1 ZINC000426327990 1101281517 /nfs/dbraw/zinc/28/15/17/1101281517.db2.gz WQRFKOFZJQXRDI-IIDMSEBBSA-N 2 0 365.359 4.189 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000414994409 1101330624 /nfs/dbraw/zinc/33/06/24/1101330624.db2.gz DNEVFQGZFRXOLF-WMZOPIPTSA-N 2 0 366.534 4.208 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459724450 1101345871 /nfs/dbraw/zinc/34/58/71/1101345871.db2.gz DRXCZCWQGTXSBA-SFHVURJKSA-N 2 0 374.960 4.023 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1O ZINC000426363627 1101375761 /nfs/dbraw/zinc/37/57/61/1101375761.db2.gz BUFZLMWIJMFSJQ-GOSISDBHSA-N 2 0 368.521 4.108 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCc2cccnc2)cc1 ZINC000537024564 1101403151 /nfs/dbraw/zinc/40/31/51/1101403151.db2.gz PVUUPHVVHNLJAW-RXVVDRJESA-N 2 0 353.510 4.186 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)Sc2ccc(Br)cc2)CC1 ZINC000537060211 1101417487 /nfs/dbraw/zinc/41/74/87/1101417487.db2.gz SQGTXXQJQBWDLC-CQSZACIVSA-N 2 0 371.388 4.394 20 0 FIADRP CC[NH+](CC)[C@@H](CNC1CC[NH+](CC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000462030445 1101525913 /nfs/dbraw/zinc/52/59/13/1101525913.db2.gz JFJNRMMONVIZSI-IBGZPJMESA-N 2 0 371.491 4.162 20 0 FIADRP Cc1nc2ccc(C[NH2+]C[C@@H]3C[NH2+]CC[C@@H]3c3ccc(F)cc3)cc2s1 ZINC000415000681 1101534312 /nfs/dbraw/zinc/53/43/12/1101534312.db2.gz KJWQUJOAAIULAE-PKOBYXMFSA-N 2 0 369.509 4.227 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000178741859 1101534381 /nfs/dbraw/zinc/53/43/81/1101534381.db2.gz DYCZZVBJDXGRJB-AVRDEDQJSA-N 2 0 365.521 4.337 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](CC2CCC2)c2ccccc2)ccn1 ZINC000537308124 1101633022 /nfs/dbraw/zinc/63/30/22/1101633022.db2.gz QWFSBAXIAZHSQY-OAQYLSRUSA-N 2 0 353.510 4.043 20 0 FIADRP c1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc(N2CCCCC2)c1 ZINC001167964869 1101639825 /nfs/dbraw/zinc/63/98/25/1101639825.db2.gz ZCJMSAFYDLQQCR-BRTIRZTQSA-N 2 0 353.554 4.172 20 0 FIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000398038989 1101961373 /nfs/dbraw/zinc/96/13/73/1101961373.db2.gz RAWNZRFTVGDECX-GBXCKJPGSA-N 2 0 363.549 4.156 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1OCC ZINC000415009037 1102052986 /nfs/dbraw/zinc/05/29/86/1102052986.db2.gz SZONBTMRHIUBKC-ZBFHGGJFSA-N 2 0 354.922 4.135 20 0 FIADRP COc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2Cl)cc1OC ZINC000643465563 1102132303 /nfs/dbraw/zinc/13/23/03/1102132303.db2.gz WFBPJWJPWJELIK-HRAATJIYSA-N 2 0 374.912 4.178 20 0 FIADRP CCC[NH+](CCC)CCN1CC[NH+]([C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168188749 1102193003 /nfs/dbraw/zinc/19/30/03/1102193003.db2.gz OHPLSCLYACUERN-IBGZPJMESA-N 2 0 365.993 4.011 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1Cl ZINC000120876638 1102261958 /nfs/dbraw/zinc/26/19/58/1102261958.db2.gz KKNQRMJLFMHAJR-ZDUSSCGKSA-N 2 0 350.865 4.400 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(=O)OC)cc1 ZINC000550782929 1102281533 /nfs/dbraw/zinc/28/15/33/1102281533.db2.gz BSDWOKIBEAJXAY-SCWSEQNSSA-N 2 0 358.526 4.167 20 0 FIADRP C[C@@H]1C[C@H](NC[C@@H](c2ccco2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000532441725 1102330799 /nfs/dbraw/zinc/33/07/99/1102330799.db2.gz FHAKPWRZKLRPMI-FCEUIQTBSA-N 2 0 367.537 4.059 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3CCC[NH2+][C@H]3c3ccccc3)n2)cc1 ZINC001211850188 1102377046 /nfs/dbraw/zinc/37/70/46/1102377046.db2.gz WLWLCGIDCKPFRT-PMACEKPBSA-N 2 0 362.477 4.007 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cccc(CO)c1 ZINC000121535338 1102409812 /nfs/dbraw/zinc/40/98/12/1102409812.db2.gz QCOOCFLAIPVRCV-LJQANCHMSA-N 2 0 352.522 4.406 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC)c(Cl)c2)[C@H](C)C1 ZINC000532500928 1102431992 /nfs/dbraw/zinc/43/19/92/1102431992.db2.gz RMOATJYQPLOLOK-MDZRGWNJSA-N 2 0 368.949 4.136 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H](CC2CC2)c2ccccc2)(N2CCCCC2)CC1 ZINC000532524877 1102443636 /nfs/dbraw/zinc/44/36/36/1102443636.db2.gz QNRGNPUXZSGSFL-JOCHJYFZSA-N 2 0 355.570 4.068 20 0 FIADRP c1oc(-c2ccccc2)nc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000122142925 1102531090 /nfs/dbraw/zinc/53/10/90/1102531090.db2.gz GLKVCXACVKKYAM-UHFFFAOYSA-N 2 0 353.510 4.430 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccsc2C)CC1 ZINC000550121860 1102548124 /nfs/dbraw/zinc/54/81/24/1102548124.db2.gz ADGOQJQYFUQFAQ-HNNXBMFYSA-N 2 0 361.530 4.188 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cnc3ccsc3c2)[C@H](C)C1 ZINC000122319515 1102566090 /nfs/dbraw/zinc/56/60/90/1102566090.db2.gz MGCRAZDFUQKPPQ-RYRKJORJSA-N 2 0 361.555 4.084 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000122368356 1102568845 /nfs/dbraw/zinc/56/88/45/1102568845.db2.gz KKPUYQNSRHHPMK-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP CCOCCC1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCCC1 ZINC000122504568 1102586677 /nfs/dbraw/zinc/58/66/77/1102586677.db2.gz RCFOAFOLOPGSES-UHFFFAOYSA-N 2 0 358.570 4.270 20 0 FIADRP c1cnc2c(c1)CC[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCCCC3)c1)CC2 ZINC001648986977 1102588393 /nfs/dbraw/zinc/58/83/93/1102588393.db2.gz YXERFFQEOHFSII-HSZRJFAPSA-N 2 0 363.549 4.495 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(NC(=O)N(CC)CC)cc2)CC1 ZINC000122644476 1102603918 /nfs/dbraw/zinc/60/39/18/1102603918.db2.gz WKQZHZCUHYGEHV-GOSISDBHSA-N 2 0 374.573 4.333 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000122683201 1102611496 /nfs/dbraw/zinc/61/14/96/1102611496.db2.gz JSYXPFGOCYHQSQ-CQSZACIVSA-N 2 0 356.457 4.069 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000122742358 1102618856 /nfs/dbraw/zinc/61/88/56/1102618856.db2.gz POAQLVUFZVVBHM-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550881907 1102653159 /nfs/dbraw/zinc/65/31/59/1102653159.db2.gz FVONANQCVCXADB-BHDDXSALSA-N 2 0 370.581 4.330 20 0 FIADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550881909 1102653201 /nfs/dbraw/zinc/65/32/01/1102653201.db2.gz FVONANQCVCXADB-YPAWHYETSA-N 2 0 370.581 4.330 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)C1 ZINC000550885010 1102657119 /nfs/dbraw/zinc/65/71/19/1102657119.db2.gz AYYAALWJYQFOAH-UVKLAMSESA-N 3 0 357.586 4.140 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)ccn1 ZINC000550886297 1102658425 /nfs/dbraw/zinc/65/84/25/1102658425.db2.gz GUSWWWNTEQTLHE-QZTJIDSGSA-N 2 0 353.510 4.173 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)ccn1 ZINC000550889755 1102661740 /nfs/dbraw/zinc/66/17/40/1102661740.db2.gz CZSLAWDJDWZNAK-OTWHNJEPSA-N 2 0 367.537 4.419 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168253020 1102661765 /nfs/dbraw/zinc/66/17/65/1102661765.db2.gz VFBOTMRJDWCHLC-FKBYEOEOSA-N 2 0 368.496 4.074 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](O)CCc2ccccc2)CC1 ZINC000550907644 1102666479 /nfs/dbraw/zinc/66/64/79/1102666479.db2.gz UPQGOPQUIIMXDB-VHYCJAOWSA-N 2 0 366.549 4.013 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)CC1 ZINC000550920880 1102693096 /nfs/dbraw/zinc/69/30/96/1102693096.db2.gz KNXFAHPULJPWOS-JTPDYBDNSA-N 2 0 368.565 4.367 20 0 FIADRP COCCC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC(F)(F)CC1 ZINC001167977813 1102733180 /nfs/dbraw/zinc/73/31/80/1102733180.db2.gz FPVMHZNMHGXUNE-YQQQUEKLSA-N 2 0 370.528 4.214 20 0 FIADRP COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000123003656 1102736451 /nfs/dbraw/zinc/73/64/51/1102736451.db2.gz OKNUHOLQSWLCAS-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388266717 1102759712 /nfs/dbraw/zinc/75/97/12/1102759712.db2.gz CKHASMDEQKVABT-QFIPXVFZSA-N 2 0 352.522 4.477 20 0 FIADRP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](CC2=Cc4ccccc4OC2)CC3)cc1 ZINC000537659576 1102762098 /nfs/dbraw/zinc/76/20/98/1102762098.db2.gz LXJLEAVFTDKAHF-UHFFFAOYSA-N 2 0 374.528 4.451 20 0 FIADRP CC[N@@H+](Cc1ccc(-n2cccn2)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660326 1102783319 /nfs/dbraw/zinc/78/33/19/1102783319.db2.gz CNCSFDFPLCPDBX-QHCPKHFHSA-N 2 0 374.532 4.216 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550263009 1102884178 /nfs/dbraw/zinc/88/41/78/1102884178.db2.gz RWOLGQCLFKZALV-UHFFFAOYSA-N 2 0 360.933 4.190 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550266959 1102887871 /nfs/dbraw/zinc/88/78/71/1102887871.db2.gz HNHYBBPOUOYLQI-UHFFFAOYSA-N 2 0 354.542 4.351 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1OCC ZINC000459361125 1102916710 /nfs/dbraw/zinc/91/67/10/1102916710.db2.gz FRMBZGVRMAAGEP-KRWDZBQOSA-N 2 0 369.509 4.199 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2OCC(F)(F)F)CC1 ZINC000506863765 1102924066 /nfs/dbraw/zinc/92/40/66/1102924066.db2.gz XRZLCRUICNONKQ-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc(C3CC3)nc2)cc1 ZINC000459366258 1102931244 /nfs/dbraw/zinc/93/12/44/1102931244.db2.gz BMYLXJRPHJHOGU-QGZVFWFLSA-N 2 0 350.510 4.018 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2C)CC1 ZINC000506949185 1102977628 /nfs/dbraw/zinc/97/76/28/1102977628.db2.gz ZZALSDGLHGWURC-UHFFFAOYSA-N 2 0 354.542 4.125 20 0 FIADRP CC1(C)Cc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)ccc2O1 ZINC000729678805 1103035497 /nfs/dbraw/zinc/03/54/97/1103035497.db2.gz PSWZBVUOIJGDTE-UHFFFAOYSA-N 2 0 350.506 4.286 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000507217497 1103222706 /nfs/dbraw/zinc/22/27/06/1103222706.db2.gz WZIXSMOBJQVZFM-UHFFFAOYSA-N 2 0 359.539 4.380 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507444806 1103392392 /nfs/dbraw/zinc/39/23/92/1103392392.db2.gz PHMQUHXJROJJMC-INIZCTEOSA-N 2 0 357.567 4.425 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1Cl ZINC000551580456 1103405143 /nfs/dbraw/zinc/40/51/43/1103405143.db2.gz KLZUYCIMACXQRU-UHFFFAOYSA-N 2 0 374.912 4.111 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCCOC1 ZINC000507469527 1103416045 /nfs/dbraw/zinc/41/60/45/1103416045.db2.gz KNYJZZJHIBIXIK-PGRDOPGGSA-N 2 0 352.522 4.320 20 0 FIADRP COc1ccc(C2([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)CC2)cc1 ZINC000507519401 1103443742 /nfs/dbraw/zinc/44/37/42/1103443742.db2.gz IEXYWXKDJFBEKV-WWPVKYPJSA-N 2 0 362.517 4.185 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000507513182 1103453371 /nfs/dbraw/zinc/45/33/71/1103453371.db2.gz RCLUOHYTHWPIOJ-IBGZPJMESA-N 2 0 367.537 4.012 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1Cl ZINC000551778468 1103624075 /nfs/dbraw/zinc/62/40/75/1103624075.db2.gz ITGDRIZJWDDVMX-DLBZAZTESA-N 2 0 368.949 4.279 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000519816566 1103880702 /nfs/dbraw/zinc/88/07/02/1103880702.db2.gz OSNZGBJQDLKMQI-CTNGQTDRSA-N 2 0 351.538 4.168 20 0 FIADRP C[C@@H](Cc1cccs1)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538295262 1104112957 /nfs/dbraw/zinc/11/29/57/1104112957.db2.gz BILCWCWOROWOPR-QFBILLFUSA-N 2 0 356.535 4.257 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCC(=O)N(C)c2ccccc2)CC1 ZINC000441180995 1104187954 /nfs/dbraw/zinc/18/79/54/1104187954.db2.gz WZOGKIQAEDDMGP-HXUWFJFHSA-N 2 0 371.569 4.016 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCCSc1ccccc1Cl ZINC000441201926 1104195412 /nfs/dbraw/zinc/19/54/12/1104195412.db2.gz FRZMIDHCFUCRDJ-NXHRZFHOSA-N 2 0 368.974 4.006 20 0 FIADRP COC(=O)c1oc([C@H](C)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1C ZINC000441319382 1104274915 /nfs/dbraw/zinc/27/49/15/1104274915.db2.gz UUMNAZTZAJNGGW-ROUUACIJSA-N 2 0 362.514 4.024 20 0 FIADRP c1cc(S[C@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)ccn1 ZINC001167995521 1104517355 /nfs/dbraw/zinc/51/73/55/1104517355.db2.gz IQCXEKRJFJFUQM-VHRCFOOQSA-N 2 0 357.567 4.044 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2Cn2ccnc2)CC1 ZINC000520459683 1104760529 /nfs/dbraw/zinc/76/05/29/1104760529.db2.gz CGVCGCATMWWJIF-XXBNENTESA-N 2 0 366.553 4.064 20 0 FIADRP Brc1ccc([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)s1 ZINC000190582868 1104934192 /nfs/dbraw/zinc/93/41/92/1104934192.db2.gz XLJZIAMMGFUNAK-BZNIZROVSA-N 2 0 355.345 4.036 20 0 FIADRP COC(=O)c1cccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001168002183 1104971311 /nfs/dbraw/zinc/97/13/11/1104971311.db2.gz PQAJXIHYALOVSH-PJEZACDQSA-N 2 0 368.521 4.016 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2-c2ccnn2C)C1 ZINC000507834403 1105241102 /nfs/dbraw/zinc/24/11/02/1105241102.db2.gz UPTNRNGDGHWFCB-WOJBJXKFSA-N 2 0 366.553 4.174 20 0 FIADRP CC(C)OC1CC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000428084455 1105360158 /nfs/dbraw/zinc/36/01/58/1105360158.db2.gz NXYVHOXLGUFFAI-UHFFFAOYSA-N 2 0 350.934 4.098 20 0 FIADRP COCCC[C@H](Cc1ccccc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000475353678 1106749097 /nfs/dbraw/zinc/74/90/97/1106749097.db2.gz XHPFXPVALKPSBJ-JOCHJYFZSA-N 2 0 358.570 4.411 20 0 FIADRP CCO[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C12CCC2 ZINC000390719036 1106753092 /nfs/dbraw/zinc/75/30/92/1106753092.db2.gz YVPPHYQGSVHOBB-RFQIGKHKSA-N 2 0 354.538 4.119 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c2ccccc21 ZINC000643455505 1106980182 /nfs/dbraw/zinc/98/01/82/1106980182.db2.gz NOFUJUCUKALBKN-KYNGSXCRSA-N 2 0 361.411 4.019 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CSCCc4ccccc43)C2)cc1 ZINC000530364372 1106985421 /nfs/dbraw/zinc/98/54/21/1106985421.db2.gz IQRMUUYLMKXDGV-KNQAVFIVSA-N 2 0 352.547 4.129 20 0 FIADRP Clc1ccc(N2CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c(Cl)c1 ZINC000530440647 1107043675 /nfs/dbraw/zinc/04/36/75/1107043675.db2.gz CWGODASZHZPYPI-KRWDZBQOSA-N 2 0 368.352 4.036 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000530714521 1107262359 /nfs/dbraw/zinc/26/23/59/1107262359.db2.gz HOLBCCPUVQANLJ-TZIWHRDSSA-N 2 0 368.525 4.259 20 0 FIADRP C[NH+](C)Cc1cccc(C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000531052250 1107488312 /nfs/dbraw/zinc/48/83/12/1107488312.db2.gz PGOCTHNRSSBYHW-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP CCCCOC(=O)[C@H]1CC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168067981 1107522531 /nfs/dbraw/zinc/52/25/31/1107522531.db2.gz VZBLKZLPMWBVPP-MXNKGDRCSA-N 2 0 372.553 4.093 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@H]3CC[C@H](c4cccc(F)c4)C3)sc2C1 ZINC000475555703 1107724769 /nfs/dbraw/zinc/72/47/69/1107724769.db2.gz NCYYTPABGNJFPX-WMZOPIPTSA-N 2 0 373.541 4.475 20 0 FIADRP [NH2+]=C(NCC1CC[NH+](Cc2ccccc2Cl)CC1)Nc1ccccc1 ZINC000303983284 1107803609 /nfs/dbraw/zinc/80/36/09/1107803609.db2.gz GZXZRPVGDSNAIA-UHFFFAOYSA-N 2 0 356.901 4.188 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3Cl)cc1 ZINC000531705606 1108083647 /nfs/dbraw/zinc/08/36/47/1108083647.db2.gz XCVGXNQFIXVWPM-NRFANRHFSA-N 2 0 358.913 4.448 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CCOCC1 ZINC000531724325 1108115928 /nfs/dbraw/zinc/11/59/28/1108115928.db2.gz XZZYDZIFRCMVKE-QFIPXVFZSA-N 2 0 356.510 4.206 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000453064687 1108117622 /nfs/dbraw/zinc/11/76/22/1108117622.db2.gz GGCSGJBVHOIGCJ-HXUWFJFHSA-N 2 0 351.538 4.295 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccsc1 ZINC000453070939 1108122268 /nfs/dbraw/zinc/12/22/68/1108122268.db2.gz WANRJKMMESTHHP-OAQYLSRUSA-N 2 0 357.567 4.127 20 0 FIADRP C[C@@H](CCCc1cccnc1)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000453083260 1108154353 /nfs/dbraw/zinc/15/43/53/1108154353.db2.gz HXYLCOWNSXTNRO-SFHVURJKSA-N 2 0 357.567 4.356 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c2nccn21 ZINC000453105699 1108174535 /nfs/dbraw/zinc/17/45/35/1108174535.db2.gz FWKNQNOPFCLPQF-UGKGYDQZSA-N 2 0 366.553 4.213 20 0 FIADRP CCn1ccnc1[C@H](C)[NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1 ZINC000453184229 1108253161 /nfs/dbraw/zinc/25/31/61/1108253161.db2.gz UDBJBWPZZOWNLN-IBGZPJMESA-N 2 0 354.542 4.246 20 0 FIADRP CCC1(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000453186682 1108256180 /nfs/dbraw/zinc/25/61/80/1108256180.db2.gz WZMBFWNAUUPWLN-UYAOXDASSA-N 2 0 352.526 4.171 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]CC3(O)CC[NH+](C(C)C)CC3)s2)cc1 ZINC000531863691 1108288467 /nfs/dbraw/zinc/28/84/67/1108288467.db2.gz CZUMSKMVUOECNW-UHFFFAOYSA-N 2 0 358.551 4.048 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000453217723 1108290415 /nfs/dbraw/zinc/29/04/15/1108290415.db2.gz IEBSTVLHNZQAPT-OAQYLSRUSA-N 2 0 373.928 4.306 20 0 FIADRP CC[C@@H](COCC(F)(F)F)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000453249751 1108324849 /nfs/dbraw/zinc/32/48/49/1108324849.db2.gz DDADPVVIIXNTAG-VIQWUECVSA-N 2 0 372.475 4.377 20 0 FIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000531965177 1108461629 /nfs/dbraw/zinc/46/16/29/1108461629.db2.gz RAGWMWMROQNHQQ-YADHBBJMSA-N 2 0 371.956 4.369 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531973153 1108484630 /nfs/dbraw/zinc/48/46/30/1108484630.db2.gz WYEDFUKCTBSEMP-IBGZPJMESA-N 2 0 354.542 4.488 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000453397212 1108528469 /nfs/dbraw/zinc/52/84/69/1108528469.db2.gz VUHUKLPXYXDPIV-ILZDJORESA-N 2 0 374.550 4.259 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H](c1ccc(Br)s1)C1CC1)C1CC1 ZINC000453420454 1108544650 /nfs/dbraw/zinc/54/46/50/1108544650.db2.gz ZOHMIRVJPJLFSN-MRXNPFEDSA-N 2 0 357.361 4.426 20 0 FIADRP c1nc(C[N@H+]2CCCCC[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)co1 ZINC000453593222 1108649670 /nfs/dbraw/zinc/64/96/70/1108649670.db2.gz BNPGVGRMVLELMR-JOCHJYFZSA-N 2 0 353.510 4.331 20 0 FIADRP C[N@H+](CCCC[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1)C1CC1 ZINC000453600249 1108651780 /nfs/dbraw/zinc/65/17/80/1108651780.db2.gz SBNRNKAJGPBJEB-UHFFFAOYSA-N 2 0 355.309 4.233 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCc4c3cccc4Cl)c2)CCO1 ZINC000532207229 1108695060 /nfs/dbraw/zinc/69/50/60/1108695060.db2.gz UZUWLWGAYDECAZ-OPAMFIHVSA-N 2 0 370.924 4.338 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532234423 1108729591 /nfs/dbraw/zinc/72/95/91/1108729591.db2.gz FXTRGQYMSJRDIZ-LSTHTHJFSA-N 2 0 357.542 4.123 20 0 FIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000524968680 1109223709 /nfs/dbraw/zinc/22/37/09/1109223709.db2.gz PUAUIWUPDXMWSO-IRXDYDNUSA-N 2 0 374.500 4.373 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822906 1109350169 /nfs/dbraw/zinc/35/01/69/1109350169.db2.gz ZEBWIQCHAMIYHQ-NZQKXSOJSA-N 2 0 357.586 4.090 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1 ZINC000447030551 1109416173 /nfs/dbraw/zinc/41/61/73/1109416173.db2.gz VPCQDJCPUCMPQC-SFHVURJKSA-N 2 0 351.332 4.364 20 0 FIADRP FC(F)(F)c1cccc(C2([NH2+]CCC[NH+]3CCCCC3)CCOCC2)c1 ZINC000447432024 1109538600 /nfs/dbraw/zinc/53/86/00/1109538600.db2.gz RJGBEWCCHLZUOK-UHFFFAOYSA-N 2 0 370.459 4.177 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)o1 ZINC000447560012 1109581637 /nfs/dbraw/zinc/58/16/37/1109581637.db2.gz BSYMKQADEDAUGK-HOTGVXAUSA-N 2 0 359.489 4.199 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000447565585 1109584085 /nfs/dbraw/zinc/58/40/85/1109584085.db2.gz MGYUOHNKGOATKF-SCLBCKFNSA-N 2 0 363.343 4.461 20 0 FIADRP CCO[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000447577580 1109593734 /nfs/dbraw/zinc/59/37/34/1109593734.db2.gz IIYLVXGPLIGTLE-WWPVKYPJSA-N 2 0 352.522 4.264 20 0 FIADRP Fc1ccc(Br)c2c1CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447580739 1109595018 /nfs/dbraw/zinc/59/50/18/1109595018.db2.gz RFIOQIMQTMUSIP-QGZVFWFLSA-N 2 0 367.306 4.040 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)c3ccc(C[NH+](C)C)cc3)cc2)CC1 ZINC000508606377 1109609464 /nfs/dbraw/zinc/60/94/64/1109609464.db2.gz ZELXRXGKUNMXHQ-UHFFFAOYSA-N 2 0 365.521 4.232 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccnn3-c3ccccc3)c2)CC1 ZINC000447933058 1109682130 /nfs/dbraw/zinc/68/21/30/1109682130.db2.gz UYGGNDJEHQEBRA-UHFFFAOYSA-N 2 0 374.532 4.394 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@H](c4ccnn4C)C3)CC2)CC1 ZINC000448027298 1109697766 /nfs/dbraw/zinc/69/77/66/1109697766.db2.gz MKLNHNHDDYDNSN-JJBAYQRUSA-N 2 0 358.574 4.079 20 0 FIADRP C[C@@H]([NH2+]CCCOc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544422445 1109792024 /nfs/dbraw/zinc/79/20/24/1109792024.db2.gz XXIIEMIBPMVVNK-SJORKVTESA-N 2 0 350.934 4.352 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)cc1 ZINC000527845314 1109832798 /nfs/dbraw/zinc/83/27/98/1109832798.db2.gz DLJVJSJMKHYHJV-HXUWFJFHSA-N 2 0 362.876 4.197 20 0 FIADRP C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000527969788 1109877617 /nfs/dbraw/zinc/87/76/17/1109877617.db2.gz RMEWOXMBZXMFOW-VGOFRKELSA-N 2 0 353.510 4.214 20 0 FIADRP C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000527969791 1109878338 /nfs/dbraw/zinc/87/83/38/1109878338.db2.gz RMEWOXMBZXMFOW-VGSWGCGISA-N 2 0 353.510 4.214 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000449031578 1109960701 /nfs/dbraw/zinc/96/07/01/1109960701.db2.gz WQMOMRYGVHQHKU-UHFFFAOYSA-N 2 0 352.522 4.205 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000449051029 1109968503 /nfs/dbraw/zinc/96/85/03/1109968503.db2.gz WLVIAJMRSKFMEG-QRWLVFNGSA-N 2 0 371.525 4.398 20 0 FIADRP c1cc(C[NH+]2CCCC2)ccc1C[NH2+]Cc1ccc2c(c1)OCCCCO2 ZINC000449066862 1109971370 /nfs/dbraw/zinc/97/13/70/1109971370.db2.gz GJEUWRZGJGUFFZ-UHFFFAOYSA-N 2 0 366.505 4.124 20 0 FIADRP C[C@H](CC(C)(C)C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000449119067 1109979699 /nfs/dbraw/zinc/97/96/99/1109979699.db2.gz WBVCLQLISODLPX-GOSISDBHSA-N 2 0 362.558 4.091 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]C3CCC(OC4CCCC4)CC3)C2)cc1 ZINC000449123547 1109980634 /nfs/dbraw/zinc/98/06/34/1109980634.db2.gz NODYKDZIUJKRSN-YNEXMFEJSA-N 2 0 370.581 4.411 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H](NCc2cc3ccccc3cc2OC)[C@@H](C)C1 ZINC000449139404 1109984043 /nfs/dbraw/zinc/98/40/43/1109984043.db2.gz KYPIRVMERINKIL-AVRDEDQJSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)[C@H](C)O1 ZINC000449153944 1109986579 /nfs/dbraw/zinc/98/65/79/1109986579.db2.gz GNMOJBLVZCLFOX-MHEOJOEOSA-N 2 0 370.459 4.244 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000449168104 1109987524 /nfs/dbraw/zinc/98/75/24/1109987524.db2.gz LXONAMWYOBFRJV-UHFFFAOYSA-N 2 0 365.493 4.300 20 0 FIADRP CO[C@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000449168250 1109990905 /nfs/dbraw/zinc/99/09/05/1109990905.db2.gz ARGDFKAZQUPJSQ-FDDCHVKYSA-N 2 0 370.512 4.198 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449180217 1109992845 /nfs/dbraw/zinc/99/28/45/1109992845.db2.gz YWYCNBRAVGCLHS-RRQZXNHTSA-N 2 0 370.647 4.335 20 0 FIADRP COCCC1(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCCC1 ZINC000449182326 1109993599 /nfs/dbraw/zinc/99/35/99/1109993599.db2.gz JRPLWISDUPHXMK-HXUWFJFHSA-N 2 0 358.570 4.269 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449186258 1109994617 /nfs/dbraw/zinc/99/46/17/1109994617.db2.gz JCUWQISXVOUBRM-IAGOWNOFSA-N 2 0 355.526 4.080 20 0 FIADRP CCCCn1cc(CNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)c(C)n1 ZINC000449210622 1109996465 /nfs/dbraw/zinc/99/64/65/1109996465.db2.gz WOCQLSXKZWQNOB-IBGZPJMESA-N 2 0 368.569 4.177 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC(NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000449219038 1109999930 /nfs/dbraw/zinc/99/99/30/1109999930.db2.gz MCTFMFSQFBUYTE-GHTZIAJQSA-N 2 0 371.594 4.036 20 0 FIADRP Cc1cc(N2CCC([NH2+]Cc3cc(Cl)sc3Cl)CC2)nc(C)n1 ZINC000449227796 1110003397 /nfs/dbraw/zinc/00/33/97/1110003397.db2.gz WLQFKPVBJORLRZ-UHFFFAOYSA-N 2 0 371.337 4.220 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449250065 1110005181 /nfs/dbraw/zinc/00/51/81/1110005181.db2.gz KVMWLUBCKQDSOM-WWPVKYPJSA-N 2 0 358.570 4.265 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000449312281 1110030164 /nfs/dbraw/zinc/03/01/64/1110030164.db2.gz MCCJOYBEOMXYSN-XUVXKRRUSA-N 2 0 358.570 4.265 20 0 FIADRP CSC1(C[NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH+](C)CC1 ZINC000449339735 1110042348 /nfs/dbraw/zinc/04/23/48/1110042348.db2.gz UZISPJASNCXWPP-WMZOPIPTSA-N 2 0 352.975 4.393 20 0 FIADRP Cc1n[nH]c(C)c1C[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449412494 1110062615 /nfs/dbraw/zinc/06/26/15/1110062615.db2.gz FSTLJDUOJXAUGU-JOCHJYFZSA-N 2 0 366.553 4.149 20 0 FIADRP C[NH+](C)CCCC(C)(C)[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000449528378 1110100102 /nfs/dbraw/zinc/10/01/02/1110100102.db2.gz OZGYWDUEKSGZML-UHFFFAOYSA-N 2 0 357.325 4.479 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@H]2CCO[C@H](C)C2)CC3)cc1 ZINC001168112369 1110155952 /nfs/dbraw/zinc/15/59/52/1110155952.db2.gz DJURAVQYYRKIOA-IRLDBZIGSA-N 2 0 356.554 4.241 20 0 FIADRP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@H]4CCO[C@@H](C)C4)CC3)C2)cc1 ZINC001168114904 1110238952 /nfs/dbraw/zinc/23/89/52/1110238952.db2.gz FLAZJRONNWRNIU-UNMCSNQZSA-N 2 0 356.554 4.241 20 0 FIADRP CC[N@H+](CCC1CCN(Cc2nnc(C(C)C)s2)CC1)CC(C)C ZINC000450650657 1110324470 /nfs/dbraw/zinc/32/44/70/1110324470.db2.gz NMCACIHJSWLLGP-UHFFFAOYSA-N 2 0 352.592 4.242 20 0 FIADRP CN(c1ccccc1CNc1cc2c(c[nH+]1)CCCC2)C1CC[NH+](C)CC1 ZINC000461207182 1111109650 /nfs/dbraw/zinc/10/96/50/1111109650.db2.gz LRFXZWZITBXLFV-UHFFFAOYSA-N 2 0 364.537 4.103 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)C[N@@H+]1Cc1ccccc1 ZINC000538407792 1111129090 /nfs/dbraw/zinc/12/90/90/1111129090.db2.gz KUSCVWRJMRZQJO-WHCFWRGISA-N 2 0 356.554 4.080 20 0 FIADRP CC[C@@H](CCc1ccc(Br)cc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408897 1111129686 /nfs/dbraw/zinc/12/96/86/1111129686.db2.gz XBDXSLSXAYSVTI-SFHVURJKSA-N 2 0 351.332 4.012 20 0 FIADRP Cc1cccn2c(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)cnc12 ZINC000538725474 1111275888 /nfs/dbraw/zinc/27/58/88/1111275888.db2.gz XVURCERHMOYHIN-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cnc(C(C)(C)C)s2)CC1 ZINC000538751138 1111281596 /nfs/dbraw/zinc/28/15/96/1111281596.db2.gz RNKSZLWTGQPCTL-UHFFFAOYSA-N 2 0 367.603 4.011 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]C2CC[NH+](C(C)(C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000539041604 1111395008 /nfs/dbraw/zinc/39/50/08/1111395008.db2.gz LQUNITVZDOPVOM-FPOVZHCZSA-N 3 0 357.586 4.140 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000539063652 1111408923 /nfs/dbraw/zinc/40/89/23/1111408923.db2.gz PQRSJOFMZFBLGB-XUVXKRRUSA-N 2 0 370.562 4.246 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]CC(C)(C)N1CCC(OC)CC1)C1CCCC1 ZINC000539202167 1111470264 /nfs/dbraw/zinc/47/02/64/1111470264.db2.gz HNYDDSVPMKPLPT-QFIPXVFZSA-N 2 0 374.569 4.406 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C[C@@H](C)O1 ZINC000539260747 1111497913 /nfs/dbraw/zinc/49/79/13/1111497913.db2.gz HGIFUDCIVZITRY-GPMSIDNRSA-N 2 0 366.933 4.033 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC2(c3ccc(OC)c(OC)c3)CCCCC2)CC1 ZINC000462114351 1111502051 /nfs/dbraw/zinc/50/20/51/1111502051.db2.gz BJPHQIYAIHBZBZ-UHFFFAOYSA-N 2 0 374.569 4.370 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000552040618 1111554055 /nfs/dbraw/zinc/55/40/55/1111554055.db2.gz BBIUVJIUDBVDEA-UHFFFAOYSA-N 3 0 365.565 4.281 20 0 FIADRP Cc1nc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)nc2ccccc12 ZINC000552044734 1111555482 /nfs/dbraw/zinc/55/54/82/1111555482.db2.gz LJJVJFHCESVLRT-UHFFFAOYSA-N 2 0 374.532 4.471 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)c(C)c1OC ZINC000552048310 1111557600 /nfs/dbraw/zinc/55/76/00/1111557600.db2.gz OHYOVEYQXXKSNZ-KRWDZBQOSA-N 2 0 374.569 4.187 20 0 FIADRP COc1ccccc1OCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552227530 1111625522 /nfs/dbraw/zinc/62/55/22/1111625522.db2.gz DYPNOPGNJXDBRK-UHFFFAOYSA-N 2 0 368.521 4.107 20 0 FIADRP Cc1ccccc1[C@@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552249730 1111628661 /nfs/dbraw/zinc/62/86/61/1111628661.db2.gz IPQPXEWDYHXIDO-YDPRHXJPSA-N 2 0 352.522 4.061 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000552245353 1111636012 /nfs/dbraw/zinc/63/60/12/1111636012.db2.gz XNAPZBPQZZKDMS-UHFFFAOYSA-N 3 0 357.586 4.141 20 0 FIADRP COc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1F ZINC000552273557 1111655274 /nfs/dbraw/zinc/65/52/74/1111655274.db2.gz MBKXJYAKXAKPJL-UHFFFAOYSA-N 2 0 368.496 4.322 20 0 FIADRP Cc1ccc([C@@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479268208 1111982740 /nfs/dbraw/zinc/98/27/40/1111982740.db2.gz CFMGTHPPDDNCTN-OFNKIYASSA-N 2 0 357.586 4.090 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000479295993 1111988077 /nfs/dbraw/zinc/98/80/77/1111988077.db2.gz NFTMMFTZTWBBMS-NXVRBGIVSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479332033 1111994346 /nfs/dbraw/zinc/99/43/46/1111994346.db2.gz SFMRNBJMCPLHRW-KNQAVFIVSA-N 2 0 366.553 4.494 20 0 FIADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cc(Br)ccc21 ZINC000479367205 1112001851 /nfs/dbraw/zinc/00/18/51/1112001851.db2.gz WEEBUOHCQHLBOQ-SCLBCKFNSA-N 2 0 363.343 4.245 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000479465602 1112034486 /nfs/dbraw/zinc/03/44/86/1112034486.db2.gz KYAJUDQNPHRNPM-ZHRRBRCNSA-N 2 0 356.485 4.494 20 0 FIADRP FC(F)(F)C1CCN(C2CC([NH2+]C3C4CC5CC(C4)CC3C5)C2)CC1 ZINC000479491541 1112044869 /nfs/dbraw/zinc/04/48/69/1112044869.db2.gz SJKOTRSJOLXSOE-UHFFFAOYSA-N 2 0 356.476 4.206 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)cn1 ZINC000480162459 1112309049 /nfs/dbraw/zinc/30/90/49/1112309049.db2.gz BRJDGEWZYXAQGN-BBWFWOEESA-N 2 0 373.928 4.195 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000480207738 1112333034 /nfs/dbraw/zinc/33/30/34/1112333034.db2.gz GHWKXFBXVBARLI-INIZCTEOSA-N 2 0 359.901 4.060 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2nccn2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000480306437 1112379461 /nfs/dbraw/zinc/37/94/61/1112379461.db2.gz HYIYWLDHEZHDID-IFMALSPDSA-N 2 0 374.532 4.263 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000480384769 1112412678 /nfs/dbraw/zinc/41/26/78/1112412678.db2.gz NXLBHWTXJUFIHZ-UHFFFAOYSA-N 2 0 365.768 4.376 20 0 FIADRP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000667671071 1112423741 /nfs/dbraw/zinc/42/37/41/1112423741.db2.gz GSBIPVRXJVCUIN-LJQANCHMSA-N 2 0 355.551 4.426 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000480610234 1112500366 /nfs/dbraw/zinc/50/03/66/1112500366.db2.gz NBFNZZLQBIIIBR-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000480604877 1112504934 /nfs/dbraw/zinc/50/49/34/1112504934.db2.gz GCOFDOOYFDFTKW-HOTGVXAUSA-N 2 0 352.494 4.148 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cnn1-c1ccc(F)cc1 ZINC000480643853 1112518696 /nfs/dbraw/zinc/51/86/96/1112518696.db2.gz SYHKYGRDOOUQCB-QZTJIDSGSA-N 2 0 372.532 4.483 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480632360 1112522180 /nfs/dbraw/zinc/52/21/80/1112522180.db2.gz UTQTWODZQIBRAR-DNVCBOLYSA-N 2 0 372.384 4.450 20 0 FIADRP CC(C)C[C@H](CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@@H](C)c1ccccc1 ZINC000667727645 1112551987 /nfs/dbraw/zinc/55/19/87/1112551987.db2.gz DXDHLQFHJLUWTJ-LAUBAEHRSA-N 2 0 368.525 4.032 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)c(C)n1 ZINC000480715662 1112566709 /nfs/dbraw/zinc/56/67/09/1112566709.db2.gz PLXQDTWZVIRWMB-KURKYZTESA-N 2 0 366.553 4.422 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC000481241243 1112823565 /nfs/dbraw/zinc/82/35/65/1112823565.db2.gz JZRKZDHLFZPZDN-DNVCBOLYSA-N 2 0 373.368 4.263 20 0 FIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CCCO2 ZINC000481318448 1112888885 /nfs/dbraw/zinc/88/88/85/1112888885.db2.gz VPTCBCINHKPEIW-QFIPXVFZSA-N 2 0 368.521 4.247 20 0 FIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000481344307 1112909237 /nfs/dbraw/zinc/90/92/37/1112909237.db2.gz WNTGEQMXZMQUGM-TZIWHRDSSA-N 2 0 360.517 4.325 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000065931974 1112987615 /nfs/dbraw/zinc/98/76/15/1112987615.db2.gz SBCFFXULRJIEEU-IYBDPMFKSA-N 2 0 358.448 4.085 20 0 FIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000481651076 1113012299 /nfs/dbraw/zinc/01/22/99/1113012299.db2.gz CUUKVQZVYMEAGN-YESZJQIVSA-N 2 0 372.475 4.115 20 0 FIADRP FC(F)(F)Oc1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000899874704 1113037827 /nfs/dbraw/zinc/03/78/27/1113037827.db2.gz JFZQEDPRACKMBC-OLZOCXBDSA-N 2 0 351.372 4.172 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCCO2 ZINC000481740258 1113063817 /nfs/dbraw/zinc/06/38/17/1113063817.db2.gz SQXHSBHIBYEWPB-OAQYLSRUSA-N 2 0 368.521 4.247 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000481814643 1113092597 /nfs/dbraw/zinc/09/25/97/1113092597.db2.gz JPQAZXBKDBBJLL-UHFFFAOYSA-N 2 0 370.859 4.346 20 0 FIADRP C[NH+](C)[C@@H]1CCc2cc(NC(=O)NCCCCC[NH+]3CCCCC3)ccc21 ZINC000455928015 1113098113 /nfs/dbraw/zinc/09/81/13/1113098113.db2.gz NSSPVJDLUBWBAS-OAQYLSRUSA-N 2 0 372.557 4.013 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCC[NH+](C)C)CCC3)cc1 ZINC000481975480 1113144046 /nfs/dbraw/zinc/14/40/46/1113144046.db2.gz SITFWAZKSIKOJW-KRWDZBQOSA-N 2 0 359.539 4.128 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Br)cc1 ZINC001168366383 1113148521 /nfs/dbraw/zinc/14/85/21/1113148521.db2.gz REZUETBRCUSKNE-SFHVURJKSA-N 2 0 351.332 4.364 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000482117622 1113174506 /nfs/dbraw/zinc/17/45/06/1113174506.db2.gz AIJLJPXTNFNWGG-DENIHFKCSA-N 2 0 364.533 4.227 20 0 FIADRP Cc1ccc2c(CC[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)c[nH]c2c1 ZINC000482136373 1113179348 /nfs/dbraw/zinc/17/93/48/1113179348.db2.gz PJCSYKWYIOKYOT-SFHVURJKSA-N 2 0 365.521 4.310 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC000482137651 1113179650 /nfs/dbraw/zinc/17/96/50/1113179650.db2.gz MZJZHNIEVFQSDI-GBXCKJPGSA-N 2 0 368.565 4.499 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)[C@H](C)C1 ZINC000482236558 1113206256 /nfs/dbraw/zinc/20/62/56/1113206256.db2.gz AGVCTHUZYULKNS-YLJYHZDGSA-N 2 0 364.961 4.098 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)[C@@H](C)C1 ZINC000482334313 1113228095 /nfs/dbraw/zinc/22/80/95/1113228095.db2.gz NSAZRZFUJIJXDC-HTAPYJJXSA-N 2 0 371.569 4.320 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000482344091 1113230373 /nfs/dbraw/zinc/23/03/73/1113230373.db2.gz NGWBGLCYKRHBIK-DYVFJYSZSA-N 2 0 351.332 4.319 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(-c2cccs2)cc1 ZINC000482361521 1113232909 /nfs/dbraw/zinc/23/29/09/1113232909.db2.gz UTZVNPDCPVMBNC-GOSISDBHSA-N 2 0 371.594 4.339 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)CC1 ZINC000482503307 1113279595 /nfs/dbraw/zinc/27/95/95/1113279595.db2.gz DHAKLIXABDJLHM-RBUKOAKNSA-N 2 0 371.594 4.339 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000482647781 1113319749 /nfs/dbraw/zinc/31/97/49/1113319749.db2.gz CCFJZHCPTDDYRX-KRWDZBQOSA-N 2 0 360.542 4.022 20 0 FIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(Oc4ccc(F)cc4)nc3)C2)CC1 ZINC000668169271 1113404971 /nfs/dbraw/zinc/40/49/71/1113404971.db2.gz MDVPRPNXSDZOLB-IBGZPJMESA-N 2 0 369.484 4.177 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)c(F)c(C)c2)[C@H](C)C1 ZINC000483151708 1113455854 /nfs/dbraw/zinc/45/58/54/1113455854.db2.gz HHCVUOXTHHWUBR-GGPKGHCWSA-N 2 0 350.522 4.230 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483183248 1113459071 /nfs/dbraw/zinc/45/90/71/1113459071.db2.gz JFHQAMIMBAFLJD-APWZRJJASA-N 2 0 362.562 4.234 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483183251 1113459097 /nfs/dbraw/zinc/45/90/97/1113459097.db2.gz JFHQAMIMBAFLJD-LPHOPBHVSA-N 2 0 362.562 4.234 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000483219528 1113466999 /nfs/dbraw/zinc/46/69/99/1113466999.db2.gz UGCOASIGJKXVSF-OXJNMPFZSA-N 2 0 370.562 4.369 20 0 FIADRP CN(CCC1CC[NH+](C2CCN(C)CC2)CC1)Cc1ccsc1Cl ZINC000483271476 1113477423 /nfs/dbraw/zinc/47/74/23/1113477423.db2.gz YFTIXVBFNHGCBM-UHFFFAOYSA-N 2 0 370.006 4.030 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)CC1 ZINC000486404286 1113560312 /nfs/dbraw/zinc/56/03/12/1113560312.db2.gz YLGWZTLKVIWUEB-VLSUOOLDSA-N 2 0 356.554 4.397 20 0 FIADRP C[NH+](C)CC1CCC([NH2+][C@H]2CCc3cccc(Br)c3C2)CC1 ZINC000559282409 1113590800 /nfs/dbraw/zinc/59/08/00/1113590800.db2.gz REWMUSQHMCGDKW-PREGVCBESA-N 2 0 365.359 4.016 20 0 FIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 ZINC000488045257 1113845841 /nfs/dbraw/zinc/84/58/41/1113845841.db2.gz ILBQSSFGQOFPKJ-VSKRKVRLSA-N 2 0 354.538 4.110 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cc4ccc(F)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000488349224 1113913292 /nfs/dbraw/zinc/91/32/92/1113913292.db2.gz BXHRHWCMKXUNHX-CALCHBBNSA-N 2 0 373.516 4.018 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)CC1 ZINC000488388117 1113919726 /nfs/dbraw/zinc/91/97/26/1113919726.db2.gz FPOQYWTWQZTOIP-IBGZPJMESA-N 2 0 373.585 4.499 20 0 FIADRP C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000488524936 1113946327 /nfs/dbraw/zinc/94/63/27/1113946327.db2.gz CZEGEYHODRUMIO-UHFFFAOYSA-N 2 0 352.457 4.050 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Br)c(F)c2)C1 ZINC000489524339 1114124364 /nfs/dbraw/zinc/12/43/64/1114124364.db2.gz VCLGGPAQBCGLGD-KGLIPLIRSA-N 2 0 357.311 4.359 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2)c1 ZINC000490118485 1114220098 /nfs/dbraw/zinc/22/00/98/1114220098.db2.gz KLIZMWDKRMKGHI-DEOSSOPVSA-N 2 0 365.565 4.008 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)[C@@H](C)C2 ZINC000491062915 1114369049 /nfs/dbraw/zinc/36/90/49/1114369049.db2.gz BRKYQESZRGAQBW-MBSDFSHPSA-N 2 0 352.522 4.349 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000570964755 1114418761 /nfs/dbraw/zinc/41/87/61/1114418761.db2.gz ARYQTRIFOHPKHX-HXOBKFHXSA-N 2 0 350.506 4.498 20 0 FIADRP Fc1ccc2c(c1)onc2C1CC[NH+](C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168378729 1114472478 /nfs/dbraw/zinc/47/24/78/1114472478.db2.gz RPCWDJVZJSJGDH-UHFFFAOYSA-N 2 0 357.473 4.021 20 0 FIADRP c1c(C[NH2+]CCC[NH+]2CCCC2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000588280841 1114568857 /nfs/dbraw/zinc/56/88/57/1114568857.db2.gz KWUIJGGHJJIZKD-UHFFFAOYSA-N 2 0 360.505 4.115 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000589836153 1114846931 /nfs/dbraw/zinc/84/69/31/1114846931.db2.gz HLERECGZZDPKQJ-OAHLLOKOSA-N 2 0 369.347 4.059 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000589837427 1114847385 /nfs/dbraw/zinc/84/73/85/1114847385.db2.gz ULLWOBQPXIEOGO-OALUTQOASA-N 2 0 354.542 4.233 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]13)C2 ZINC001168400289 1115036792 /nfs/dbraw/zinc/03/67/92/1115036792.db2.gz LOBYWYBKIJHKFM-AYVPJYCDSA-N 2 0 364.508 4.183 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000573255773 1115086840 /nfs/dbraw/zinc/08/68/40/1115086840.db2.gz JLXKALVYLNKLAM-NMNUPHIUSA-N 2 0 368.521 4.198 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000573345144 1115092520 /nfs/dbraw/zinc/09/25/20/1115092520.db2.gz VGYPNHNBKAVLQU-KRWDZBQOSA-N 2 0 365.949 4.221 20 0 FIADRP COc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)c1 ZINC000592463824 1115234671 /nfs/dbraw/zinc/23/46/71/1115234671.db2.gz HPADKAKSLDFWIH-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP CC(C)(C)OC(=O)[C@@H]1C[C@H](NC2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000593691161 1115342262 /nfs/dbraw/zinc/34/22/62/1115342262.db2.gz ORMWKFRAPRRQOF-UXHICEINSA-N 2 0 372.553 4.409 20 0 FIADRP COC(=O)CC(C)(C)C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000595016049 1115504018 /nfs/dbraw/zinc/50/40/18/1115504018.db2.gz GPDIXFTZMWZYRW-LBFURVHYSA-N 2 0 372.553 4.140 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(C(=O)OC)c(Cl)c2)cc1 ZINC000597043836 1115637558 /nfs/dbraw/zinc/63/75/58/1115637558.db2.gz OTURNOITKDRSEH-UHFFFAOYSA-N 2 0 374.912 4.258 20 0 FIADRP CC(C)(C)[N@@H+]1CCCN(c2ccnc3c(Br)cccc23)CC1 ZINC000601513492 1115643547 /nfs/dbraw/zinc/64/35/47/1115643547.db2.gz AKFZVEXZYVPTPY-UHFFFAOYSA-N 2 0 362.315 4.308 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000669703970 1115831366 /nfs/dbraw/zinc/83/13/66/1115831366.db2.gz ZUTIUHNIKAXKHO-USWKJHDZSA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605323457 1115885787 /nfs/dbraw/zinc/88/57/87/1115885787.db2.gz XIEWRRWVYYSGAU-IRLDBZIGSA-N 2 0 374.569 4.092 20 0 FIADRP Oc1ccc([C@H]2CCC[NH+]2CCC[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000607151092 1116003627 /nfs/dbraw/zinc/00/36/27/1116003627.db2.gz WRPCOOIFTQVOEI-DHIUTWEWSA-N 2 0 366.505 4.462 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](CCCc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000607151514 1116003809 /nfs/dbraw/zinc/00/38/09/1116003809.db2.gz RFXLSMKKRVYXPV-QZTJIDSGSA-N 2 0 364.961 4.094 20 0 FIADRP CC[C@](C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1nc(C)cs1 ZINC000608060380 1116079600 /nfs/dbraw/zinc/07/96/00/1116079600.db2.gz AVMGKRGDPJEYJD-NRFANRHFSA-N 2 0 373.566 4.341 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000608061244 1116079660 /nfs/dbraw/zinc/07/96/60/1116079660.db2.gz JBWNQVXVKUBLBM-SIKLNZKXSA-N 2 0 374.532 4.420 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1 ZINC000534064660 1116151442 /nfs/dbraw/zinc/15/14/42/1116151442.db2.gz YKMYDLIEXXDRED-BDTNDASRSA-N 2 0 354.538 4.110 20 0 FIADRP C[C@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)c1ccc([S@](C)=O)cc1 ZINC000534452302 1116200277 /nfs/dbraw/zinc/20/02/77/1116200277.db2.gz JKUFZCPOBWGPKI-QYBDOPJKSA-N 2 0 372.578 4.233 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509438 1116313817 /nfs/dbraw/zinc/31/38/17/1116313817.db2.gz SHXQKIBYBULFRR-BDJLRTHQSA-N 2 0 357.723 4.021 20 0 FIADRP CC(C)(C)n1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cn1 ZINC000539825349 1116384249 /nfs/dbraw/zinc/38/42/49/1116384249.db2.gz SJNZGOHYVDWHJF-UHFFFAOYSA-N 2 0 366.553 4.126 20 0 FIADRP CCC1(C[NH2+]Cc2cccc3nccn32)CC[NH+](Cc2ccccc2)CC1 ZINC000539858377 1116391591 /nfs/dbraw/zinc/39/15/91/1116391591.db2.gz JYCUCFCBDNKMKO-UHFFFAOYSA-N 2 0 362.521 4.116 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000462764592 1117754653 /nfs/dbraw/zinc/75/46/53/1117754653.db2.gz UQLDIINJILZSBP-UHFFFAOYSA-N 2 0 374.960 4.354 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc2c(s1)CCCC2 ZINC000540158244 1117903278 /nfs/dbraw/zinc/90/32/78/1117903278.db2.gz TVMCKYYQLQICLK-IPELMVKDSA-N 2 0 362.583 4.045 20 0 FIADRP C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000540161426 1117904433 /nfs/dbraw/zinc/90/44/33/1117904433.db2.gz UENCKHVRIRFLAG-AUUYWEPGSA-N 2 0 360.885 4.065 20 0 FIADRP C[C@@H]1C[C@H](NCCC[NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463130736 1117978609 /nfs/dbraw/zinc/97/86/09/1117978609.db2.gz IHTPYYSHVZIRBT-ZJSXRUAMSA-N 2 0 365.565 4.151 20 0 FIADRP CCCc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C(C)C)cc1 ZINC000540321243 1117982800 /nfs/dbraw/zinc/98/28/00/1117982800.db2.gz RECLOJVZBOYDDB-OFNKIYASSA-N 2 0 358.570 4.427 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C[C@H](C)O1 ZINC000540320792 1117983119 /nfs/dbraw/zinc/98/31/19/1117983119.db2.gz NBCVVPQVYKWUJS-GQIGUUNPSA-N 2 0 350.934 4.270 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@H](C)[C@@H](C)C2)cc1)c1nccs1 ZINC000540394208 1118027659 /nfs/dbraw/zinc/02/76/59/1118027659.db2.gz IZUOSPRGEGLDIJ-BZSNNMDCSA-N 2 0 373.566 4.003 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCCc4cc(F)ccc43)c2)CCO1 ZINC000540408558 1118038253 /nfs/dbraw/zinc/03/82/53/1118038253.db2.gz MCWHGMVKJYZPLL-GAJHUEQPSA-N 2 0 368.496 4.214 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCCc4cc(F)ccc43)c2)CCO1 ZINC000540408561 1118038548 /nfs/dbraw/zinc/03/85/48/1118038548.db2.gz MCWHGMVKJYZPLL-UZUQRXQVSA-N 2 0 368.496 4.214 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000540419300 1118045056 /nfs/dbraw/zinc/04/50/56/1118045056.db2.gz WFINIWQLHAMGEQ-IIYDPXPESA-N 2 0 369.372 4.163 20 0 FIADRP C[C@@H]1C[C@H](N[C@H]2CCOc3c(F)cccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463263600 1118057864 /nfs/dbraw/zinc/05/78/64/1118057864.db2.gz DDMOZZNRDNMIRY-BLIXFSHQSA-N 2 0 354.469 4.292 20 0 FIADRP CCC1(CC)[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@@H]1OC ZINC000540494198 1118091571 /nfs/dbraw/zinc/09/15/71/1118091571.db2.gz XJIGVLLMYXPFDA-TYPHKJRUSA-N 2 0 372.553 4.158 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CCCC[NH+](C)C ZINC000540595419 1118138914 /nfs/dbraw/zinc/13/89/14/1118138914.db2.gz JFBWUFLWYYMCPW-UHFFFAOYSA-N 2 0 362.521 4.279 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1C(C)(C)C ZINC000540989821 1118339949 /nfs/dbraw/zinc/33/99/49/1118339949.db2.gz XEKBIARIFZMRBR-GHTZIAJQSA-N 2 0 366.549 4.402 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc2c(s1)CCC2 ZINC000540990768 1118340936 /nfs/dbraw/zinc/34/09/36/1118340936.db2.gz RRLGANRYPHADLG-JXFKEZNVSA-N 2 0 370.562 4.044 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cn1 ZINC000491316105 1118479701 /nfs/dbraw/zinc/47/97/01/1118479701.db2.gz KBBKSPDDPMCVBN-LZJOCLMNSA-N 2 0 371.500 4.071 20 0 FIADRP C[C@H](CCCCO)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000670161067 1118749552 /nfs/dbraw/zinc/74/95/52/1118749552.db2.gz GHFAJUQERLZYAH-XZBHBCHMSA-N 2 0 364.961 4.395 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492598588 1119141180 /nfs/dbraw/zinc/14/11/80/1119141180.db2.gz AYVPPUHJHVWOHV-GGAORHGYSA-N 3 0 357.586 4.143 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1sc(C)nc1C ZINC000178132154 1119373178 /nfs/dbraw/zinc/37/31/78/1119373178.db2.gz KFUZIEADYNNREM-HNNXBMFYSA-N 2 0 361.555 4.331 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2ccc(O)cc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311491842 1119376710 /nfs/dbraw/zinc/37/67/10/1119376710.db2.gz CFPPSZIMPIFVME-KPDCDPCYSA-N 2 0 350.506 4.270 20 0 FIADRP CCOc1ccc([C@@H](CC)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1OCC ZINC000178257426 1119380853 /nfs/dbraw/zinc/38/08/53/1119380853.db2.gz HLXMTNAJNIWRNN-HXUWFJFHSA-N 2 0 360.542 4.399 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+]C2CCN(c3cc(C)nc(C)n3)CC2)cc1 ZINC000178322684 1119384000 /nfs/dbraw/zinc/38/40/00/1119384000.db2.gz YEYITWURVBVMIE-QGZVFWFLSA-N 2 0 368.525 4.202 20 0 FIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)c1cccc(OC)c1 ZINC000542464527 1119384906 /nfs/dbraw/zinc/38/49/06/1119384906.db2.gz ZOBGVRKOZSROQK-QGZVFWFLSA-N 2 0 350.466 4.167 20 0 FIADRP c1ccc(C[N@H+]2CCCC[C@@H](C[NH2+][C@@H]3CCCC34CCOCC4)C2)cc1 ZINC000311892242 1119393420 /nfs/dbraw/zinc/39/34/20/1119393420.db2.gz YPKVVOBZLJVWSK-FCHUYYIVSA-N 2 0 356.554 4.228 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)CC1 ZINC000493909049 1119504944 /nfs/dbraw/zinc/50/49/44/1119504944.db2.gz UDEROGPBDBPLCQ-HLAWJBBLSA-N 2 0 374.956 4.099 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCc3cc(Br)cc(C)c32)C1 ZINC000493916682 1119506436 /nfs/dbraw/zinc/50/64/36/1119506436.db2.gz MCLNFWTYHCWWTE-YOEHRIQHSA-N 2 0 351.332 4.066 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000493945734 1119513653 /nfs/dbraw/zinc/51/36/53/1119513653.db2.gz TZXPHCBTTXTHRW-XXBNENTESA-N 2 0 352.522 4.059 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000494172951 1119550903 /nfs/dbraw/zinc/55/09/03/1119550903.db2.gz ODBBRWCGGAHGKI-UHFFFAOYSA-N 2 0 359.739 4.313 20 0 FIADRP C[C@@H](O)[C@](C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1 ZINC000188917547 1119805576 /nfs/dbraw/zinc/80/55/76/1119805576.db2.gz BKGZANILNHFYET-XXBNENTESA-N 2 0 358.570 4.003 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3F)CC2)C1 ZINC000542484739 1119904892 /nfs/dbraw/zinc/90/48/92/1119904892.db2.gz RXKFHUZGCULSHU-YOEHRIQHSA-N 2 0 354.460 4.279 20 0 FIADRP Fc1cncc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC000494572596 1119907991 /nfs/dbraw/zinc/90/79/91/1119907991.db2.gz BCGLTSYQPQCKBA-UHFFFAOYSA-N 2 0 355.501 4.045 20 0 FIADRP Cc1cnn(CCCCC[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000189949098 1119922080 /nfs/dbraw/zinc/92/20/80/1119922080.db2.gz XPAPQNFTGUMDSW-SFTDATJTSA-N 2 0 368.569 4.108 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)cn1 ZINC000190957151 1119955684 /nfs/dbraw/zinc/95/56/84/1119955684.db2.gz DJWQJWMJBBBTLY-UHFFFAOYSA-N 2 0 366.553 4.059 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCS2 ZINC000191514985 1119981060 /nfs/dbraw/zinc/98/10/60/1119981060.db2.gz OKPFXQOVGUJNJF-LJQANCHMSA-N 2 0 360.498 4.223 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(-c2noc(C3CC[NH+](C4CC4)CC3)n2)c1 ZINC000192701731 1120075901 /nfs/dbraw/zinc/07/59/01/1120075901.db2.gz RKHSDWAWRINJOU-UHFFFAOYSA-N 2 0 366.509 4.064 20 0 FIADRP FC(F)(F)C1CCC(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000192918721 1120090724 /nfs/dbraw/zinc/09/07/24/1120090724.db2.gz LOMIJWLJOGXIHK-CUYAVPTFSA-N 2 0 354.460 4.467 20 0 FIADRP C[C@H]([NH2+]Cc1cc(Cl)cs1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000193087547 1120098603 /nfs/dbraw/zinc/09/86/03/1120098603.db2.gz VITXRRJDXRGCMF-ZDUSSCGKSA-N 2 0 367.921 4.143 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495078424 1120462381 /nfs/dbraw/zinc/46/23/81/1120462381.db2.gz JMZBTEOXUNTOKI-AUSIDOKSSA-N 2 0 357.586 4.090 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001168484336 1120639469 /nfs/dbraw/zinc/63/94/69/1120639469.db2.gz FTULFKXKIUTUDM-IBGZPJMESA-N 2 0 367.512 4.140 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001168488672 1120858272 /nfs/dbraw/zinc/85/82/72/1120858272.db2.gz SAMXSECKSBYZPL-GOSISDBHSA-N 2 0 356.485 4.338 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000236761714 1120969599 /nfs/dbraw/zinc/96/95/99/1120969599.db2.gz IMNAAWYGVVOTCP-MRXNPFEDSA-N 2 0 354.485 4.463 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000236870938 1120970761 /nfs/dbraw/zinc/97/07/61/1120970761.db2.gz MOJJSHHXNIZAPX-OAQYLSRUSA-N 2 0 374.532 4.030 20 0 FIADRP c1cn(-c2ccc(-c3noc([C@@H]4CC[C@@H](c5ccccc5)[NH2+]C4)n3)cc2)cn1 ZINC001212207292 1120979581 /nfs/dbraw/zinc/97/95/81/1120979581.db2.gz FTTIOBNPPCVPDR-QUCCMNQESA-N 2 0 371.444 4.131 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]C[C@@H](C)C[NH+]3CCCCC3)cc2)cs1 ZINC000237577022 1120980034 /nfs/dbraw/zinc/98/00/34/1120980034.db2.gz MMKBBYAIJNZGGQ-QGZVFWFLSA-N 2 0 373.566 4.242 20 0 FIADRP Clc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cn1 ZINC000762927340 1120998573 /nfs/dbraw/zinc/99/85/73/1120998573.db2.gz PXQISUWQOXQOMP-UHFFFAOYSA-N 2 0 355.913 4.223 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000542668146 1121163008 /nfs/dbraw/zinc/16/30/08/1121163008.db2.gz FRFQGTOUWIPVOE-GOSISDBHSA-N 2 0 357.567 4.093 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000397553637 1121218011 /nfs/dbraw/zinc/21/80/11/1121218011.db2.gz HOAKBPWRJZEREL-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC000397556115 1121219055 /nfs/dbraw/zinc/21/90/55/1121219055.db2.gz MGTVTOWIBWHHPR-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCc3cccnc3)cc2)CC1 ZINC000154656126 1121304187 /nfs/dbraw/zinc/30/41/87/1121304187.db2.gz HVIMNLAZITYGCH-SFHVURJKSA-N 2 0 353.510 4.186 20 0 FIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)o2)cc1C ZINC000123641882 1121620962 /nfs/dbraw/zinc/62/09/62/1121620962.db2.gz WNZDZRGPLLUBEN-GOSISDBHSA-N 2 0 370.541 4.468 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1 ZINC000123729181 1121626921 /nfs/dbraw/zinc/62/69/21/1121626921.db2.gz DNELAHSAMYKAMU-LJQANCHMSA-N 2 0 364.411 4.424 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc3[nH]c(=O)oc3c2)cc1 ZINC000671739804 1121637432 /nfs/dbraw/zinc/63/74/32/1121637432.db2.gz XIGOYGCOYHBUFG-OAHLLOKOSA-N 2 0 353.466 4.226 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c(C)c1OC ZINC000671741412 1121638227 /nfs/dbraw/zinc/63/82/27/1121638227.db2.gz LZKYFLNPQIPMJA-MSOLQXFVSA-N 2 0 362.558 4.187 20 0 FIADRP COc1nc(C)cc(C)c1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671745672 1121661321 /nfs/dbraw/zinc/66/13/21/1121661321.db2.gz JQMSPPVOTMRHLI-UHFFFAOYSA-N 2 0 367.537 4.240 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCc3c2cccc3O)CC1 ZINC000671746330 1121664091 /nfs/dbraw/zinc/66/40/91/1121664091.db2.gz PFMUDYLMBDYMLV-AJTFCVKESA-N 2 0 350.506 4.412 20 0 FIADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2CCCCN2Cc2cccc(Cl)c2)CC1(C)C ZINC001649095865 1121754946 /nfs/dbraw/zinc/75/49/46/1121754946.db2.gz IBWWOABDZNRWBG-WOJBJXKFSA-N 2 0 363.977 4.157 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1 ZINC000125566973 1121792826 /nfs/dbraw/zinc/79/28/26/1121792826.db2.gz QGMPWNFSJNRXBP-RTBURBONSA-N 2 0 374.573 4.333 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000125613999 1121797558 /nfs/dbraw/zinc/79/75/58/1121797558.db2.gz AQNVUVGRPVRVIY-HZPDHXFCSA-N 2 0 358.555 4.286 20 0 FIADRP C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000069753267 1121878495 /nfs/dbraw/zinc/87/84/95/1121878495.db2.gz CPNIJHJHOLVFNF-LAUBAEHRSA-N 2 0 354.494 4.167 20 0 FIADRP Cc1cccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000126763139 1121985702 /nfs/dbraw/zinc/98/57/02/1121985702.db2.gz PNJMXWJPXFJYEV-ZWKOTPCHSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@](C)(O)c1cccc(Cl)c1 ZINC000765815695 1122124209 /nfs/dbraw/zinc/12/42/09/1122124209.db2.gz KXBQBDZFUCTQQC-ZPMCFJSWSA-N 2 0 372.940 4.048 20 0 FIADRP C[C@H](CCn1cccn1)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000497525400 1122265638 /nfs/dbraw/zinc/26/56/38/1122265638.db2.gz RZAMYCRCXRCBJU-LJQANCHMSA-N 2 0 354.542 4.216 20 0 FIADRP C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000497658542 1122341277 /nfs/dbraw/zinc/34/12/77/1122341277.db2.gz ZHQFCQUOOYPEGP-ROUUACIJSA-N 2 0 372.557 4.007 20 0 FIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000497821524 1122427548 /nfs/dbraw/zinc/42/75/48/1122427548.db2.gz SYWMDXIIMVHCIL-QFIPXVFZSA-N 2 0 355.501 4.420 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)CC1 ZINC000556104640 1122657839 /nfs/dbraw/zinc/65/78/39/1122657839.db2.gz FQUPPNIMBZZSNO-PKTZIBPZSA-N 2 0 357.586 4.170 20 0 FIADRP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1cccc(C2CC2)c1 ZINC000556194587 1122726186 /nfs/dbraw/zinc/72/61/86/1122726186.db2.gz WALWEEBJVIFCIE-QGZVFWFLSA-N 2 0 353.510 4.140 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)C1 ZINC000556232747 1122749684 /nfs/dbraw/zinc/74/96/84/1122749684.db2.gz IKJVKUBWHWFKNB-DNVCBOLYSA-N 2 0 369.475 4.276 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC34CCCC4)C3(C2)CCOCC3)cc1 ZINC000556234328 1122751520 /nfs/dbraw/zinc/75/15/20/1122751520.db2.gz WRGZNKUTMNQGIG-FCHUYYIVSA-N 2 0 368.565 4.228 20 0 FIADRP CC(C)c1nnc([C@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)[nH]1 ZINC000556262795 1122771681 /nfs/dbraw/zinc/77/16/81/1122771681.db2.gz XLPJVVYTWKTGOX-IVMQYODDSA-N 2 0 355.530 4.022 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000131308892 1123034600 /nfs/dbraw/zinc/03/46/00/1123034600.db2.gz LNMIXXUMBVPHKL-JKSUJKDBSA-N 2 0 363.937 4.082 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)nc1-c1ccccc1 ZINC000556887167 1123164702 /nfs/dbraw/zinc/16/47/02/1123164702.db2.gz RXDDFFCFEUTNPK-QRVBRYPASA-N 2 0 355.551 4.123 20 0 FIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000556889469 1123174918 /nfs/dbraw/zinc/17/49/18/1123174918.db2.gz HSFPGQKGNJHIOK-NTKDMRAZSA-N 2 0 366.549 4.303 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556890427 1123176757 /nfs/dbraw/zinc/17/67/57/1123176757.db2.gz LKHDNBQLJQVCJZ-DGZMEDPXSA-N 2 0 370.581 4.472 20 0 FIADRP CCC(CC)(CNC(=O)C1CC[NH+](C(C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000073648391 1123236815 /nfs/dbraw/zinc/23/68/15/1123236815.db2.gz FFXHHOJCXUGZMV-IBGZPJMESA-N 2 0 373.585 4.133 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCN[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499144741 1123287494 /nfs/dbraw/zinc/28/74/94/1123287494.db2.gz XXLDIIADNBBAQY-CUPZBTRVSA-N 2 0 369.597 4.140 20 0 FIADRP COc1cccc2c1CC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499196136 1123315773 /nfs/dbraw/zinc/31/57/73/1123315773.db2.gz RGVQFYGICYSSBU-VLVHOKLOSA-N 2 0 362.517 4.468 20 0 FIADRP C[NH+](C)CC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000499217780 1123333206 /nfs/dbraw/zinc/33/32/06/1123333206.db2.gz WONJHVRJFMLZTB-LRSLUSHPSA-N 3 0 357.586 4.138 20 0 FIADRP COc1cccc(C[C@@H](C)[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499231287 1123340468 /nfs/dbraw/zinc/34/04/68/1123340468.db2.gz UTCPZCBFWQFIAD-TWHAJKEOSA-N 2 0 364.533 4.411 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCCc4ccccc43)cc2)CC1 ZINC000132772398 1123358839 /nfs/dbraw/zinc/35/88/39/1123358839.db2.gz SVERLIFPJNMWAC-DEOSSOPVSA-N 2 0 364.533 4.201 20 0 FIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCCC2 ZINC000132980609 1123394469 /nfs/dbraw/zinc/39/44/69/1123394469.db2.gz TWRDHVRXXZWWRN-IERDGZPVSA-N 2 0 362.945 4.198 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CCOCC1 ZINC000133422281 1123485859 /nfs/dbraw/zinc/48/58/59/1123485859.db2.gz PDTMNGUSYGJYJO-GOSISDBHSA-N 2 0 352.522 4.320 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCCCSc2ccccc2Br)CC[N@@H+]1C ZINC000133419582 1123486177 /nfs/dbraw/zinc/48/61/77/1123486177.db2.gz VQMSTUMUBOUYCH-HUUCEWRRSA-N 2 0 371.388 4.394 20 0 FIADRP c1csc([C@@H](CNC2CC[NH+](C3CCCCC3)CC2)[NH+]2CCCC2)c1 ZINC000134130790 1123594973 /nfs/dbraw/zinc/59/49/73/1123594973.db2.gz HNDMHQUAUVQOOR-HXUWFJFHSA-N 2 0 361.599 4.272 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H](C2CC2)[C@H]2CCCCO2)C3)cc1 ZINC000655788835 1123827278 /nfs/dbraw/zinc/82/72/78/1123827278.db2.gz PYZDMZDNWMKKNY-KCSJKLDESA-N 2 0 354.538 4.119 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(C)c(F)c2)c1 ZINC000615324057 1123989676 /nfs/dbraw/zinc/98/96/76/1123989676.db2.gz AOYGHONUWYVICP-QGZVFWFLSA-N 2 0 371.500 4.093 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000245528802 1124109977 /nfs/dbraw/zinc/10/99/77/1124109977.db2.gz GEKYWHCESGIEIE-FPOVZHCZSA-N 2 0 372.553 4.040 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ncc(Br)s1 ZINC000245653357 1124168654 /nfs/dbraw/zinc/16/86/54/1124168654.db2.gz KNWKIAUXKVSKDR-QWHCGFSZSA-N 2 0 360.365 4.068 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000245654046 1124168875 /nfs/dbraw/zinc/16/88/75/1124168875.db2.gz DDMDBHLDRFSOFR-DKUWSORSSA-N 2 0 356.554 4.369 20 0 FIADRP CC(C)(C)C[N@H+](Cc1cc(F)cc(Br)c1)C1CC[NH2+]CC1 ZINC001236456743 1124183982 /nfs/dbraw/zinc/18/39/82/1124183982.db2.gz GPBZOISHOVJETJ-UHFFFAOYSA-N 2 0 357.311 4.188 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)C1CCC(C(F)(F)F)CC1 ZINC000474601435 1124217794 /nfs/dbraw/zinc/21/77/94/1124217794.db2.gz QLJCFOIEMXSMIL-HJOIGYKYSA-N 2 0 372.475 4.474 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245724524 1124221048 /nfs/dbraw/zinc/22/10/48/1124221048.db2.gz PGNWBGPJQALPEF-HLRQEUIKSA-N 2 0 350.506 4.108 20 0 FIADRP CO[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245733514 1124228031 /nfs/dbraw/zinc/22/80/31/1124228031.db2.gz QOBJSBLGUCDSKF-BXXSPATCSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(F)c1F ZINC000245852349 1124263732 /nfs/dbraw/zinc/26/37/32/1124263732.db2.gz GOUXMEQDWBYYNZ-IXDOHACOSA-N 2 0 374.475 4.425 20 0 FIADRP COc1ccc([C@@H](NC[C@@H]2CCC[N@H+](C)C2)c2ccccc2Cl)cc1 ZINC000245885411 1124271967 /nfs/dbraw/zinc/27/19/67/1124271967.db2.gz BPQJUGROGFRRJI-HRAATJIYSA-N 2 0 358.913 4.369 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)CCO2)cc1 ZINC001168654447 1124414600 /nfs/dbraw/zinc/41/46/00/1124414600.db2.gz UBGFNLDBCLUUHI-XJUOHMSHSA-N 2 0 372.553 4.256 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000246302715 1124440066 /nfs/dbraw/zinc/44/00/66/1124440066.db2.gz DEHAHHOCHRNDHX-XUVXKRRUSA-N 2 0 350.934 4.149 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc(C)c1F ZINC000542846554 1124442006 /nfs/dbraw/zinc/44/20/06/1124442006.db2.gz MMANULMQIAYGLM-PGRDOPGGSA-N 2 0 370.512 4.250 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1SC ZINC000246508067 1124519820 /nfs/dbraw/zinc/51/98/20/1124519820.db2.gz TXCKMGQWZMOVDN-SJORKVTESA-N 2 0 350.572 4.436 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2cccs2)C2CCCC2)CC1 ZINC000246528766 1124524660 /nfs/dbraw/zinc/52/46/60/1124524660.db2.gz VEZFJTCGEYXOEL-SBHAEUEKSA-N 2 0 362.583 4.337 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000246584090 1124536796 /nfs/dbraw/zinc/53/67/96/1124536796.db2.gz YWNAJUNHVYGPBI-FASAQXTFSA-N 2 0 371.352 4.412 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000246895559 1124571984 /nfs/dbraw/zinc/57/19/84/1124571984.db2.gz FPHNUWGZWQTXSC-ZYSHUDEJSA-N 2 0 371.491 4.161 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3Cl)[C@H](C)C1 ZINC000246983902 1124578111 /nfs/dbraw/zinc/57/81/11/1124578111.db2.gz KGNBUTFWEFAJSQ-XPGWFJOJSA-N 2 0 350.934 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc32)[C@@H](C)C1 ZINC000247088358 1124588314 /nfs/dbraw/zinc/58/83/14/1124588314.db2.gz RKFVUAXRFXUNGU-RYGJVYDSSA-N 2 0 350.934 4.054 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cc(F)c(Cl)cc1Cl ZINC000247133577 1124593669 /nfs/dbraw/zinc/59/36/69/1124593669.db2.gz AURQHWGWENRWIS-OLZOCXBDSA-N 2 0 363.304 4.020 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C2CC2)cc1 ZINC000248430227 1124767537 /nfs/dbraw/zinc/76/75/37/1124767537.db2.gz BNAPPOPQOKEYRJ-BJKOFHAPSA-N 2 0 364.533 4.193 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(C)c1 ZINC000248435649 1124768359 /nfs/dbraw/zinc/76/83/59/1124768359.db2.gz FUCQTZGHMKIBJE-UGKGYDQZSA-N 2 0 352.522 4.111 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1 ZINC000248440097 1124769504 /nfs/dbraw/zinc/76/95/04/1124769504.db2.gz JGOCCKQKYYTVDN-GOTSBHOMSA-N 2 0 352.522 4.130 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1 ZINC000248440098 1124769597 /nfs/dbraw/zinc/76/95/97/1124769597.db2.gz JGOCCKQKYYTVDN-XZOQPEGZSA-N 2 0 352.522 4.130 20 0 FIADRP CC1(C)C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2ccccc21 ZINC000248449846 1124770184 /nfs/dbraw/zinc/77/01/84/1124770184.db2.gz ORFGSMNJIORACB-NZQKXSOJSA-N 2 0 364.533 4.156 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1 ZINC000248456350 1124773581 /nfs/dbraw/zinc/77/35/81/1124773581.db2.gz SFDTZJHHWAXYGU-KKSFZXQISA-N 2 0 358.913 4.148 20 0 FIADRP CC(C)c1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000248462770 1124773900 /nfs/dbraw/zinc/77/39/00/1124773900.db2.gz YMOPGSXFRQDYQE-FDDCHVKYSA-N 2 0 352.522 4.227 20 0 FIADRP CN1CCC[C@H](C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)[C@H]1c1cccs1 ZINC000248739040 1124808177 /nfs/dbraw/zinc/80/81/77/1124808177.db2.gz PQUFWWGVJLYTOD-OMZCVMJRSA-N 2 0 360.567 4.068 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000249108340 1124843641 /nfs/dbraw/zinc/84/36/41/1124843641.db2.gz MANRUCRJQXVWNS-VLHNPEIBSA-N 2 0 363.549 4.293 20 0 FIADRP Cc1ccc(-c2ccc(-c3noc([C@@](C)([NH3+])CCCC[NH3+])n3)cc2)cc1 ZINC001212337992 1124855645 /nfs/dbraw/zinc/85/56/45/1124855645.db2.gz KFUVMEKASAAMRD-NRFANRHFSA-N 2 0 350.466 4.015 20 0 FIADRP CCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)cc1 ZINC000063319648 1124908803 /nfs/dbraw/zinc/90/88/03/1124908803.db2.gz LIIXICCGUBCNLY-UHFFFAOYSA-N 2 0 352.522 4.259 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4cccs4)cc3)C2)CC1 ZINC000618283294 1125131805 /nfs/dbraw/zinc/13/18/05/1125131805.db2.gz GVXNMXXYRKXOMD-OAQYLSRUSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H](CO)c3ccc(Cl)cc3)CC2)C1 ZINC000672619104 1125195273 /nfs/dbraw/zinc/19/52/73/1125195273.db2.gz IOBFRPLVQVSKPP-MMOPVJDHSA-N 2 0 364.961 4.049 20 0 FIADRP C[NH+](C/C=C\C[N@H+](C)CCc1ccc(F)cc1)CCc1ccc(F)cc1 ZINC000618985803 1125411536 /nfs/dbraw/zinc/41/15/36/1125411536.db2.gz RRABUDUZNDEWQD-ARJAWSKDSA-N 2 0 358.476 4.170 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccnc5ccccc45)C[C@H]3C2)cc1 ZINC000312643736 1125438452 /nfs/dbraw/zinc/43/84/52/1125438452.db2.gz INSGGPVNAFWPMT-IFMALSPDSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ncc(Br)cc1F ZINC000187012248 568044885 /nfs/dbraw/zinc/04/48/85/568044885.db2.gz LDHQWFAEZVWXIA-CQSZACIVSA-N 2 0 372.326 4.146 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCC3(CCCC[NH2+]3)CC2)nc1 ZINC001164386911 718803652 /nfs/dbraw/zinc/80/36/52/718803652.db2.gz HBRVIUNMKOSDTN-HXUWFJFHSA-N 2 0 356.558 4.131 20 0 FIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@H]2CC[NH+]2CCCC2)nc1 ZINC001165049184 721978012 /nfs/dbraw/zinc/97/80/12/721978012.db2.gz ICDNWORHQYDHTF-FCHUYYIVSA-N 2 0 370.585 4.473 20 0 FIADRP CCc1nc(CN[C@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)cs1 ZINC000182897723 1125677571 /nfs/dbraw/zinc/67/75/71/1125677571.db2.gz PHNVVXNXOOSSOD-OAHLLOKOSA-N 2 0 361.555 4.407 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3F)c2)C1 ZINC000619772559 1125700374 /nfs/dbraw/zinc/70/03/74/1125700374.db2.gz OKPSYQRAHUQCFB-IBGZPJMESA-N 2 0 356.485 4.226 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000544827692 1079555037 /nfs/dbraw/zinc/55/50/37/1079555037.db2.gz IJWKWLVUTXJVKL-YWZLYKJASA-N 2 0 350.934 4.413 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c(F)c1 ZINC001648786152 1079618456 /nfs/dbraw/zinc/61/84/56/1079618456.db2.gz SKFAOJJNPKNYLF-ROUUACIJSA-N 2 0 356.485 4.033 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000643546984 1079666854 /nfs/dbraw/zinc/66/68/54/1079666854.db2.gz XWMPACQCOUXEAX-RHSMWYFYSA-N 2 0 371.550 4.452 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc(C)c1F ZINC000579820550 1079962100 /nfs/dbraw/zinc/96/21/00/1079962100.db2.gz NHFCCENXLIPKEH-QGZVFWFLSA-N 2 0 359.489 4.019 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(C(=O)OC)cc1 ZINC000579859676 1080163927 /nfs/dbraw/zinc/16/39/27/1080163927.db2.gz BBHHHFJLKJCYFN-NRFANRHFSA-N 2 0 358.526 4.311 20 0 FIADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(C(=O)OC)cc1 ZINC000579859677 1080164260 /nfs/dbraw/zinc/16/42/60/1080164260.db2.gz BBHHHFJLKJCYFN-OAQYLSRUSA-N 2 0 358.526 4.311 20 0 FIADRP COCc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC001648791907 1080496689 /nfs/dbraw/zinc/49/66/89/1080496689.db2.gz DLZPGQXVOABHQI-IBGZPJMESA-N 2 0 352.522 4.355 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000109786974 1080751290 /nfs/dbraw/zinc/75/12/90/1080751290.db2.gz GOFGTOVWWTUSIL-UHFFFAOYSA-N 2 0 372.340 4.128 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2-c2ccnn2C)c1 ZINC000510246209 1080868145 /nfs/dbraw/zinc/86/81/45/1080868145.db2.gz WQVNHDKYNUTGHM-UHFFFAOYSA-N 2 0 362.521 4.217 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3cn4ccnc4s3)cc2)C1 ZINC001648808198 1081111952 /nfs/dbraw/zinc/11/19/52/1081111952.db2.gz DWEGYHAEONEBSH-CALCHBBNSA-N 2 0 368.550 4.164 20 0 FIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]C2CCN(C[C@H]3CCCO3)CC2)cc1 ZINC000655696352 1081122818 /nfs/dbraw/zinc/12/28/18/1081122818.db2.gz GCBSVWHTDPHOGB-AUSIDOKSSA-N 2 0 374.569 4.028 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000655805228 1081211519 /nfs/dbraw/zinc/21/15/19/1081211519.db2.gz LGIALQXPFXKCMA-RPVQJOFSSA-N 2 0 363.299 4.061 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CCC3)cc1 ZINC000655806663 1081211680 /nfs/dbraw/zinc/21/16/80/1081211680.db2.gz ZBLUBWCNNMBWHG-JQHSSLGASA-N 2 0 355.551 4.426 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000655803722 1081213217 /nfs/dbraw/zinc/21/32/17/1081213217.db2.gz CHGBFCHOFSHGAP-UIAACRFSSA-N 2 0 373.338 4.468 20 0 FIADRP CC(C)n1ncc2cc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)cnc21 ZINC000121777409 1081252749 /nfs/dbraw/zinc/25/27/49/1081252749.db2.gz CZLFIFKSBBOUFI-UHFFFAOYSA-N 2 0 369.557 4.100 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+][C@H]2CCCN3CCCC[C@H]23)cc1 ZINC000655848503 1081257438 /nfs/dbraw/zinc/25/74/38/1081257438.db2.gz GFYYRULWEBSGFA-DZFGPLHGSA-N 2 0 372.557 4.228 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397600977 1081296400 /nfs/dbraw/zinc/29/64/00/1081296400.db2.gz UGUQOTHFYCEBCE-IBGZPJMESA-N 2 0 352.522 4.128 20 0 FIADRP CC(C)C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397613209 1081322272 /nfs/dbraw/zinc/32/22/72/1081322272.db2.gz SIAWWVFQGFFYDN-HSZRJFAPSA-N 2 0 366.549 4.391 20 0 FIADRP C[C@H](O)[C@@H]1CCCC[N@@H+]1C[C@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167337093 1081470178 /nfs/dbraw/zinc/47/01/78/1081470178.db2.gz GZGCQRXXCLRXHP-OYDLWJJNSA-N 2 0 366.549 4.138 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3ccc4cnccc4c3)CC2)c1 ZINC000683767466 1081525084 /nfs/dbraw/zinc/52/50/84/1081525084.db2.gz IXPYMEODTHKUIQ-UHFFFAOYSA-N 2 0 351.519 4.298 20 0 FIADRP c1nc(C2CC2)c(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000683774703 1081539526 /nfs/dbraw/zinc/53/95/26/1081539526.db2.gz IVKPMDJKVPSACU-XUVXKRRUSA-N 2 0 367.562 4.411 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cncc(OCc3ccccc3)c2)CC1 ZINC000683780280 1081547787 /nfs/dbraw/zinc/54/77/87/1081547787.db2.gz DYGFPELQCLVVQC-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H](OCc2ccccc2)c2ccc(Cl)cc2)C1 ZINC000580095125 1081589282 /nfs/dbraw/zinc/58/92/82/1081589282.db2.gz IXNWSZLXPVXFGV-NJDAHSKKSA-N 2 0 358.913 4.457 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000683816221 1081619028 /nfs/dbraw/zinc/61/90/28/1081619028.db2.gz NBZSUICJKYXKQM-RRPUWOKSSA-N 2 0 352.522 4.264 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)c2ccccc21 ZINC000580218711 1081757883 /nfs/dbraw/zinc/75/78/83/1081757883.db2.gz UOSXUTKFOHCQBA-VXKWHMMOSA-N 2 0 370.537 4.165 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000580249319 1081780399 /nfs/dbraw/zinc/78/03/99/1081780399.db2.gz CICCOUJTKOCEOC-AUSIDOKSSA-N 2 0 350.506 4.053 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000580249322 1081780632 /nfs/dbraw/zinc/78/06/32/1081780632.db2.gz CICCOUJTKOCEOC-XXBNENTESA-N 2 0 350.506 4.053 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312782669 1081841177 /nfs/dbraw/zinc/84/11/77/1081841177.db2.gz ASJLKICJBLSYOD-RXVVDRJESA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CCC(F)(F)CC1 ZINC000656201595 1081910648 /nfs/dbraw/zinc/91/06/48/1081910648.db2.gz SDYIYIOIEGDKAO-UCLAIMLFSA-N 2 0 350.453 4.046 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)COCc1ccccc1 ZINC000580587181 1082028201 /nfs/dbraw/zinc/02/82/01/1082028201.db2.gz XDXILIXRXFESQP-PTUXOGIPSA-N 2 0 352.522 4.264 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1 ZINC000471599097 1082036779 /nfs/dbraw/zinc/03/67/79/1082036779.db2.gz NYSROAMDLZDGDR-UXHICEINSA-N 2 0 357.586 4.411 20 0 FIADRP CSC1(C[NH2+][C@H](C)Cc2c(Cl)cccc2Cl)CC[NH+](C)CC1 ZINC000564432977 1082043380 /nfs/dbraw/zinc/04/33/80/1082043380.db2.gz USMWPWMDTPYEOA-CYBMUJFWSA-N 2 0 361.382 4.341 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@H]1CC[N@@H+](C(C)C)C1 ZINC000077417528 1082145297 /nfs/dbraw/zinc/14/52/97/1082145297.db2.gz ANGKWCPAKGPMTA-LJQANCHMSA-N 2 0 374.960 4.022 20 0 FIADRP FC(F)(F)CCCN1CCC[C@]2(CCC[N@H+](C[C@@H]3CCCCO3)C2)C1 ZINC001279475223 1082255968 /nfs/dbraw/zinc/25/59/68/1082255968.db2.gz XUVPNVGURDMGSA-ROUUACIJSA-N 2 0 362.480 4.076 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000581103910 1082316893 /nfs/dbraw/zinc/31/68/93/1082316893.db2.gz ZGOKMWPWQKTYJA-HRSGCLKMSA-N 2 0 350.453 4.107 20 0 FIADRP Cc1cc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)ccc1Oc1cccnc1 ZINC000581131564 1082332902 /nfs/dbraw/zinc/33/29/02/1082332902.db2.gz LMBZHBOODSWZSP-FQEVSTJZSA-N 2 0 351.494 4.004 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000430549272 1082436463 /nfs/dbraw/zinc/43/64/63/1082436463.db2.gz IHWAUFRWJKKWCA-ICSRJNTNSA-N 2 0 360.505 4.099 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000656466459 1082442098 /nfs/dbraw/zinc/44/20/98/1082442098.db2.gz QQWYZSVXEOBGLQ-DEOSSOPVSA-N 2 0 373.500 4.438 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)s1 ZINC000090401647 1082766131 /nfs/dbraw/zinc/76/61/31/1082766131.db2.gz UXJXBVNWALDMND-GOSISDBHSA-N 2 0 372.582 4.013 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C2CCC(OC(C)C)CC2)CC1 ZINC000130243876 1082837808 /nfs/dbraw/zinc/83/78/08/1082837808.db2.gz PUUQMVASYRADAO-UHFFFAOYSA-N 2 0 373.585 4.044 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2nc3ccccc3s2)CC1 ZINC000581911414 1083023722 /nfs/dbraw/zinc/02/37/22/1083023722.db2.gz STOSSTWNIFXOAD-APWZRJJASA-N 2 0 357.567 4.472 20 0 FIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)s1 ZINC000090971306 1083096495 /nfs/dbraw/zinc/09/64/95/1083096495.db2.gz BVXRUZJPHFDTSC-SFHVURJKSA-N 2 0 369.578 4.439 20 0 FIADRP Fc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1Br ZINC000430762024 1083155785 /nfs/dbraw/zinc/15/57/85/1083155785.db2.gz NNLDWTHMSOMSNN-KLHDSHLOSA-N 2 0 367.306 4.051 20 0 FIADRP c1ccc(COc2cccc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000090953705 1083219003 /nfs/dbraw/zinc/21/90/03/1083219003.db2.gz VZJVCWSIMCLKNG-FGZHOGPDSA-N 2 0 350.506 4.025 20 0 FIADRP C[NH2+]CC1CC[NH+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000430932426 1083239937 /nfs/dbraw/zinc/23/99/37/1083239937.db2.gz GMIKTTXABLMGSC-UHFFFAOYSA-N 2 0 369.456 4.260 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H]3CC[C@H]3C3CCC3)CC2)cc1 ZINC000510745883 1083287061 /nfs/dbraw/zinc/28/70/61/1083287061.db2.gz BCZCFSAYIPZEKG-GOTSBHOMSA-N 2 0 356.554 4.226 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccc(Br)cc32)C1 ZINC000510754586 1083291208 /nfs/dbraw/zinc/29/12/08/1083291208.db2.gz ULFYJZKXKRRMJY-KDOFPFPSSA-N 2 0 351.332 4.146 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3ccc(Br)cc32)C1 ZINC000510754587 1083291665 /nfs/dbraw/zinc/29/16/65/1083291665.db2.gz ULFYJZKXKRRMJY-KSSFIOAISA-N 2 0 351.332 4.146 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)CCc2c(F)cccc2F)[C@H](C)C1 ZINC000510755985 1083294088 /nfs/dbraw/zinc/29/40/88/1083294088.db2.gz YBCJJTCTYQCYMR-LZJOCLMNSA-N 2 0 368.512 4.013 20 0 FIADRP CCC[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)C1CC[NH2+]CC1 ZINC000431075545 1083328445 /nfs/dbraw/zinc/32/84/45/1083328445.db2.gz AGRIPXCROUAWOS-UHFFFAOYSA-N 2 0 365.521 4.146 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C/C(C)=C/c2ccccc2COC)c1 ZINC000510871668 1083349620 /nfs/dbraw/zinc/34/96/20/1083349620.db2.gz IUTQTEQYAKDLJH-CPNJWEJPSA-N 2 0 352.522 4.478 20 0 FIADRP CC(C)[C@H](O)[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000658288435 1083394894 /nfs/dbraw/zinc/39/48/94/1083394894.db2.gz PHUYPAQOMKQNKC-NMNUPHIUSA-N 2 0 370.537 4.036 20 0 FIADRP C[C@H](CC1CCOCC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320170 1083406677 /nfs/dbraw/zinc/40/66/77/1083406677.db2.gz PHEBTDGCLWULMO-KNQAVFIVSA-N 2 0 356.554 4.084 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658318661 1083407050 /nfs/dbraw/zinc/40/70/50/1083407050.db2.gz RTAAYXDWVARCHR-BDTNDASRSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(O)c1 ZINC000658320436 1083407800 /nfs/dbraw/zinc/40/78/00/1083407800.db2.gz YDENUTMZUMBHEX-NQIIRXRSSA-N 2 0 350.506 4.345 20 0 FIADRP Fc1ccc([C@@H](C[C@H]2CCOC2)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000658352656 1083423998 /nfs/dbraw/zinc/42/39/98/1083423998.db2.gz HPCXAKJXUBCVTB-DENIHFKCSA-N 2 0 360.517 4.005 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)cc1 ZINC000658355146 1083425133 /nfs/dbraw/zinc/42/51/33/1083425133.db2.gz HTJOCHMOGJSMLW-JOCHJYFZSA-N 2 0 353.485 4.022 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)c1 ZINC000535685238 1083576827 /nfs/dbraw/zinc/57/68/27/1083576827.db2.gz GXRAMVPIHRSQJW-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccc(F)c2)s1 ZINC000535807967 1083693996 /nfs/dbraw/zinc/69/39/96/1083693996.db2.gz KKAUJRGCUBGBLF-RLLQIKCJSA-N 2 0 374.525 4.238 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccc(F)cc2)s1 ZINC000535809148 1083697829 /nfs/dbraw/zinc/69/78/29/1083697829.db2.gz IPALIYXZJKTHTM-YZGWKJHDSA-N 2 0 374.525 4.238 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2F)s1 ZINC000535809886 1083697943 /nfs/dbraw/zinc/69/79/43/1083697943.db2.gz OCLLZWBGWZWIFE-CDHQVMDDSA-N 2 0 374.525 4.238 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)o1 ZINC000065976547 1083904233 /nfs/dbraw/zinc/90/42/33/1083904233.db2.gz AZDDNBYNFMPHPL-UHFFFAOYSA-N 2 0 352.482 4.108 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1F ZINC000472459736 1083986075 /nfs/dbraw/zinc/98/60/75/1083986075.db2.gz PPQBHKCRUBIGKJ-FQEVSTJZSA-N 2 0 369.956 4.182 20 0 FIADRP C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177489979 1083999695 /nfs/dbraw/zinc/99/96/95/1083999695.db2.gz FHEAFNSXRZKUPE-SJLPKXTDSA-N 2 0 367.578 4.017 20 0 FIADRP Cc1nccn1CCC[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000510994366 1084016177 /nfs/dbraw/zinc/01/61/77/1084016177.db2.gz HVUGCLGJLXLMIL-LBPRGKRZSA-N 2 0 362.271 4.441 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000511003159 1084100157 /nfs/dbraw/zinc/10/01/57/1084100157.db2.gz VETZXPSGJUPPRW-QVKFZJNVSA-N 2 0 372.484 4.113 20 0 FIADRP c1ccc(NC2CC[NH+](Cc3ccccc3Oc3cccnc3)CC2)nc1 ZINC000536370266 1084221827 /nfs/dbraw/zinc/22/18/27/1084221827.db2.gz KGUZSZBAAFXEDZ-UHFFFAOYSA-N 2 0 360.461 4.345 20 0 FIADRP CC[C@H]1C[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC[C@@H]1[NH3+] ZINC000647497903 1084249955 /nfs/dbraw/zinc/24/99/55/1084249955.db2.gz ZZNGQAQSODNMGM-JXFKEZNVSA-N 2 0 371.912 4.152 20 0 FIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000537969587 1084319372 /nfs/dbraw/zinc/31/93/72/1084319372.db2.gz GYNFNZWWFGOFQR-OAGGEKHMSA-N 2 0 358.979 4.202 20 0 FIADRP OCC[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCc2ccccc21 ZINC001167529668 1084464588 /nfs/dbraw/zinc/46/45/88/1084464588.db2.gz QPMYPQPKQXAPGI-DEOSSOPVSA-N 2 0 364.533 4.154 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]CCSc2ccc(Cl)cc2)cc1 ZINC000613257932 1084512448 /nfs/dbraw/zinc/51/24/48/1084512448.db2.gz PRSUAHNFHMQJNB-UHFFFAOYSA-N 2 0 364.942 4.162 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NCc3ccnn3-c3cc[nH+]cc3)cc2)C1 ZINC000657320952 1084543454 /nfs/dbraw/zinc/54/34/54/1084543454.db2.gz KHNRYIAUBNNRML-SFHVURJKSA-N 2 0 361.493 4.111 20 0 FIADRP Cn1ncc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)c1C1CC1 ZINC000892540440 1084654870 /nfs/dbraw/zinc/65/48/70/1084654870.db2.gz JVPDQMLEHRMCQP-UHFFFAOYSA-N 2 0 374.532 4.316 20 0 FIADRP CCn1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)c(C)n1 ZINC000892540679 1084660424 /nfs/dbraw/zinc/66/04/24/1084660424.db2.gz PHLYOKBLFYWTNB-UHFFFAOYSA-N 2 0 362.521 4.230 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000414150491 1084706408 /nfs/dbraw/zinc/70/64/08/1084706408.db2.gz PETFNXVAJOSVFH-GOSISDBHSA-N 2 0 368.521 4.327 20 0 FIADRP Brc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414162151 1084719378 /nfs/dbraw/zinc/71/93/78/1084719378.db2.gz DBRBBYCVOBDAMF-GOSISDBHSA-N 2 0 356.267 4.264 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000414173484 1084738799 /nfs/dbraw/zinc/73/87/99/1084738799.db2.gz FSFJQVJXAJLVNI-LAUBAEHRSA-N 2 0 357.929 4.340 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000414296367 1084987958 /nfs/dbraw/zinc/98/79/58/1084987958.db2.gz FGLHNAXSFLKZCH-FXAWDEMLSA-N 2 0 370.562 4.303 20 0 FIADRP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657429695 1085002908 /nfs/dbraw/zinc/00/29/08/1085002908.db2.gz IRBPUQVJXZQRGM-QFBILLFUSA-N 2 0 351.519 4.297 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657429690 1085004136 /nfs/dbraw/zinc/00/41/36/1085004136.db2.gz IRBPUQVJXZQRGM-APWZRJJASA-N 2 0 351.519 4.297 20 0 FIADRP Cc1cccc2[nH]c(C[NH2+]Cc3ccc(OC4CC[NH+](C)CC4)cc3)cc21 ZINC000657460458 1085124769 /nfs/dbraw/zinc/12/47/69/1085124769.db2.gz XGXRSKOTOCBVEP-UHFFFAOYSA-N 2 0 363.505 4.239 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000563415151 1085243928 /nfs/dbraw/zinc/24/39/28/1085243928.db2.gz BXNJTNDGAWQBAS-KURKYZTESA-N 2 0 352.526 4.114 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCC2(CCCC2)O1 ZINC000582618814 1085258786 /nfs/dbraw/zinc/25/87/86/1085258786.db2.gz AWWUWTNXSMGUKR-NRFANRHFSA-N 2 0 357.542 4.112 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H](c1cccnc1)C1CCCCC1 ZINC000652145191 1085266338 /nfs/dbraw/zinc/26/63/38/1085266338.db2.gz GQSUUUSZWVNNQH-QHCPKHFHSA-N 2 0 367.537 4.433 20 0 FIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000549527980 1085366288 /nfs/dbraw/zinc/36/62/88/1085366288.db2.gz SETIYOWSJLULMH-FCHUYYIVSA-N 2 0 366.505 4.020 20 0 FIADRP Cc1nn(-c2cccc(C)c2)cc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000651749682 1085443697 /nfs/dbraw/zinc/44/36/97/1085443697.db2.gz FZSFEMWDWIYUEN-UHFFFAOYSA-N 2 0 374.532 4.375 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000040227369 1085575495 /nfs/dbraw/zinc/57/54/95/1085575495.db2.gz BSXFHSTZOGHLPT-GOSISDBHSA-N 2 0 351.332 4.291 20 0 FIADRP Clc1cc(Cl)cc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000657612241 1085688215 /nfs/dbraw/zinc/68/82/15/1085688215.db2.gz KCXZUGRJQVMDQU-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP c1nc(C2CCCC2)sc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613222 1085691404 /nfs/dbraw/zinc/69/14/04/1085691404.db2.gz JAEAAOPPGNELMY-UHFFFAOYSA-N 2 0 370.566 4.198 20 0 FIADRP CC(C)[C@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000657612914 1085697604 /nfs/dbraw/zinc/69/76/04/1085697604.db2.gz FBYZDVVZDHAQRF-QHCPKHFHSA-N 2 0 351.538 4.323 20 0 FIADRP CCc1cc(N(c2cc(OC)cc3cccnc32)[C@@H](C)CCC[NH3+])cc[nH+]1 ZINC001167615173 1085713621 /nfs/dbraw/zinc/71/36/21/1085713621.db2.gz RGPMRCCMYHKKMU-INIZCTEOSA-N 2 0 364.493 4.466 20 0 FIADRP Cc1ccc2[nH]c(C[NH+]3CCC(C[N@@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)cc2c1C ZINC000473132649 1085732602 /nfs/dbraw/zinc/73/26/02/1085732602.db2.gz NWQPBJMXNWHYGM-HDICACEKSA-N 2 0 369.553 4.106 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000153490140 1085823985 /nfs/dbraw/zinc/82/39/85/1085823985.db2.gz QHYRBYOGAZIVLP-CYFREDJKSA-N 2 0 372.516 4.144 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000511904869 1085936896 /nfs/dbraw/zinc/93/68/96/1085936896.db2.gz DJNLSKCWVDEFEV-BOPFTXTBSA-N 2 0 356.485 4.227 20 0 FIADRP c1[nH+]cn2ccc(-c3noc(-c4ccc(C[NH+]5CCCCC5)cc4)n3)cc12 ZINC000582989871 1085999641 /nfs/dbraw/zinc/99/96/41/1085999641.db2.gz FEHPSZPSPGKVEA-UHFFFAOYSA-N 2 0 359.433 4.037 20 0 FIADRP C[C@@H](CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000249053747 1086182844 /nfs/dbraw/zinc/18/28/44/1086182844.db2.gz YCEMTOUNKUBYPY-SNJCGAMXSA-N 2 0 355.570 4.036 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cnc(-c2ccccc2)nc1 ZINC000583111523 1086204447 /nfs/dbraw/zinc/20/44/47/1086204447.db2.gz XICMELHTYHLFBL-UHFFFAOYSA-N 2 0 360.505 4.227 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295716 1086398672 /nfs/dbraw/zinc/39/86/72/1086398672.db2.gz HYEVVSGHLTXEBF-WMLDXEAASA-N 2 0 374.916 4.163 20 0 FIADRP C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327350 1086417927 /nfs/dbraw/zinc/41/79/27/1086417927.db2.gz OEZJSBINPPYJCC-HNNXBMFYSA-N 2 0 372.944 4.471 20 0 FIADRP CC(C)c1cccc(C[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c1 ZINC000662327268 1086418302 /nfs/dbraw/zinc/41/83/02/1086418302.db2.gz LQQFVASRROJZPV-UHFFFAOYSA-N 2 0 366.553 4.380 20 0 FIADRP C[C@H](c1c(F)cccc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662328743 1086418408 /nfs/dbraw/zinc/41/84/08/1086418408.db2.gz UOSZROVCEAWXRP-CQSZACIVSA-N 2 0 374.479 4.096 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662328005 1086418913 /nfs/dbraw/zinc/41/89/13/1086418913.db2.gz XOPYXSLRPDQKTG-OAHLLOKOSA-N 2 0 372.944 4.471 20 0 FIADRP O=C(C[C@H]1[NH2+]Cc2ccccc21)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000662417837 1086434462 /nfs/dbraw/zinc/43/44/62/1086434462.db2.gz WXWORUTXPLNGQD-JOCHJYFZSA-N 2 0 363.505 4.236 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(CN(C)C(=O)OC(C)(C)C)CC1 ZINC001167827431 1086625582 /nfs/dbraw/zinc/62/55/82/1086625582.db2.gz VVUHNZAQYKXXDY-GOSISDBHSA-N 2 0 369.594 4.076 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2cccs2)cc1 ZINC000150952651 1086632370 /nfs/dbraw/zinc/63/23/70/1086632370.db2.gz PSTMXFXKHMKHHY-QGZVFWFLSA-N 2 0 357.567 4.092 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@H]1c1cccc(OC)c1 ZINC001167833644 1086671007 /nfs/dbraw/zinc/67/10/07/1086671007.db2.gz CUQOQHKAGRFKSK-PXNSSMCTSA-N 2 0 350.572 4.296 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCc2ccc(OC(F)(F)F)cc2C1 ZINC001167840021 1086719775 /nfs/dbraw/zinc/71/97/75/1086719775.db2.gz DHECHADXYFMVRM-OAHLLOKOSA-N 2 0 358.448 4.454 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)CC[NH+](C)CC1 ZINC000569630505 1086726973 /nfs/dbraw/zinc/72/69/73/1086726973.db2.gz YGSVUWVUIDXSHQ-SJLPKXTDSA-N 2 0 352.975 4.393 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001167840638 1086727097 /nfs/dbraw/zinc/72/70/97/1086727097.db2.gz GTRBSUDCOGVCPM-HXUWFJFHSA-N 3 0 351.623 4.331 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCCO1 ZINC000432413227 1086735948 /nfs/dbraw/zinc/73/59/48/1086735948.db2.gz LMBGGSLROUUIKV-BEFAXECRSA-N 2 0 370.459 4.247 20 0 FIADRP CC(C)(C)OC1CC(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000432425783 1086752830 /nfs/dbraw/zinc/75/28/30/1086752830.db2.gz NPYAXAZCRNXDNI-ZWUBBELISA-N 2 0 370.581 4.470 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)N1CCCC2=C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]21 ZINC001167842929 1086761093 /nfs/dbraw/zinc/76/10/93/1086761093.db2.gz ZRXBEUOXMBUORM-ISBMVONUSA-N 2 0 373.629 4.392 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CCC([NH3+])CC2)CCC3)cc1 ZINC000583558868 1086795459 /nfs/dbraw/zinc/79/54/59/1086795459.db2.gz QNAOOPMYVWAOQH-DQPZFDDXSA-N 2 0 357.523 4.056 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]Cc2ccccc2C[NH2+]C)cc1OC ZINC000650718184 1086803038 /nfs/dbraw/zinc/80/30/38/1086803038.db2.gz BCBNQIAPPPJCIS-UHFFFAOYSA-N 2 0 362.901 4.147 20 0 FIADRP Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)s1 ZINC000606471143 1086844003 /nfs/dbraw/zinc/84/40/03/1086844003.db2.gz AJGWUUJVSHVSQK-QGZVFWFLSA-N 2 0 358.551 4.252 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000650747210 1086934932 /nfs/dbraw/zinc/93/49/32/1086934932.db2.gz URVQOJBYRVXURF-SFHVURJKSA-N 2 0 359.311 4.257 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3c(Br)cccc32)c(F)c1 ZINC000650754196 1086960231 /nfs/dbraw/zinc/96/02/31/1086960231.db2.gz CVKMTEPVZKLVHK-SFHVURJKSA-N 2 0 363.274 4.214 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2-c2ccc(C)o2)CC1)CC1CC1 ZINC000536139440 1086982878 /nfs/dbraw/zinc/98/28/78/1086982878.db2.gz DXXOZBLMNHIHGF-UHFFFAOYSA-N 2 0 370.541 4.312 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cncc(Br)c1 ZINC000657838494 1087250170 /nfs/dbraw/zinc/25/01/70/1087250170.db2.gz BRWLJCREZFLJAT-BZUAXINKSA-N 2 0 368.363 4.253 20 0 FIADRP Cc1cc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)ccc1Oc1cccnc1 ZINC000584343865 1087273168 /nfs/dbraw/zinc/27/31/68/1087273168.db2.gz QAOGSRKRMOVWMW-OAQYLSRUSA-N 2 0 365.521 4.346 20 0 FIADRP C[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1nc(-c2ccccc2)no1 ZINC000090911597 1087410734 /nfs/dbraw/zinc/41/07/34/1087410734.db2.gz UPMZRVIACDMHOI-QGZVFWFLSA-N 2 0 368.525 4.227 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000091285160 1087427225 /nfs/dbraw/zinc/42/72/25/1087427225.db2.gz BVIAZZKWCAVVCL-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4cccc5cnccc54)C3)C2)cc1 ZINC000685443012 1087569744 /nfs/dbraw/zinc/56/97/44/1087569744.db2.gz HZSWUVHBIJCNCU-DEOSSOPVSA-N 2 0 357.501 4.333 20 0 FIADRP C[C@@H](CCSc1ccccc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000431599827 1087597032 /nfs/dbraw/zinc/59/70/32/1087597032.db2.gz KBAUVHMERLCHJZ-IBGZPJMESA-N 2 0 362.583 4.134 20 0 FIADRP CC[NH+](C/C=C/C[N@@H+](CC)[C@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685589917 1087634697 /nfs/dbraw/zinc/63/46/97/1087634697.db2.gz AEFZJLHSTRAIRH-COJYZCGHSA-N 2 0 366.590 4.102 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1O ZINC000685649175 1087656754 /nfs/dbraw/zinc/65/67/54/1087656754.db2.gz CCLYFYQHCPYIOO-KURKYZTESA-N 2 0 368.521 4.208 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)cc2)cc1 ZINC000511319022 1087679543 /nfs/dbraw/zinc/67/95/43/1087679543.db2.gz BWGICCBZIMDSSU-UHFFFAOYSA-N 2 0 353.510 4.232 20 0 FIADRP CCOC1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000657970521 1087683209 /nfs/dbraw/zinc/68/32/09/1087683209.db2.gz FNEOXJNFXCLEER-TTWXDQCFSA-N 2 0 356.554 4.224 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068973 1087710477 /nfs/dbraw/zinc/71/04/77/1087710477.db2.gz BTTCHCPSKWEPHX-LJQANCHMSA-N 2 0 374.569 4.407 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc(F)ccc1F ZINC000658134546 1087728077 /nfs/dbraw/zinc/72/80/77/1087728077.db2.gz BGCZWMRGJAFLNG-DENIHFKCSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc2ccccc2c1 ZINC000658147228 1087738454 /nfs/dbraw/zinc/73/84/54/1087738454.db2.gz XJPLDLDNVGOSLW-KOSHJBKYSA-N 2 0 360.501 4.257 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000424129720 1087800008 /nfs/dbraw/zinc/80/00/08/1087800008.db2.gz GODPPXKISHEFMW-UHFFFAOYSA-N 2 0 362.521 4.482 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(Cl)c1 ZINC000424257737 1087879513 /nfs/dbraw/zinc/87/95/13/1087879513.db2.gz BNZYHWJPEUUBFQ-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP Cc1cc(C[N@H+]2CCCC23CC[NH+](C)CC3)ccc1Oc1cccnc1 ZINC000472596110 1087979731 /nfs/dbraw/zinc/97/97/31/1087979731.db2.gz KFFQRZZEXVBPKU-UHFFFAOYSA-N 2 0 351.494 4.243 20 0 FIADRP FC(F)(F)C1=CC[NH+](CCCC[N@H+]2CC=C(C(F)(F)F)CC2)CC1 ZINC000536537529 1088094111 /nfs/dbraw/zinc/09/41/11/1088094111.db2.gz HSZMSPRLZXOPJH-UHFFFAOYSA-N 2 0 356.354 4.155 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Br)c(Cl)s2)cc1 ZINC000414806446 1088153894 /nfs/dbraw/zinc/15/38/94/1088153894.db2.gz BTFSHWXAUGTNGA-SECBINFHSA-N 2 0 359.720 4.474 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000414808104 1088178923 /nfs/dbraw/zinc/17/89/23/1088178923.db2.gz KCARCKXLSAHBNN-INIZCTEOSA-N 2 0 357.929 4.114 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)nc1 ZINC000423375654 1088181132 /nfs/dbraw/zinc/18/11/32/1088181132.db2.gz UOKGXUXBKOPVLY-FCEUIQTBSA-N 2 0 371.956 4.311 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000414808551 1088182754 /nfs/dbraw/zinc/18/27/54/1088182754.db2.gz KZNBQNIJXIKOQT-CQSZACIVSA-N 2 0 374.410 4.201 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]Cc3ccc([C@@H](C)[NH3+])cc3)cc2)cs1 ZINC000414812308 1088222422 /nfs/dbraw/zinc/22/24/22/1088222422.db2.gz QZXZZXGONDWKSW-OAHLLOKOSA-N 2 0 367.518 4.340 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000414812616 1088224654 /nfs/dbraw/zinc/22/46/54/1088224654.db2.gz XOFSAXOAQGSOKR-JXFKEZNVSA-N 2 0 371.912 4.199 20 0 FIADRP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414815567 1088244068 /nfs/dbraw/zinc/24/40/68/1088244068.db2.gz XQESNTDGUSOJER-KRWDZBQOSA-N 2 0 362.521 4.166 20 0 FIADRP COC(=O)c1csc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000514084237 1088727182 /nfs/dbraw/zinc/72/71/82/1088727182.db2.gz OYRZOLAYQFTGTM-INIZCTEOSA-N 2 0 372.534 4.371 20 0 FIADRP CCO[C@@H](C)c1nc(CN2CCC(c3ncc4n3CCCC4)CC2)cs1 ZINC000434675412 1088942385 /nfs/dbraw/zinc/94/23/85/1088942385.db2.gz YPNGIOPKGIZDPO-HNNXBMFYSA-N 2 0 374.554 4.153 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccccc2-c2ccnn2C)c1 ZINC000509986325 1088962192 /nfs/dbraw/zinc/96/21/92/1088962192.db2.gz KGRHDEFHBILBQW-UHFFFAOYSA-N 2 0 362.521 4.219 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000415011005 1089038543 /nfs/dbraw/zinc/03/85/43/1089038543.db2.gz VPYQTTFREJAAHH-QMTHXVAHSA-N 2 0 354.338 4.331 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415044161 1089080818 /nfs/dbraw/zinc/08/08/18/1089080818.db2.gz AKLMUWTZMMMUSC-NRFANRHFSA-N 2 0 368.912 4.404 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 ZINC000415053334 1089084446 /nfs/dbraw/zinc/08/44/46/1089084446.db2.gz MNNSALUTZKGAPT-KRWDZBQOSA-N 2 0 370.390 4.337 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cn1 ZINC000415050570 1089088064 /nfs/dbraw/zinc/08/80/64/1089088064.db2.gz IMLZAHYTNSHQGV-JOCHJYFZSA-N 2 0 360.505 4.419 20 0 FIADRP COc1c(Br)cccc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415044671 1089092083 /nfs/dbraw/zinc/09/20/83/1089092083.db2.gz AWAXILWYZZSCRJ-QGZVFWFLSA-N 2 0 363.299 4.028 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cccc(OCC(F)(F)F)c1)c1ccccc1 ZINC000415060356 1089095277 /nfs/dbraw/zinc/09/52/77/1089095277.db2.gz WMDBYQMCQJAVGV-GOSISDBHSA-N 2 0 352.400 4.198 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(F)cc1Br)c1ccccc1 ZINC000415053921 1089098044 /nfs/dbraw/zinc/09/80/44/1089098044.db2.gz NBKYSZSTBPUIEN-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000415080264 1089135781 /nfs/dbraw/zinc/13/57/81/1089135781.db2.gz JDIJINLUOGXWOK-PBHICJAKSA-N 2 0 370.368 4.078 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC2CC[NH2+]CC2)c2cc(F)ccc2F)c1 ZINC000415085601 1089145172 /nfs/dbraw/zinc/14/51/72/1089145172.db2.gz SVSPFRIFQWERFL-FQEVSTJZSA-N 2 0 362.489 4.365 20 0 FIADRP C[C@H]1C[C@H](C[NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[NH2+]1 ZINC000415087262 1089148610 /nfs/dbraw/zinc/14/86/10/1089148610.db2.gz KTATWNNAQQQQLQ-LSDHHAIUSA-N 2 0 371.352 4.019 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCN[C@H](c4ccccc4)C3)CC2)CC1 ZINC000415095978 1089153368 /nfs/dbraw/zinc/15/33/68/1089153368.db2.gz AEBMWSMYHXMXKI-KRLBEQFCSA-N 2 0 355.570 4.112 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]3CCC[NH2+]C3)s2)cc1 ZINC000415097799 1089158589 /nfs/dbraw/zinc/15/85/89/1089158589.db2.gz DNJJYUMAVSDDOL-ZQIUZPCESA-N 2 0 359.539 4.166 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3F)CC2)C1 ZINC000415122058 1089185271 /nfs/dbraw/zinc/18/52/71/1089185271.db2.gz JIQTXVFHZFMEBC-GMAHTHKFSA-N 2 0 368.496 4.211 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(Oc4ccccc4)c3)CC2)C1 ZINC000415127751 1089192200 /nfs/dbraw/zinc/19/22/00/1089192200.db2.gz REGKODGULOETFB-NFBKMPQASA-N 2 0 366.505 4.197 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)C1 ZINC000415129584 1089192975 /nfs/dbraw/zinc/19/29/75/1089192975.db2.gz VFXSBRGNRYBAOK-AZUAARDMSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000415130368 1089194923 /nfs/dbraw/zinc/19/49/23/1089194923.db2.gz QSEPIWWVGYYSDW-CTNGQTDRSA-N 2 0 374.525 4.273 20 0 FIADRP CCC[C@@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000415135702 1089197626 /nfs/dbraw/zinc/19/76/26/1089197626.db2.gz QICRAWWMLZMNLV-QHCPKHFHSA-N 2 0 365.565 4.153 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000415139374 1089200786 /nfs/dbraw/zinc/20/07/86/1089200786.db2.gz ZNFMHMQEYFVUBI-CTNGQTDRSA-N 2 0 374.525 4.273 20 0 FIADRP C[NH+](C)[C@@H]1CCOc2c(N[C@H]3CCC[N@H+](Cc4ccccc4)C3)cccc21 ZINC000435023453 1089210069 /nfs/dbraw/zinc/21/00/69/1089210069.db2.gz KKONVTUCWYMUMP-SIKLNZKXSA-N 2 0 365.521 4.148 20 0 FIADRP CC[NH+](CC)CCOc1ccc(NC(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000415183567 1089254527 /nfs/dbraw/zinc/25/45/27/1089254527.db2.gz NPWWXQLCNRQRBE-INIZCTEOSA-N 2 0 370.497 4.071 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000514602037 1089257520 /nfs/dbraw/zinc/25/75/20/1089257520.db2.gz DJSNIDXZKDSVKJ-UGKGYDQZSA-N 2 0 374.532 4.158 20 0 FIADRP Cc1ccccc1[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccncc1 ZINC001167958518 1089462963 /nfs/dbraw/zinc/46/29/63/1089462963.db2.gz GPSXWTIURXFHAW-IFBIMPTNSA-N 2 0 361.533 4.474 20 0 FIADRP CCC(CC)(CNC(=O)c1ccc([C@H](C)[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000514789613 1089471096 /nfs/dbraw/zinc/47/10/96/1089471096.db2.gz MFZXAZBQILXFFG-ZWKOTPCHSA-N 2 0 367.537 4.346 20 0 FIADRP C[C@H]1C[C@H](C[NH3+])CN1Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435374809 1089566846 /nfs/dbraw/zinc/56/68/46/1089566846.db2.gz YOWMZTHOFFTAGI-LSDHHAIUSA-N 2 0 360.933 4.128 20 0 FIADRP CSC1(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)CC[NH+](C)CC1 ZINC000515256553 1089932589 /nfs/dbraw/zinc/93/25/89/1089932589.db2.gz BHVCCKHYTXLXCP-UHFFFAOYSA-N 2 0 366.880 4.276 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)NC[C@H](c1ccccc1)[NH+](CC)CC ZINC000415941073 1090016345 /nfs/dbraw/zinc/01/63/45/1090016345.db2.gz GFNHWHKKAVFPSA-OAQYLSRUSA-N 2 0 368.525 4.001 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000500278663 1091205434 /nfs/dbraw/zinc/20/54/34/1091205434.db2.gz HTUPEDGHEJOBFD-UHFFFAOYSA-N 2 0 358.448 4.138 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390551001 1091244134 /nfs/dbraw/zinc/24/41/34/1091244134.db2.gz KCGCMNGZXRCDHD-DNKMKRHMSA-N 2 0 355.570 4.082 20 0 FIADRP Cn1c(=O)ccc2c1CCC[C@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000652074989 1091325717 /nfs/dbraw/zinc/32/57/17/1091325717.db2.gz WZNWHNVHUQGPNR-LJQANCHMSA-N 2 0 373.585 4.032 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388542631 1091508962 /nfs/dbraw/zinc/50/89/62/1091508962.db2.gz RSXFTXKBFWWFQN-UGKGYDQZSA-N 2 0 352.522 4.128 20 0 FIADRP c1c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2n1Cc1ccccc1 ZINC000590612027 1091608907 /nfs/dbraw/zinc/60/89/07/1091608907.db2.gz UZZLBNNHPILMQW-FCHUYYIVSA-N 2 0 359.517 4.406 20 0 FIADRP C[NH+](C)Cc1ccc(C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000511768949 1091660167 /nfs/dbraw/zinc/66/01/67/1091660167.db2.gz OQZZSCSLEKZXES-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP Cc1ccc(CCC[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1 ZINC000544142015 1091764763 /nfs/dbraw/zinc/76/47/63/1091764763.db2.gz NDXHAJVZKOOWIF-UHFFFAOYSA-N 2 0 371.613 4.056 20 0 FIADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000187279911 1091863752 /nfs/dbraw/zinc/86/37/52/1091863752.db2.gz AIQAGTBLVLDNPK-XMMPIXPASA-N 2 0 366.549 4.000 20 0 FIADRP CCN1CCC([NH2+][C@H](C)C[C@H]2CCCCCN2C(=O)OC(C)(C)C)CC1 ZINC000236859638 1092069751 /nfs/dbraw/zinc/06/97/51/1092069751.db2.gz PORMDSNBODFSPR-IEBWSBKVSA-N 2 0 367.578 4.019 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000521043696 1092442664 /nfs/dbraw/zinc/44/26/64/1092442664.db2.gz HSCYQSIVNPZOHM-KNQAVFIVSA-N 2 0 374.532 4.076 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCC2 ZINC000447565080 1092662684 /nfs/dbraw/zinc/66/26/84/1092662684.db2.gz IPLGFFIKKODLMG-IBGZPJMESA-N 2 0 363.343 4.291 20 0 FIADRP CCOc1ccc(C[N@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)C(C)C)cc1 ZINC000544348449 1092785779 /nfs/dbraw/zinc/78/57/79/1092785779.db2.gz MNHKXIPYTIZOFO-UHFFFAOYSA-N 2 0 364.493 4.385 20 0 FIADRP c1cc2cc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)ccc2[nH]1 ZINC000442820260 1092788866 /nfs/dbraw/zinc/78/88/66/1092788866.db2.gz KFBODLBSQYMZQM-WPFOTENUSA-N 2 0 359.517 4.211 20 0 FIADRP COCCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000442865498 1092812680 /nfs/dbraw/zinc/81/26/80/1092812680.db2.gz UCMCIGGDJAAAAT-NZQKXSOJSA-N 2 0 370.512 4.405 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1 ZINC000443062315 1092925157 /nfs/dbraw/zinc/92/51/57/1092925157.db2.gz UKORVFGXLCQIMZ-UGKGYDQZSA-N 2 0 365.521 4.044 20 0 FIADRP C[C@@H]1CC[C@H](C)[N@H+]1Cc1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000443088344 1092932414 /nfs/dbraw/zinc/93/24/14/1092932414.db2.gz AKYNLNMRQOPBLA-CALCHBBNSA-N 2 0 354.498 4.095 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+](C)C)cc1 ZINC000521834087 1092946390 /nfs/dbraw/zinc/94/63/90/1092946390.db2.gz MSDWTDCCHUYKIG-UHFFFAOYSA-N 2 0 362.521 4.279 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000474042935 1093036983 /nfs/dbraw/zinc/03/69/83/1093036983.db2.gz FJEJFZDGEYSNBS-RJGXRXQPSA-N 2 0 356.554 4.357 20 0 FIADRP Cc1cccc(OCC[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168018202 1093164720 /nfs/dbraw/zinc/16/47/20/1093164720.db2.gz YWPSSAPWSGNQEX-VTYHHJSWSA-N 2 0 352.522 4.405 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3[C@H]3CCOC3)CC2)c1 ZINC000474069754 1093181355 /nfs/dbraw/zinc/18/13/55/1093181355.db2.gz ZAKFAYLSLVINHW-CEWLAPEOSA-N 2 0 362.583 4.145 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474071850 1093186111 /nfs/dbraw/zinc/18/61/11/1093186111.db2.gz GFIFIYOVULCAHT-MRXNPFEDSA-N 2 0 370.368 4.425 20 0 FIADRP C[C@H](C[NH+]1CCC(C)CC1)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168020207 1093202011 /nfs/dbraw/zinc/20/20/11/1093202011.db2.gz LJSFXNJUKPNKCN-CUDBPUKSSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@H](O)C[NH+]1CCC(C[N@H+](C)[C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000443584875 1093284779 /nfs/dbraw/zinc/28/47/79/1093284779.db2.gz TXGNBUYMPFWZCA-DJJJIMSYSA-N 2 0 371.352 4.005 20 0 FIADRP CC[C@H](C)Sc1ccc(NC(=O)CCC[NH+]2CCC([NH3+])CC2)c(C)c1 ZINC000433129289 1093304891 /nfs/dbraw/zinc/30/48/91/1093304891.db2.gz DAQJHLISPGJSIE-INIZCTEOSA-N 2 0 363.571 4.027 20 0 FIADRP CCc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443603049 1093320082 /nfs/dbraw/zinc/32/00/82/1093320082.db2.gz QFMRRJDAWOOGRA-LJQANCHMSA-N 2 0 371.569 4.164 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1c(C)nn(C)c1C ZINC000411518283 1093349752 /nfs/dbraw/zinc/34/97/52/1093349752.db2.gz OWIXIYPKXWJBDR-NRFANRHFSA-N 2 0 354.542 4.264 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CCc3ccc(O)cc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168030226 1093575754 /nfs/dbraw/zinc/57/57/54/1093575754.db2.gz UXVMJCWOHMCJGA-JBYIUTFZSA-N 2 0 364.533 4.281 20 0 FIADRP C[C@H](Cc1cccc(O)c1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168031378 1093623799 /nfs/dbraw/zinc/62/37/99/1093623799.db2.gz YVXHRYACVWMSIA-NXWNEQKCSA-N 2 0 352.522 4.354 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3CCC[C@@H](c4ccccc4)N3)n2)cc1 ZINC001211884880 1093631094 /nfs/dbraw/zinc/63/10/94/1093631094.db2.gz ICKYJEUEVBLSBE-VQTJNVASSA-N 2 0 362.477 4.354 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000163582367 1093683516 /nfs/dbraw/zinc/68/35/16/1093683516.db2.gz BSUYMNOVLQINKK-UHFFFAOYSA-N 2 0 363.977 4.014 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000513063790 1093715367 /nfs/dbraw/zinc/71/53/67/1093715367.db2.gz IPMSNMKPHANNDL-LAUBAEHRSA-N 2 0 365.496 4.492 20 0 FIADRP Cc1cccnc1C1(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168033997 1093728548 /nfs/dbraw/zinc/72/85/48/1093728548.db2.gz NXLNHXIGCBVSDS-PMACEKPBSA-N 2 0 363.549 4.453 20 0 FIADRP FC(F)(F)c1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647793965 1093808869 /nfs/dbraw/zinc/80/88/69/1093808869.db2.gz NGGWEDHEDGMWAO-CMQWMLGXSA-N 2 0 352.444 4.319 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccc(F)cc1 ZINC000474482135 1093829062 /nfs/dbraw/zinc/82/90/62/1093829062.db2.gz XJNDURUSMNGYCM-UHFFFAOYSA-N 2 0 366.484 4.143 20 0 FIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000474484353 1093831711 /nfs/dbraw/zinc/83/17/11/1093831711.db2.gz IEVBKYZZPPGYLX-RTBURBONSA-N 2 0 354.542 4.232 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1OC ZINC000474484541 1093831841 /nfs/dbraw/zinc/83/18/41/1093831841.db2.gz KOEMSMHQCJYNPG-DLBZAZTESA-N 2 0 356.510 4.047 20 0 FIADRP Cc1noc2ncc(C[NH2+]Cc3ccccc3C[N@H+]3CCCC[C@@H]3C)cc12 ZINC000894179358 1093889516 /nfs/dbraw/zinc/88/95/16/1093889516.db2.gz QWOJSXRGXZOOBQ-INIZCTEOSA-N 2 0 364.493 4.195 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccc(F)cc34)CC2)C1 ZINC000513233813 1094014839 /nfs/dbraw/zinc/01/48/39/1094014839.db2.gz OYDRFVJUGQTKOO-JXFKEZNVSA-N 2 0 357.517 4.482 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000513337689 1094063937 /nfs/dbraw/zinc/06/39/37/1094063937.db2.gz JMDUIDIDWBMCCU-FGGAIWKESA-N 2 0 364.533 4.348 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1-n1cccn1 ZINC000513341087 1094065898 /nfs/dbraw/zinc/06/58/98/1094065898.db2.gz QFFOVSRLLYRWJN-SFHVURJKSA-N 2 0 352.526 4.320 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000513350410 1094073548 /nfs/dbraw/zinc/07/35/48/1094073548.db2.gz HSWGNYLHCNHDKB-BAMDZGJYSA-N 2 0 369.597 4.282 20 0 FIADRP Cc1ccc2ncc(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)n2c1 ZINC000513500296 1094172735 /nfs/dbraw/zinc/17/27/35/1094172735.db2.gz LTEXZIYGTUBQON-CTNGQTDRSA-N 2 0 362.521 4.033 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc(OC)c1 ZINC000513501432 1094173971 /nfs/dbraw/zinc/17/39/71/1094173971.db2.gz SXWIVGYXQSOPIV-AZUAARDMSA-N 2 0 368.521 4.094 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccc(F)cc2)cc1 ZINC000513685124 1094275094 /nfs/dbraw/zinc/27/50/94/1094275094.db2.gz XJYYYGUOLLMZAT-AOMIVXANSA-N 2 0 356.485 4.386 20 0 FIADRP COC[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000513697690 1094364851 /nfs/dbraw/zinc/36/48/51/1094364851.db2.gz QPADGZRMJSTAAV-XPPIMPSXSA-N 2 0 352.522 4.407 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000501063679 1094475142 /nfs/dbraw/zinc/47/51/42/1094475142.db2.gz KLXLFZAEKUTMLE-PXNSSMCTSA-N 2 0 372.553 4.385 20 0 FIADRP CCOC(=O)C[C@@H]1CCC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039987 1094483091 /nfs/dbraw/zinc/48/30/91/1094483091.db2.gz JJSUWNLTJYZJFD-ZJOUEHCJSA-N 2 0 372.553 4.093 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000501137697 1094525116 /nfs/dbraw/zinc/52/51/16/1094525116.db2.gz WJDKYVMIUPTRIT-INIZCTEOSA-N 2 0 372.384 4.402 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000474716551 1094537674 /nfs/dbraw/zinc/53/76/74/1094537674.db2.gz YCDRLXMZPNDWKV-MSOLQXFVSA-N 2 0 370.537 4.437 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000474716554 1094538227 /nfs/dbraw/zinc/53/82/27/1094538227.db2.gz YCDRLXMZPNDWKV-ROUUACIJSA-N 2 0 370.537 4.437 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)[C@H](C)C1CCCCC1 ZINC000474798625 1094616272 /nfs/dbraw/zinc/61/62/72/1094616272.db2.gz DJZCNHQQUKCDTK-RBUKOAKNSA-N 2 0 358.570 4.338 20 0 FIADRP CCOC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000474815326 1094661235 /nfs/dbraw/zinc/66/12/35/1094661235.db2.gz FHJAKBYWFABVLU-RBBKRZOGSA-N 2 0 356.510 4.206 20 0 FIADRP CCC1(C[NH2+]Cc2ccnn2C(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000474884790 1094849911 /nfs/dbraw/zinc/84/99/11/1094849911.db2.gz FHPRGYHGWXWNLR-UHFFFAOYSA-N 2 0 354.542 4.246 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OC ZINC000474893880 1094862427 /nfs/dbraw/zinc/86/24/27/1094862427.db2.gz ZRSMVOSDPWVSCY-SJORKVTESA-N 2 0 356.510 4.047 20 0 FIADRP Cc1nc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)oc1-c1ccc(Cl)cc1 ZINC000420341811 1094884736 /nfs/dbraw/zinc/88/47/36/1094884736.db2.gz WAWOHLXHDILCKY-SFHVURJKSA-N 2 0 359.901 4.267 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000501779316 1094922561 /nfs/dbraw/zinc/92/25/61/1094922561.db2.gz WAKLLPATQICXDE-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2cc(F)ccc2F)CC1 ZINC000501817301 1094934780 /nfs/dbraw/zinc/93/47/80/1094934780.db2.gz SJCPKLUNSCIYAX-MRXNPFEDSA-N 2 0 354.485 4.096 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)CC1 ZINC000501982844 1095035737 /nfs/dbraw/zinc/03/57/37/1095035737.db2.gz VYRUBZVJKBXKCM-VXNXHJTFSA-N 2 0 369.597 4.061 20 0 FIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000522551461 1095135982 /nfs/dbraw/zinc/13/59/82/1095135982.db2.gz JMFPAPRULWVHFO-DENIHFKCSA-N 2 0 357.586 4.147 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CCC(OC3CCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168046562 1095204345 /nfs/dbraw/zinc/20/43/45/1095204345.db2.gz OBZDRYGYSOZWJD-CEQLMSFQSA-N 2 0 356.554 4.462 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCCC23CCOCC3)cc1 ZINC000502254653 1095274267 /nfs/dbraw/zinc/27/42/67/1095274267.db2.gz NVPPJGPGUNJRRB-SIKLNZKXSA-N 2 0 356.554 4.500 20 0 FIADRP CCC1(C[NH2+][C@@H](C)c2cc(C)n(C)n2)CC[NH+](Cc2ccccc2)CC1 ZINC000502427480 1095465469 /nfs/dbraw/zinc/46/54/69/1095465469.db2.gz IRGPAPHJVQNBGD-IBGZPJMESA-N 2 0 354.542 4.072 20 0 FIADRP Cc1ccc(C[NH2+]Cc2cccc(CN3CCO[C@H](C)C3)c2)cc1Cl ZINC000443979514 1095568015 /nfs/dbraw/zinc/56/80/15/1095568015.db2.gz OQDBRAMARDKDND-QGZVFWFLSA-N 2 0 358.913 4.159 20 0 FIADRP C[NH+](C)C1CCC([NH2+]C2CC(c3ccc(Br)cc3F)C2)CC1 ZINC000421383617 1095587445 /nfs/dbraw/zinc/58/74/45/1095587445.db2.gz ZPOAKRAUNPCHTR-UHFFFAOYSA-N 2 0 369.322 4.297 20 0 FIADRP CCC(CC)[C@@H]([NH2+]C1CCN(C[C@H]2CCCO2)CC1)c1cccs1 ZINC000655703669 1095921665 /nfs/dbraw/zinc/92/16/65/1095921665.db2.gz SVQAMIDELJTTBA-UYAOXDASSA-N 2 0 350.572 4.458 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccncc1Cl ZINC000421855435 1095957079 /nfs/dbraw/zinc/95/70/79/1095957079.db2.gz NANFHZPMONBUFE-OAHLLOKOSA-N 2 0 359.901 4.059 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000421872408 1095982112 /nfs/dbraw/zinc/98/21/12/1095982112.db2.gz GTZLFFDXXUIJED-QWQCLYJRSA-N 2 0 355.295 4.038 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000503074293 1096052513 /nfs/dbraw/zinc/05/25/13/1096052513.db2.gz QJOPOUFOBPDRHL-AZUAARDMSA-N 2 0 374.573 4.246 20 0 FIADRP C[N@H+](Cc1cccc(OCc2ccc(F)cc2)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414652165 1096342884 /nfs/dbraw/zinc/34/28/84/1096342884.db2.gz GGIFXZKJIOEWKV-WCRBZPEASA-N 2 0 354.469 4.120 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(c2ccc(Br)cc2)CC1 ZINC000503377167 1096378184 /nfs/dbraw/zinc/37/81/84/1096378184.db2.gz PILOTVOSGIAURN-GOSISDBHSA-N 2 0 351.332 4.113 20 0 FIADRP COCC[C@H](c1ccccc1)[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503428741 1096394776 /nfs/dbraw/zinc/39/47/76/1096394776.db2.gz HWXRJOBXUYDVNE-PZJWPPBQSA-N 2 0 353.510 4.177 20 0 FIADRP Clc1ccccc1OCC[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503434927 1096398813 /nfs/dbraw/zinc/39/88/13/1096398813.db2.gz LJCZSRRGYUUNSW-MRXNPFEDSA-N 2 0 359.901 4.131 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000422730555 1096463852 /nfs/dbraw/zinc/46/38/52/1096463852.db2.gz KABKFCJFLZZLSU-KRWDZBQOSA-N 2 0 361.489 4.279 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000422730677 1096463914 /nfs/dbraw/zinc/46/39/14/1096463914.db2.gz FDXQWCQFSBSEOQ-HZPDHXFCSA-N 2 0 355.526 4.264 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000422730675 1096464201 /nfs/dbraw/zinc/46/42/01/1096464201.db2.gz FDXQWCQFSBSEOQ-CVEARBPZSA-N 2 0 355.526 4.264 20 0 FIADRP C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 ZINC000422747203 1096480942 /nfs/dbraw/zinc/48/09/42/1096480942.db2.gz PMCLBCJLKAMUGC-HGSOSGBHSA-N 2 0 355.570 4.112 20 0 FIADRP c1sc2ccccc2c1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422751870 1096482884 /nfs/dbraw/zinc/48/28/84/1096482884.db2.gz DDNCJEOPQLJYFI-GHTZIAJQSA-N 2 0 350.487 4.247 20 0 FIADRP Fc1ccc(SCCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422771999 1096487551 /nfs/dbraw/zinc/48/75/51/1096487551.db2.gz XSQACCBZEZVVKL-CTNGQTDRSA-N 2 0 372.509 4.153 20 0 FIADRP CCC(CC)(CN[C@H](C)c1ccc(C[NH3+])nc1C)[NH2+][C@@H](C)c1ccccc1 ZINC000422772638 1096487872 /nfs/dbraw/zinc/48/78/72/1096487872.db2.gz XHRNQRNPOJVJHL-ZWKOTPCHSA-N 2 0 368.569 4.409 20 0 FIADRP CCC(CC)(CN[C@@H](C)c1ccc(C[NH3+])nc1C)[NH2+][C@@H](C)c1ccccc1 ZINC000422772636 1096487919 /nfs/dbraw/zinc/48/79/19/1096487919.db2.gz XHRNQRNPOJVJHL-ROUUACIJSA-N 2 0 368.569 4.409 20 0 FIADRP FC(F)(F)c1ccccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422776063 1096489096 /nfs/dbraw/zinc/48/90/96/1096489096.db2.gz CBDHJEJFHPHNTB-HKUYNNGSSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1OC ZINC000422781445 1096490305 /nfs/dbraw/zinc/49/03/05/1096490305.db2.gz KQBKOIGDLDABOZ-HLIPFELVSA-N 2 0 356.510 4.011 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1OC(F)F ZINC000422809902 1096497331 /nfs/dbraw/zinc/49/73/31/1096497331.db2.gz SQWVPFXEQCKPCU-XXHMAFKTSA-N 2 0 374.431 4.195 20 0 FIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422815004 1096498479 /nfs/dbraw/zinc/49/84/79/1096498479.db2.gz ALRKEUQRCWZNBA-VYCZESIESA-N 2 0 368.443 4.201 20 0 FIADRP COc1ccc2ccccc2c1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422813547 1096498509 /nfs/dbraw/zinc/49/85/09/1096498509.db2.gz ZNPNXIVIPIJCSO-URXFXBBRSA-N 2 0 374.484 4.194 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422825975 1096500906 /nfs/dbraw/zinc/50/09/06/1096500906.db2.gz QKTSJILOYOXJMG-GFCCVEGCSA-N 2 0 352.309 4.439 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000422855854 1096505504 /nfs/dbraw/zinc/50/55/04/1096505504.db2.gz FLOWQKRUZOWOGW-ZWKOTPCHSA-N 3 0 366.553 4.074 20 0 FIADRP Cc1cccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422858896 1096506776 /nfs/dbraw/zinc/50/67/76/1096506776.db2.gz JFFXPWUVQSOMEJ-FDFHNCONSA-N 2 0 366.505 4.034 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)Cc1ccc(Cl)cc1Cl ZINC000422862517 1096506870 /nfs/dbraw/zinc/50/68/70/1096506870.db2.gz PXDSEGPLFJWIJF-VXGBXAGGSA-N 2 0 352.309 4.437 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(OC(F)F)c1 ZINC000422876600 1096510105 /nfs/dbraw/zinc/51/01/05/1096510105.db2.gz GMTRUSIWBWJSRR-FIKMYACPSA-N 2 0 374.431 4.195 20 0 FIADRP CCC(CC)(C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000422879531 1096510760 /nfs/dbraw/zinc/51/07/60/1096510760.db2.gz MIWHVNJFTVYURV-XUVXKRRUSA-N 2 0 364.961 4.145 20 0 FIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422884097 1096512387 /nfs/dbraw/zinc/51/23/87/1096512387.db2.gz WDTYBXVIRFCHSV-ZWKOTPCHSA-N 2 0 371.352 4.291 20 0 FIADRP Cc1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(OC(C)C)c1 ZINC000422872335 1096517173 /nfs/dbraw/zinc/51/71/73/1096517173.db2.gz GQYOIQGMPLYMFM-NZQKXSOJSA-N 2 0 366.505 4.128 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000422874195 1096517515 /nfs/dbraw/zinc/51/75/15/1096517515.db2.gz CGCVMMYVGXBXSX-SJORKVTESA-N 2 0 371.500 4.175 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422897363 1096518589 /nfs/dbraw/zinc/51/85/89/1096518589.db2.gz ZSRZYBZCWNYCRJ-LXBDKUERSA-N 2 0 366.505 4.380 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000422900886 1096519320 /nfs/dbraw/zinc/51/93/20/1096519320.db2.gz KGCOVIXZNHIREX-QWHCGFSZSA-N 2 0 367.415 4.202 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422901576 1096519797 /nfs/dbraw/zinc/51/97/97/1096519797.db2.gz SEMHKQSDNXMMPU-QHAWAJNXSA-N 2 0 369.484 4.413 20 0 FIADRP c1c2ccccc2sc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422902787 1096520100 /nfs/dbraw/zinc/52/01/00/1096520100.db2.gz NOYUNSWYBKUXSW-WIYYLYMNSA-N 2 0 350.487 4.247 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCS2 ZINC000422911740 1096522035 /nfs/dbraw/zinc/52/20/35/1096522035.db2.gz LHHZOEPJRGUAKP-LQWHRVPQSA-N 2 0 370.493 4.208 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000422912670 1096522881 /nfs/dbraw/zinc/52/28/81/1096522881.db2.gz WQHUKBUPGIGKBI-YXJHDRRASA-N 2 0 371.550 4.174 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCS2 ZINC000422911742 1096522967 /nfs/dbraw/zinc/52/29/67/1096522967.db2.gz LHHZOEPJRGUAKP-OPYAIIAOSA-N 2 0 370.493 4.208 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)nc1-c1ccccc1 ZINC000422925645 1096526038 /nfs/dbraw/zinc/52/60/38/1096526038.db2.gz BWXIMSLTHBKBPX-IPMKNSEASA-N 2 0 355.551 4.171 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000422925095 1096526051 /nfs/dbraw/zinc/52/60/51/1096526051.db2.gz VBVHYYSJBCSRJU-IAGOWNOFSA-N 2 0 352.526 4.396 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000422927663 1096527476 /nfs/dbraw/zinc/52/74/76/1096527476.db2.gz ZMVFZAWVVZCADL-VQIMIIECSA-N 2 0 367.320 4.426 20 0 FIADRP Cc1sc(CC[NH2+][C@H](Cc2ccccc2)[C@H](C)[NH3+])nc1-c1ccccc1 ZINC000422927541 1096527503 /nfs/dbraw/zinc/52/75/03/1096527503.db2.gz GQWYIYNTFAWMLB-OXJNMPFZSA-N 2 0 365.546 4.209 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422934565 1096528807 /nfs/dbraw/zinc/52/88/07/1096528807.db2.gz CPBASQXEYVOMFR-CVEARBPZSA-N 2 0 371.525 4.448 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000422934842 1096529087 /nfs/dbraw/zinc/52/90/87/1096529087.db2.gz KGOHPKOMXRNNIN-LPHOPBHVSA-N 2 0 367.320 4.426 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000422934843 1096529328 /nfs/dbraw/zinc/52/93/28/1096529328.db2.gz KGOHPKOMXRNNIN-QFBILLFUSA-N 2 0 367.320 4.426 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OCC(C)C ZINC000422944539 1096535487 /nfs/dbraw/zinc/53/54/87/1096535487.db2.gz SHEJUIZVAYDVHR-HOTGVXAUSA-N 2 0 371.525 4.304 20 0 FIADRP Clc1ccc(CCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422950204 1096536868 /nfs/dbraw/zinc/53/68/68/1096536868.db2.gz XIKNQUFNEVPPAD-TZIWHRDSSA-N 2 0 356.897 4.118 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](COc1ccccc1)c1ccccc1 ZINC000422959614 1096540377 /nfs/dbraw/zinc/54/03/77/1096540377.db2.gz SVSJRXIDUASOEX-MBSDFSHPSA-N 2 0 361.489 4.320 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422976109 1096543572 /nfs/dbraw/zinc/54/35/72/1096543572.db2.gz UQUDTAKQQKOGKP-NZQKXSOJSA-N 2 0 360.457 4.292 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NCCC[C@@H]1CCC[NH2+]1)C1CCCCC1 ZINC000414713305 1096556904 /nfs/dbraw/zinc/55/69/04/1096556904.db2.gz OPMXZGRNOSECBE-IBGZPJMESA-N 2 0 372.557 4.105 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000414715542 1096564457 /nfs/dbraw/zinc/56/44/57/1096564457.db2.gz RBHQEPCWBPVIQR-ROUUACIJSA-N 2 0 372.557 4.042 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000423052644 1096565129 /nfs/dbraw/zinc/56/51/29/1096565129.db2.gz RAQXKMJRFXFQRT-ISKFKSNPSA-N 2 0 371.484 4.094 20 0 FIADRP CC(C)N1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423051217 1096565173 /nfs/dbraw/zinc/56/51/73/1096565173.db2.gz ZZNJJSLRMWPAPO-YUNSAGIJSA-N 2 0 367.940 4.110 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1F ZINC000503860285 1096569662 /nfs/dbraw/zinc/56/96/62/1096569662.db2.gz UVBHDFZFYFUTOS-UAPYVXQJSA-N 2 0 360.517 4.467 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)ccn1 ZINC000423085753 1096569970 /nfs/dbraw/zinc/56/99/70/1096569970.db2.gz KMKUZNLDOFZNJA-YZGWKJHDSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089887 1096570745 /nfs/dbraw/zinc/57/07/45/1096570745.db2.gz WETDCLKTZGYCIL-VWPQPMDRSA-N 2 0 352.453 4.049 20 0 FIADRP CCCOc1c(Cl)cc(C[N@H+](CC)[C@@H]2CCC[NH2+]CC2)cc1OC ZINC000414715786 1096574024 /nfs/dbraw/zinc/57/40/24/1096574024.db2.gz NMGQRDWDXHRNDS-MRXNPFEDSA-N 2 0 354.922 4.101 20 0 FIADRP FC1(F)CCCC[C@H](C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423123850 1096579795 /nfs/dbraw/zinc/57/97/95/1096579795.db2.gz FITQCVDDDXFRKU-VDZJLULYSA-N 2 0 350.453 4.048 20 0 FIADRP Clc1cccc([C@H]2C[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423105275 1096582269 /nfs/dbraw/zinc/58/22/69/1096582269.db2.gz YWELLODYQVRUMF-UZSDIVCKSA-N 2 0 368.908 4.432 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000423113104 1096585733 /nfs/dbraw/zinc/58/57/33/1096585733.db2.gz YKDBMISFICVWQC-CWJKEVGVSA-N 2 0 364.961 4.361 20 0 FIADRP Fc1ccc(C2CC2)cc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423147296 1096586795 /nfs/dbraw/zinc/58/67/95/1096586795.db2.gz RPYOYVKZHFAVTR-RBBKRZOGSA-N 2 0 352.453 4.049 20 0 FIADRP Brc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423144829 1096586867 /nfs/dbraw/zinc/58/68/67/1096586867.db2.gz ZNGMICYPQNWMJN-GPFWEFOESA-N 2 0 363.343 4.205 20 0 FIADRP Clc1ccccc1[C@H]1C[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423150893 1096589198 /nfs/dbraw/zinc/58/91/98/1096589198.db2.gz ZMIXPDXRUKYFGB-UARLMTKWSA-N 2 0 368.908 4.432 20 0 FIADRP C[C@@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@@H]1C[NH3+] ZINC000414719001 1096589206 /nfs/dbraw/zinc/58/92/06/1096589206.db2.gz XENLKYXWYFLUOU-DYESRHJHSA-N 2 0 372.557 4.042 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000423142474 1096594945 /nfs/dbraw/zinc/59/49/45/1096594945.db2.gz VIIZDSXAZLAEQT-YEWWUXTCSA-N 2 0 374.326 4.208 20 0 FIADRP Cc1ncsc1C[N@H+](C[C@@H](C)CCc1ccccc1)C[C@H]1CC[NH2+]C1 ZINC000414722870 1096609983 /nfs/dbraw/zinc/60/99/83/1096609983.db2.gz GOEOUVSQBFTHFU-PXNSSMCTSA-N 2 0 357.567 4.132 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423213736 1096616158 /nfs/dbraw/zinc/61/61/58/1096616158.db2.gz NXMBVXZJIDNWNO-MNOVXSKESA-N 2 0 365.237 4.118 20 0 FIADRP C[NH2+]CCC[NH2+][C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423204069 1096616288 /nfs/dbraw/zinc/61/62/88/1096616288.db2.gz UGDVQPSVPXUQTP-NSHDSACASA-N 2 0 368.344 4.141 20 0 FIADRP Brc1cccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2)c1 ZINC000423238742 1096618195 /nfs/dbraw/zinc/61/81/95/1096618195.db2.gz AUNRSWDYFGCLRC-KXBFYZLASA-N 2 0 359.311 4.128 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423214012 1096619394 /nfs/dbraw/zinc/61/93/94/1096619394.db2.gz ODACKHVNNYWFGW-CZUORRHYSA-N 2 0 361.942 4.430 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(Br)o2)c2ccc(F)cc2)CC1 ZINC000423230808 1096624689 /nfs/dbraw/zinc/62/46/89/1096624689.db2.gz KFBZSAHXLNZXSA-KVULBXGLSA-N 2 0 367.262 4.130 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000423233439 1096625768 /nfs/dbraw/zinc/62/57/68/1096625768.db2.gz OIHCYZBLYSFARY-RJYAGPCLSA-N 2 0 359.311 4.398 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]CC[C@H]2CC[NH2+]C2)nc1 ZINC000423248303 1096628541 /nfs/dbraw/zinc/62/85/41/1096628541.db2.gz MYHQEIKEZPPHDP-KNQAVFIVSA-N 2 0 371.956 4.040 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1cc(Cl)ccc1Cl)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414727759 1096629412 /nfs/dbraw/zinc/62/94/12/1096629412.db2.gz BOBFDISXDLHNGK-KBPBESRZSA-N 2 0 372.340 4.032 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253302 1096630632 /nfs/dbraw/zinc/63/06/32/1096630632.db2.gz VSAWDNYXDZIKCE-CZUORRHYSA-N 2 0 361.942 4.430 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423253846 1096631446 /nfs/dbraw/zinc/63/14/46/1096631446.db2.gz WNDYBFCSRFFDCR-WDEREUQCSA-N 2 0 365.237 4.118 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Br)c1 ZINC000423291106 1096636254 /nfs/dbraw/zinc/63/62/54/1096636254.db2.gz GUHIXOAOLHSIJH-STQMWFEESA-N 2 0 363.299 4.328 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423292664 1096636257 /nfs/dbraw/zinc/63/62/57/1096636257.db2.gz NURYCSMUUFAIJF-IAGOWNOFSA-N 2 0 368.525 4.431 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2F)cc1 ZINC000423293995 1096643341 /nfs/dbraw/zinc/64/33/41/1096643341.db2.gz SUOYGRVBYXUYKC-NEPJUHHUSA-N 2 0 351.263 4.459 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000423328579 1096648800 /nfs/dbraw/zinc/64/88/00/1096648800.db2.gz KWNREIWEJFFVSC-NSHDSACASA-N 2 0 368.344 4.271 20 0 FIADRP C[C@@H]1C[C@H](N[C@H](c2ccccc2)c2ccc(Br)cc2)CC[NH2+]1 ZINC000423387059 1096662844 /nfs/dbraw/zinc/66/28/44/1096662844.db2.gz SIIVUUVNWHAGQX-NIKGAXFTSA-N 2 0 359.311 4.269 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2cc3c(ccc4ccccc34)o2)CC[NH2+]CC1 ZINC000423395825 1096664880 /nfs/dbraw/zinc/66/48/80/1096664880.db2.gz AXHWSYQMNQCSLF-MRXNPFEDSA-N 2 0 352.478 4.253 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2cc3c(ccc4ccccc34)o2)CC[NH2+]CC1 ZINC000423395820 1096665069 /nfs/dbraw/zinc/66/50/69/1096665069.db2.gz AXHWSYQMNQCSLF-INIZCTEOSA-N 2 0 352.478 4.253 20 0 FIADRP Brc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423398981 1096666882 /nfs/dbraw/zinc/66/68/82/1096666882.db2.gz ULGSYOVXJXWIDN-SFHVURJKSA-N 2 0 373.294 4.056 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)CC[NH2+]CC1 ZINC000423398598 1096667312 /nfs/dbraw/zinc/66/73/12/1096667312.db2.gz DDFPCEJNRRXREG-SFHVURJKSA-N 2 0 368.521 4.029 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3F)s2)CC[NH2+]CC1 ZINC000423408807 1096673828 /nfs/dbraw/zinc/67/38/28/1096673828.db2.gz PCUYLNUBEWBIJV-HNNXBMFYSA-N 2 0 362.514 4.221 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423430551 1096683026 /nfs/dbraw/zinc/68/30/26/1096683026.db2.gz LBISZQGBKRHXTR-KBXCAEBGSA-N 2 0 369.347 4.024 20 0 FIADRP FC(F)(F)c1ccc([C@H]2CC[C@H]([NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC000423438106 1096687034 /nfs/dbraw/zinc/68/70/34/1096687034.db2.gz MPOZMJLJMPHJHJ-DSLXNQLJSA-N 2 0 352.444 4.319 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCC2 ZINC000423474388 1096695922 /nfs/dbraw/zinc/69/59/22/1096695922.db2.gz HGSOLRUVZUVSPJ-YOEHRIQHSA-N 2 0 359.514 4.448 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3CCC[C@H]([NH3+])C3)s2)cc1 ZINC000423454776 1096698588 /nfs/dbraw/zinc/69/85/88/1096698588.db2.gz DJEPDTULXHQOOG-QRTARXTBSA-N 2 0 359.539 4.295 20 0 FIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cncn2)cc1Cl ZINC000423507778 1096701865 /nfs/dbraw/zinc/70/18/65/1096701865.db2.gz QKOGOLFSIAQYQT-FOIQADDNSA-N 2 0 369.900 4.052 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000423493362 1096706417 /nfs/dbraw/zinc/70/64/17/1096706417.db2.gz BHQHDDSIPYGTCE-OWZDWXTDSA-N 2 0 362.489 4.493 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]C1CCN(c2ccc(F)cc2F)CC1)c1ccccc1 ZINC000423494518 1096706505 /nfs/dbraw/zinc/70/65/05/1096706505.db2.gz ARODWHXKPJSXGL-HXUWFJFHSA-N 2 0 359.464 4.003 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000423512695 1096709977 /nfs/dbraw/zinc/70/99/77/1096709977.db2.gz QXKNVZXHDCELGM-CKUKBARFSA-N 2 0 357.723 4.271 20 0 FIADRP COC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000423518083 1096712201 /nfs/dbraw/zinc/71/22/01/1096712201.db2.gz ZFXKQCBTQSGIQX-RBUKOAKNSA-N 2 0 366.427 4.463 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C1CCC([NH+]2CCNCC2)CC1 ZINC000423525794 1096713251 /nfs/dbraw/zinc/71/32/51/1096713251.db2.gz YQBFUHXFVOKSFD-UHYCVJNDSA-N 2 0 369.578 4.085 20 0 FIADRP CSC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000423538956 1096715738 /nfs/dbraw/zinc/71/57/38/1096715738.db2.gz HIPIVZHZWYOPBW-WTTBNOFXSA-N 2 0 358.473 4.087 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423540321 1096716521 /nfs/dbraw/zinc/71/65/21/1096716521.db2.gz JRGIRQRHDHCCJI-WJFTUGDTSA-N 2 0 367.562 4.474 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc2ccccc2c1OC(F)F ZINC000423547931 1096718115 /nfs/dbraw/zinc/71/81/15/1096718115.db2.gz QNNPPVQQLGFGHR-RKTXRCNFSA-N 2 0 360.448 4.480 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000423546334 1096718652 /nfs/dbraw/zinc/71/86/52/1096718652.db2.gz CYONQLKKGUGSSC-QGZVFWFLSA-N 2 0 357.567 4.009 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccc(OCc2ccccc2)c1 ZINC000423553914 1096720054 /nfs/dbraw/zinc/72/00/54/1096720054.db2.gz WHWOEYSCHZMHMR-ZHNGQKSSSA-N 2 0 350.506 4.304 20 0 FIADRP COc1ccccc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1Cl ZINC000423554574 1096720909 /nfs/dbraw/zinc/72/09/09/1096720909.db2.gz WWOAWLSFXQQAEY-MPWIWIEXSA-N 2 0 370.924 4.416 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423555612 1096721285 /nfs/dbraw/zinc/72/12/85/1096721285.db2.gz YDQILCJBNMFHOE-WNRNVDISSA-N 2 0 353.535 4.165 20 0 FIADRP C[C@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000423574766 1096723875 /nfs/dbraw/zinc/72/38/75/1096723875.db2.gz PPHNTDWOTFGVTK-HNNXBMFYSA-N 2 0 363.958 4.046 20 0 FIADRP CCN(C(=O)[C@@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1)C1CCCCC1 ZINC000515526875 1098665228 /nfs/dbraw/zinc/66/52/28/1098665228.db2.gz PQZLKKGYUNLWDB-LJQANCHMSA-N 2 0 373.585 4.188 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000515530275 1098668462 /nfs/dbraw/zinc/66/84/62/1098668462.db2.gz TWXQYIZXMZMBLC-NQRSXGPZSA-N 2 0 350.453 4.248 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000436237997 1098844473 /nfs/dbraw/zinc/84/44/73/1098844473.db2.gz IDSJVFBCWPMXAE-GOTSBHOMSA-N 2 0 364.533 4.069 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000436237999 1098845047 /nfs/dbraw/zinc/84/50/47/1098845047.db2.gz IDSJVFBCWPMXAE-PKTZIBPZSA-N 2 0 364.533 4.069 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1c[nH]nc1-c1ccsc1 ZINC000436271959 1098898307 /nfs/dbraw/zinc/89/83/07/1098898307.db2.gz FMUXGYUUIISGSQ-UHFFFAOYSA-N 2 0 354.523 4.268 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1C ZINC000533309928 1098944334 /nfs/dbraw/zinc/94/43/34/1098944334.db2.gz GTOKMHSWBWKSFH-HIFRSBDPSA-N 2 0 372.340 4.127 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1C ZINC000533309927 1098944961 /nfs/dbraw/zinc/94/49/61/1098944961.db2.gz GTOKMHSWBWKSFH-DZGCQCFKSA-N 2 0 372.340 4.127 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000533608568 1099225063 /nfs/dbraw/zinc/22/50/63/1099225063.db2.gz UTBVAXVTICEPFY-FQEVSTJZSA-N 2 0 370.562 4.164 20 0 FIADRP COc1c(F)cc(F)cc1C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001143562152 1099531583 /nfs/dbraw/zinc/53/15/83/1099531583.db2.gz BOZYFMQGNRMEJR-UHFFFAOYSA-N 2 0 372.459 4.071 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)c(Cl)c1 ZINC000162569264 1099864103 /nfs/dbraw/zinc/86/41/03/1099864103.db2.gz QKKMTWJPAHHBLL-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@@H]([NH2+]CCCCN(C)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715620 1099885732 /nfs/dbraw/zinc/88/57/32/1099885732.db2.gz DRVUWMFURVRBBB-GGAORHGYSA-N 2 0 365.565 4.403 20 0 FIADRP COc1cc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508717891 1099908534 /nfs/dbraw/zinc/90/85/34/1099908534.db2.gz MQRAWUKTVMYHBN-UGKGYDQZSA-N 2 0 352.522 4.046 20 0 FIADRP C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722243 1099940530 /nfs/dbraw/zinc/94/05/30/1099940530.db2.gz WWZUFQXBUHBYPC-AZUAARDMSA-N 2 0 352.497 4.358 20 0 FIADRP COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162772675 1099996158 /nfs/dbraw/zinc/99/61/58/1099996158.db2.gz ZKHUPKVOZCMVNR-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC2(C)CC[NH2+]CC2)c(-c2ccccc2Cl)n1 ZINC000414910066 1100040146 /nfs/dbraw/zinc/04/01/46/1100040146.db2.gz SFFHTOFFBJNUNV-UHFFFAOYSA-N 2 0 374.960 4.438 20 0 FIADRP CC1(C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC[NH2+]CC1 ZINC000414912103 1100130033 /nfs/dbraw/zinc/13/00/33/1100130033.db2.gz UXTHXFAEOGDUSU-UHFFFAOYSA-N 2 0 369.456 4.308 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)C[C@@H]1C ZINC000536659683 1100130856 /nfs/dbraw/zinc/13/08/56/1100130856.db2.gz RLSRDSMMULFLMU-ICSRJNTNSA-N 2 0 353.510 4.487 20 0 FIADRP C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000536665608 1100139443 /nfs/dbraw/zinc/13/94/43/1100139443.db2.gz UBTGQVCAOVYEQB-AVRDEDQJSA-N 2 0 373.585 4.031 20 0 FIADRP Cc1ccc(C[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000459418349 1100145227 /nfs/dbraw/zinc/14/52/27/1100145227.db2.gz VHYCVSVGQUHZDS-DEOSSOPVSA-N 2 0 372.516 4.327 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2cn(C3CCCC3)nc2-c2ccccn2)C1 ZINC000459427051 1100164962 /nfs/dbraw/zinc/16/49/62/1100164962.db2.gz OBLHRMUEBMNHRW-UYAOXDASSA-N 2 0 367.541 4.023 20 0 FIADRP CC[C@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Oc1ccccc1Cl ZINC000459451880 1100189042 /nfs/dbraw/zinc/18/90/42/1100189042.db2.gz ZRDGIQGVCFBKIJ-GOSISDBHSA-N 2 0 359.901 4.151 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000536696403 1100198499 /nfs/dbraw/zinc/19/84/99/1100198499.db2.gz VQYXOUYAXOIOIN-UHFFFAOYSA-N 2 0 360.933 4.284 20 0 FIADRP Fc1ccc(C2=CC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)CC2)cc1 ZINC000459469037 1100214080 /nfs/dbraw/zinc/21/40/80/1100214080.db2.gz UGCKLSOXEUDLEN-HXUWFJFHSA-N 2 0 351.469 4.415 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000379638038 1100235780 /nfs/dbraw/zinc/23/57/80/1100235780.db2.gz UEIVSIXSTBVIER-LPHOPBHVSA-N 2 0 358.913 4.491 20 0 FIADRP CCCn1ccnc1CCC[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000191483340 1100244121 /nfs/dbraw/zinc/24/41/21/1100244121.db2.gz YZEJHKPDDZZVIQ-UHFFFAOYSA-N 2 0 356.445 4.152 20 0 FIADRP COc1ccc(Oc2ccc(CC[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000536824949 1100342228 /nfs/dbraw/zinc/34/22/28/1100342228.db2.gz DZUYQYPSVRWLJS-HKUYNNGSSA-N 2 0 354.494 4.102 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@@H]4CC[N@H+](C)[C@@H](C)C4)cc3)ccc2O1 ZINC000536842168 1100355252 /nfs/dbraw/zinc/35/52/52/1100355252.db2.gz WLQHAHIDKNDPLD-GSHUGGBRSA-N 2 0 350.506 4.249 20 0 FIADRP Cc1ccn(-c2ccccc2C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000536847764 1100359106 /nfs/dbraw/zinc/35/91/06/1100359106.db2.gz WSZGXAUKEDUZDY-WMZHIEFXSA-N 2 0 374.532 4.181 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000425939193 1100362657 /nfs/dbraw/zinc/36/26/57/1100362657.db2.gz ZDZXFOUBSIDOLJ-RXVVDRJESA-N 2 0 357.929 4.340 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000536853093 1100368017 /nfs/dbraw/zinc/36/80/17/1100368017.db2.gz PRBDNBAURUGOMJ-PXNSSMCTSA-N 2 0 364.961 4.098 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)C1 ZINC000536831714 1100369337 /nfs/dbraw/zinc/36/93/37/1100369337.db2.gz IWQUORBOCHSAPT-RBUKOAKNSA-N 2 0 374.573 4.235 20 0 FIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000536856338 1100370885 /nfs/dbraw/zinc/37/08/85/1100370885.db2.gz FBMUOYAUHUYHBN-BRWVUGGUSA-N 2 0 372.475 4.115 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cc4c(cccc4F)[nH]3)CC2)C[C@H](C)O1 ZINC000438112137 1100436349 /nfs/dbraw/zinc/43/63/49/1100436349.db2.gz DRUAGBCPRLMUKU-CALCHBBNSA-N 2 0 373.516 4.018 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@@H]1CCCC[C@H]1[NH3+])C1CCCCC1 ZINC000517571614 1100506163 /nfs/dbraw/zinc/50/61/63/1100506163.db2.gz ZDMOUPQDAGUYSO-FXAWDEMLSA-N 2 0 357.542 4.297 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)C2CCCCC2)cc1)C1CC1 ZINC000517693297 1100609220 /nfs/dbraw/zinc/60/92/20/1100609220.db2.gz MQOZYSQMFOJJPS-UHFFFAOYSA-N 2 0 371.569 4.007 20 0 FIADRP Cc1ccc2cc([C@H](C)[NH2+]CC3(N4CCCCC4)CC[NH+](C)CC3)oc2c1 ZINC000426071390 1100780869 /nfs/dbraw/zinc/78/08/69/1100780869.db2.gz HUJVDWPEYLAOTH-IBGZPJMESA-N 2 0 369.553 4.342 20 0 FIADRP COc1cc(C[NH2+]C2(C)CC[NH2+]CC2)ccc1OCc1ccc(Cl)cc1 ZINC000414939038 1100839989 /nfs/dbraw/zinc/83/99/89/1100839989.db2.gz JBBVDPSUOYOLLB-UHFFFAOYSA-N 2 0 374.912 4.159 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414946993 1100904354 /nfs/dbraw/zinc/90/43/54/1100904354.db2.gz KFAHSURLPVIFRG-UYAOXDASSA-N 2 0 360.505 4.078 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C2(C)CC[NH2+]CC2)cc1 ZINC000414949050 1100905107 /nfs/dbraw/zinc/90/51/07/1100905107.db2.gz ZMUQPYUZXRHECO-UHFFFAOYSA-N 2 0 360.505 4.079 20 0 FIADRP [NH3+]C[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414948988 1100911321 /nfs/dbraw/zinc/91/13/21/1100911321.db2.gz ZEKBGCQBGFTHCV-RUZDIDTESA-N 2 0 373.544 4.136 20 0 FIADRP CCOc1c(Cl)cccc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000426163364 1100932835 /nfs/dbraw/zinc/93/28/35/1100932835.db2.gz VRTMUPBEOVXZGI-UHFFFAOYSA-N 2 0 373.928 4.482 20 0 FIADRP CCc1noc(CC)c1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438836179 1100954253 /nfs/dbraw/zinc/95/42/53/1100954253.db2.gz MYCKLAXUUYIRPV-UHFFFAOYSA-N 2 0 355.526 4.332 20 0 FIADRP C[C@H](CCCO)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000438836870 1100955182 /nfs/dbraw/zinc/95/51/82/1100955182.db2.gz ORXWCCUVLFKORH-NQIIRXRSSA-N 2 0 350.522 4.130 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[C@H]2CCC[NH2+]2)o1 ZINC000414966594 1101011663 /nfs/dbraw/zinc/01/16/63/1101011663.db2.gz GUXOYJSTYSKAKS-IBGZPJMESA-N 2 0 364.493 4.063 20 0 FIADRP C[C@@H](C[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1)CN1CC[NH+](C)CC1 ZINC000467383479 1101286552 /nfs/dbraw/zinc/28/65/52/1101286552.db2.gz TYVNWNUEQWRWPM-UWJYYQICSA-N 2 0 363.977 4.044 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)C1 ZINC000414994407 1101330365 /nfs/dbraw/zinc/33/03/65/1101330365.db2.gz DNEVFQGZFRXOLF-FUHWJXTLSA-N 2 0 366.534 4.208 20 0 FIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459722400 1101345226 /nfs/dbraw/zinc/34/52/26/1101345226.db2.gz BFZMZLRXHGOEMP-SFHVURJKSA-N 2 0 374.960 4.023 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000536962033 1101358234 /nfs/dbraw/zinc/35/82/34/1101358234.db2.gz YEDWOPWMMICEHT-SFHVURJKSA-N 2 0 351.332 4.146 20 0 FIADRP CC(C)[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000536963025 1101359502 /nfs/dbraw/zinc/35/95/02/1101359502.db2.gz NOEKHOMBTBITOY-HXUWFJFHSA-N 2 0 359.514 4.475 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000459740213 1101366654 /nfs/dbraw/zinc/36/66/54/1101366654.db2.gz TYYKXSIIQIDOCL-IBGZPJMESA-N 2 0 366.553 4.047 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013842 1101394186 /nfs/dbraw/zinc/39/41/86/1101394186.db2.gz SKVHNSHPAWIEIK-BDTNDASRSA-N 2 0 360.517 4.024 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC(C)C[NH2+][C@H](C)c2ccc(OC)cc2)cc1 ZINC000537027160 1101407414 /nfs/dbraw/zinc/40/74/14/1101407414.db2.gz LDAHPXPCJKDNFO-QZTJIDSGSA-N 2 0 356.510 4.341 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000414999127 1101472393 /nfs/dbraw/zinc/47/23/93/1101472393.db2.gz IWADBKNEIRPRCX-KPDCDPCYSA-N 2 0 370.512 4.138 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000415001256 1101551478 /nfs/dbraw/zinc/55/14/78/1101551478.db2.gz KSALZNMZULKSPC-WBVHZDCISA-N 2 0 371.912 4.199 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000537293670 1101615889 /nfs/dbraw/zinc/61/58/89/1101615889.db2.gz ABRWAARVWNPBON-GHTZIAJQSA-N 2 0 363.565 4.166 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](Cc2cccnc2)CC1 ZINC001168165823 1101763543 /nfs/dbraw/zinc/76/35/43/1101763543.db2.gz JMRNVLXBZUNIMR-QGZVFWFLSA-N 2 0 357.929 4.168 20 0 FIADRP COc1ccc(C2([NH3+])CC[NH+]([C@H](C)Cc3ccc(Cl)cc3)CC2)cc1 ZINC001168168924 1101841099 /nfs/dbraw/zinc/84/10/99/1101841099.db2.gz VTZWKACOPCJKPG-MRXNPFEDSA-N 2 0 358.913 4.230 20 0 FIADRP CC[N@@H+]1CCCN(C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC1 ZINC000105350986 1102209637 /nfs/dbraw/zinc/20/96/37/1102209637.db2.gz KZOYSZIGKOYZFU-UHFFFAOYSA-N 2 0 372.557 4.011 20 0 FIADRP c1ccc(C[N@H+]2CC[C@]3(CCN(CC4=Cc5ccccc5OC4)C3)C2)cc1 ZINC000519476883 1102234884 /nfs/dbraw/zinc/23/48/84/1102234884.db2.gz FAMVMPNLSSAJLU-DEOSSOPVSA-N 2 0 360.501 4.060 20 0 FIADRP C[NH+]1CCC(CC[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000187573088 1102284942 /nfs/dbraw/zinc/28/49/42/1102284942.db2.gz AZNAIXJDLBNKOJ-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(CO)c1 ZINC000121238725 1102354429 /nfs/dbraw/zinc/35/44/29/1102354429.db2.gz JWXOKLWDAQWERD-OALUTQOASA-N 2 0 352.522 4.262 20 0 FIADRP C[C@H](NC[C@H](O)C[NH+]1CCCC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000532479642 1102422966 /nfs/dbraw/zinc/42/29/66/1102422966.db2.gz LJHLELNHPRDGFZ-YOEHRIQHSA-N 2 0 364.942 4.176 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1cccc(Br)c1 ZINC000532488673 1102430281 /nfs/dbraw/zinc/43/02/81/1102430281.db2.gz XOWCKHHFOQVKMX-CKEIUWERSA-N 2 0 353.348 4.045 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC)c(Cl)c2)[C@@H](C)C1 ZINC000532500927 1102431731 /nfs/dbraw/zinc/43/17/31/1102431731.db2.gz RMOATJYQPLOLOK-FCEWJHQRSA-N 2 0 368.949 4.136 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CCCN(C)C2)CCC3)cc1 ZINC000532507027 1102434833 /nfs/dbraw/zinc/43/48/33/1102434833.db2.gz LAKPLADTRYVWQC-WMZOPIPTSA-N 2 0 355.551 4.427 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000532524397 1102443471 /nfs/dbraw/zinc/44/34/71/1102443471.db2.gz FSFSHFVWLILMJS-RVKKMQEKSA-N 2 0 354.460 4.445 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000121747117 1102447130 /nfs/dbraw/zinc/44/71/30/1102447130.db2.gz FCVSHOFCMYSLCB-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP Cc1nc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)nc2ccccc12 ZINC000121855988 1102461669 /nfs/dbraw/zinc/46/16/69/1102461669.db2.gz IYZKIKBFYJAELN-UHFFFAOYSA-N 2 0 352.526 4.026 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccc(F)cc2F)cc1 ZINC000532550256 1102464511 /nfs/dbraw/zinc/46/45/11/1102464511.db2.gz ZXPHYJJNNGIQFQ-CQSZACIVSA-N 2 0 357.404 4.189 20 0 FIADRP CC1CCC([N@@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@@H]3COCC3CC3)C2)CC1 ZINC001168214668 1102491889 /nfs/dbraw/zinc/49/18/89/1102491889.db2.gz CUCGQOUXJHGXAA-SSXYFDDISA-N 2 0 360.586 4.026 20 0 FIADRP C[C@H](COc1ccc(F)cc1F)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000152274739 1102507849 /nfs/dbraw/zinc/50/78/49/1102507849.db2.gz YTZRLHDSPHZUOE-OAHLLOKOSA-N 2 0 352.469 4.119 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1C(F)(F)F ZINC000122347862 1102561530 /nfs/dbraw/zinc/56/15/30/1102561530.db2.gz VTGYJDOMVHSSQG-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC1 ZINC001167974816 1102565488 /nfs/dbraw/zinc/56/54/88/1102565488.db2.gz AEEXUUABIVWWGE-MJOFCKKISA-N 3 0 367.581 4.164 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC000122352739 1102577716 /nfs/dbraw/zinc/57/77/16/1102577716.db2.gz JPCPLKCJNLJUPE-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP CN(C)c1ccccc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC001648985752 1102585554 /nfs/dbraw/zinc/58/55/54/1102585554.db2.gz IIOVNNFABTYGAG-UHFFFAOYSA-N 2 0 351.538 4.418 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168252205 1102651277 /nfs/dbraw/zinc/65/12/77/1102651277.db2.gz OBMNHEZHULYOMR-NJDAHSKKSA-N 2 0 368.496 4.074 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[C@@H]1C ZINC000550882053 1102653447 /nfs/dbraw/zinc/65/34/47/1102653447.db2.gz HPYKZMUOLWBWHY-PRTQVNTJSA-N 2 0 370.581 4.330 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000537345700 1102683776 /nfs/dbraw/zinc/68/37/76/1102683776.db2.gz ZCJYTLUQEVWBEE-UHFFFAOYSA-N 2 0 350.384 4.317 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000125917910 1102693431 /nfs/dbraw/zinc/69/34/31/1102693431.db2.gz QEZMZXXPCRWQOP-QFIPXVFZSA-N 2 0 373.504 4.238 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH2+]CC)c2)cc1 ZINC000428565220 1102719017 /nfs/dbraw/zinc/71/90/17/1102719017.db2.gz GYULSMHRTOHABX-UHFFFAOYSA-N 2 0 353.510 4.280 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cnn(Cc2ccccc2)c1 ZINC000123055972 1102775384 /nfs/dbraw/zinc/77/53/84/1102775384.db2.gz VJGBDLPXXLNALC-FQEVSTJZSA-N 2 0 374.532 4.378 20 0 FIADRP CC[N@@H+](Cc1cccc(-n2cccn2)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660923 1102785165 /nfs/dbraw/zinc/78/51/65/1102785165.db2.gz KATVLOPCKVHCEJ-QHCPKHFHSA-N 2 0 374.532 4.216 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000537660860 1102786325 /nfs/dbraw/zinc/78/63/25/1102786325.db2.gz IQOCAPKCHFMLJJ-UHFFFAOYSA-N 2 0 365.587 4.124 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000551013470 1102788569 /nfs/dbraw/zinc/78/85/69/1102788569.db2.gz BYUFYGOVVRKVIV-RPWUZVMVSA-N 2 0 365.565 4.452 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccc(F)cc2)CC1 ZINC000506864869 1102917181 /nfs/dbraw/zinc/91/71/81/1102917181.db2.gz CRRNPECFECTHCE-UHFFFAOYSA-N 2 0 358.505 4.160 20 0 FIADRP Cc1cc(F)ccc1-c1ccc(CN2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)o1 ZINC000537696073 1102962577 /nfs/dbraw/zinc/96/25/77/1102962577.db2.gz DFEKWYXMBJZPNG-NQSCKRDGSA-N 2 0 372.484 4.078 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC000537698607 1102985427 /nfs/dbraw/zinc/98/54/27/1102985427.db2.gz UVUQYQDHWMJRFK-ZLNRFVROSA-N 2 0 350.506 4.037 20 0 FIADRP Cc1cnn(CCCCC[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1 ZINC000476985500 1103005467 /nfs/dbraw/zinc/00/54/67/1103005467.db2.gz PZEFPYDJIITCSX-NRFANRHFSA-N 2 0 360.590 4.338 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000551268258 1103031461 /nfs/dbraw/zinc/03/14/61/1103031461.db2.gz TUTDAZRFHPIWGH-QFIPXVFZSA-N 2 0 368.521 4.280 20 0 FIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000459382342 1103099727 /nfs/dbraw/zinc/09/97/27/1103099727.db2.gz DHSDRHOKKYZLMP-JOUQPQNBSA-N 2 0 362.517 4.495 20 0 FIADRP COc1cc(Cl)c(C[NH2+]C[C@H]2CCCn3cc(C)nc32)cc1Cl ZINC000532827767 1103242917 /nfs/dbraw/zinc/24/29/17/1103242917.db2.gz ANRFWLRVURZRFD-GFCCVEGCSA-N 2 0 354.281 4.174 20 0 FIADRP CC[C@@H](Cc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001203214039 1103249989 /nfs/dbraw/zinc/24/99/89/1103249989.db2.gz BBZBVTZYTLUCDO-DLBZAZTESA-N 2 0 353.348 4.233 20 0 FIADRP COc1ncc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1Cl ZINC000551532403 1103329900 /nfs/dbraw/zinc/32/99/00/1103329900.db2.gz BRIUJYDBPWVRHU-ZLPCBKJTSA-N 2 0 365.949 4.437 20 0 FIADRP CCC[N@H+](Cc1ccc(-n2ccnc2)cc1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507377065 1103333211 /nfs/dbraw/zinc/33/32/11/1103333211.db2.gz HQQJRPNISWUVLE-SFHVURJKSA-N 2 0 362.477 4.112 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CS[C@H](C(C)(C)C)C3)cc2)CC1 ZINC000551567394 1103369427 /nfs/dbraw/zinc/36/94/27/1103369427.db2.gz SLRNMADZZDIFEG-XLIONFOSSA-N 2 0 362.583 4.169 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCSc3ccc(Br)cc32)CC1 ZINC000507489354 1103435561 /nfs/dbraw/zinc/43/55/61/1103435561.db2.gz ZUWNOVXPUVQUCR-HNNXBMFYSA-N 2 0 369.372 4.308 20 0 FIADRP CC(C)c1ncc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)s1 ZINC000551617552 1103440600 /nfs/dbraw/zinc/44/06/00/1103440600.db2.gz UGKLULCDTPCVCS-UHFFFAOYSA-N 2 0 359.539 4.029 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000551779177 1103626436 /nfs/dbraw/zinc/62/64/36/1103626436.db2.gz RJQALZFIFKYGJI-VKFKNLQPSA-N 2 0 364.533 4.299 20 0 FIADRP C[C@@H]1[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H]1c1ccccc1 ZINC000551817230 1103675622 /nfs/dbraw/zinc/67/56/22/1103675622.db2.gz OQXDBXUPQXKHRJ-GKVQRAMASA-N 2 0 364.533 4.441 20 0 FIADRP C[NH+](C)CC1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000519712570 1103814025 /nfs/dbraw/zinc/81/40/25/1103814025.db2.gz LKHTXBITUQIZDM-UHFFFAOYSA-N 2 0 358.476 4.370 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H](c3ccnn3C)C2)c1 ZINC000519863484 1103912671 /nfs/dbraw/zinc/91/26/71/1103912671.db2.gz TXSFJQKDAJRARH-LEWJYISDSA-N 2 0 354.542 4.076 20 0 FIADRP Cc1ccc(O[C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995840 1104567787 /nfs/dbraw/zinc/56/77/87/1104567787.db2.gz RTHQXSZUVDRKLF-FANLQWHUSA-N 2 0 354.538 4.244 20 0 FIADRP COc1ccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1OC ZINC001167995875 1104574929 /nfs/dbraw/zinc/57/49/29/1104574929.db2.gz UASFGZVAZCTOSG-JKWVGCSGSA-N 2 0 370.537 4.246 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2Cn2ccnc2)CC1 ZINC000520459681 1104760467 /nfs/dbraw/zinc/76/04/67/1104760467.db2.gz CGVCGCATMWWJIF-CVDCTZTESA-N 2 0 366.553 4.064 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000391584440 1105013665 /nfs/dbraw/zinc/01/36/65/1105013665.db2.gz PYWCCRBRQZZXPX-MOPGFXCFSA-N 2 0 372.384 4.306 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ncc(Br)cc1F ZINC000427604220 1105045002 /nfs/dbraw/zinc/04/50/02/1105045002.db2.gz OEVCOYGXUQZREK-UONOGXRCSA-N 2 0 372.326 4.288 20 0 FIADRP COc1ccc(OC)c(CN[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168005046 1105063316 /nfs/dbraw/zinc/06/33/16/1105063316.db2.gz FEVKKSJKBWYGBI-RMFSNUHRSA-N 2 0 368.521 4.235 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2COc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168005191 1105076078 /nfs/dbraw/zinc/07/60/78/1105076078.db2.gz HUDSRRRUDKSMTR-GMQQQROESA-N 2 0 350.506 4.021 20 0 FIADRP C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1OCc1ccccc1 ZINC000152404191 1105087289 /nfs/dbraw/zinc/08/72/89/1105087289.db2.gz VEFFDCGSLILGOV-ICSRJNTNSA-N 2 0 350.506 4.401 20 0 FIADRP Cc1cc(F)cc(C[NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)c1 ZINC001143587380 1105098095 /nfs/dbraw/zinc/09/80/95/1105098095.db2.gz ILZYDEIQLRZGMV-UHFFFAOYSA-N 2 0 367.512 4.406 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000152426761 1105174035 /nfs/dbraw/zinc/17/40/35/1105174035.db2.gz CRSFCTZBWZCCCZ-KDOFPFPSSA-N 2 0 371.525 4.401 20 0 FIADRP C[C@@H]1CC(n2c3ccccc3nc2CC[NH3+])C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008460 1105192448 /nfs/dbraw/zinc/19/24/48/1105192448.db2.gz DYWHMRVAPDHWAO-QZTJIDSGSA-N 2 0 362.521 4.152 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H]2CCn4ccnc4C2)CCC3)cc1 ZINC000427899698 1105308050 /nfs/dbraw/zinc/30/80/50/1105308050.db2.gz XBRWIWSXOFZRPB-IRXDYDNUSA-N 2 0 364.518 4.297 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C(=O)N(CC)CC)c2ccccc2)CC1 ZINC000520793179 1105357918 /nfs/dbraw/zinc/35/79/18/1105357918.db2.gz QXRMXHLQMQCING-QFIPXVFZSA-N 2 0 373.585 4.040 20 0 FIADRP Cc1cc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc2cccnc12 ZINC000475346773 1106745328 /nfs/dbraw/zinc/74/53/28/1106745328.db2.gz IFZDXBGKPQBMHV-ZRZAMGCNSA-N 2 0 357.501 4.107 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530241011 1106922207 /nfs/dbraw/zinc/92/22/07/1106922207.db2.gz OVPKIIAHLLZTSP-CJNGLKHVSA-N 2 0 357.325 4.145 20 0 FIADRP C[C@@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530241449 1106923358 /nfs/dbraw/zinc/92/33/58/1106923358.db2.gz PYMVBWRJEYAYQM-BBRMVZONSA-N 2 0 357.325 4.145 20 0 FIADRP Cc1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301717553 1107120958 /nfs/dbraw/zinc/12/09/58/1107120958.db2.gz ODMBNSLSMVARSU-KDOFPFPSSA-N 2 0 361.436 4.065 20 0 FIADRP COCCC[NH+]1CCC(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC1 ZINC000301780528 1107147669 /nfs/dbraw/zinc/14/76/69/1107147669.db2.gz IOGRRRYQOAKXDV-UHFFFAOYSA-N 2 0 367.415 4.166 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1OCc1ccccc1 ZINC000530674114 1107246406 /nfs/dbraw/zinc/24/64/06/1107246406.db2.gz RDLMYCHASRIKSU-RTWAWAEBSA-N 2 0 368.521 4.237 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCC[C@@H](C)C2)cc1)C(C)C ZINC000228655560 1107566587 /nfs/dbraw/zinc/56/65/87/1107566587.db2.gz WHKBBUGAYAPKPO-HXUWFJFHSA-N 2 0 373.585 4.159 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1sccc1Br ZINC000531688354 1108053239 /nfs/dbraw/zinc/05/32/39/1108053239.db2.gz OEGFCASTNGJQDE-LBPRGKRZSA-N 2 0 353.329 4.423 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2cccnc21)c1cccc(OCC[NH+](C)C)c1 ZINC000531687402 1108053376 /nfs/dbraw/zinc/05/33/76/1108053376.db2.gz SRRBHMLLLIKZEQ-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531688705 1108056046 /nfs/dbraw/zinc/05/60/46/1108056046.db2.gz ALAPZIXHCZCULP-KRWDZBQOSA-N 2 0 363.505 4.018 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000531690286 1108057451 /nfs/dbraw/zinc/05/74/51/1108057451.db2.gz LPUIKUYOKQICQG-QGZVFWFLSA-N 2 0 365.521 4.264 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c2nccn21 ZINC000453105697 1108174692 /nfs/dbraw/zinc/17/46/92/1108174692.db2.gz FWKNQNOPFCLPQF-KNQAVFIVSA-N 2 0 366.553 4.213 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453127594 1108205372 /nfs/dbraw/zinc/20/53/72/1108205372.db2.gz PPGBOQLOEPGLFB-DNVJHFABSA-N 2 0 366.553 4.005 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453197597 1108266717 /nfs/dbraw/zinc/26/67/17/1108266717.db2.gz NLIHLQDPXQGPOW-WSTZPKSXSA-N 2 0 366.553 4.391 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)C1 ZINC000453205610 1108274925 /nfs/dbraw/zinc/27/49/25/1108274925.db2.gz HAJWMPHFCRIWCQ-FDTLVRFQSA-N 2 0 356.554 4.224 20 0 FIADRP FCC1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000453316456 1108405719 /nfs/dbraw/zinc/40/57/19/1108405719.db2.gz WVOFXCWRWJQXOW-BHIFYINESA-N 2 0 374.544 4.033 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000531936102 1108410276 /nfs/dbraw/zinc/41/02/76/1108410276.db2.gz CMRLWPBPUARYKA-MOPGFXCFSA-N 2 0 354.542 4.486 20 0 FIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000531965175 1108460359 /nfs/dbraw/zinc/46/03/59/1108460359.db2.gz RAGWMWMROQNHQQ-FGZHOGPDSA-N 2 0 371.956 4.369 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCc2c1ccc(F)c2Br)C1CC1 ZINC000453395315 1108526850 /nfs/dbraw/zinc/52/68/50/1108526850.db2.gz HSFDQVGALDOKJV-INIZCTEOSA-N 2 0 355.295 4.040 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453602513 1108653143 /nfs/dbraw/zinc/65/31/43/1108653143.db2.gz WGCISVFKJCKFAI-UHFFFAOYSA-N 2 0 374.960 4.166 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)CCCCC2)cc1OC ZINC000532223338 1108721644 /nfs/dbraw/zinc/72/16/44/1108721644.db2.gz KCCIVBBCVYPITK-NLWGTHIKSA-N 2 0 374.569 4.224 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)C1 ZINC000524639945 1109101634 /nfs/dbraw/zinc/10/16/34/1109101634.db2.gz AJXZYEJCOHSRLF-QFIPXVFZSA-N 2 0 352.522 4.130 20 0 FIADRP C[N@H+](CC/C=C\c1ccc(Br)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000525518127 1109410322 /nfs/dbraw/zinc/41/03/22/1109410322.db2.gz YSCXEGCPAHMOLH-GPCFVJJQSA-N 2 0 351.332 4.126 20 0 FIADRP C[C@@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Cl)c1 ZINC000525874951 1109548718 /nfs/dbraw/zinc/54/87/18/1109548718.db2.gz WNLDUEWIIONXFQ-AVRDEDQJSA-N 2 0 371.956 4.022 20 0 FIADRP C[NH+](C)C1(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000447523853 1109560069 /nfs/dbraw/zinc/56/00/69/1109560069.db2.gz WULKSGYXNMLQTL-DKUWSORSSA-N 2 0 355.570 4.036 20 0 FIADRP CN(C)[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccsc1 ZINC000447546304 1109574979 /nfs/dbraw/zinc/57/49/79/1109574979.db2.gz USWDOJDHIOLLCA-YUMYIRISSA-N 2 0 369.578 4.136 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000447571194 1109578147 /nfs/dbraw/zinc/57/81/47/1109578147.db2.gz IXURNIXELYZVCY-GOSISDBHSA-N 2 0 351.332 4.364 20 0 FIADRP COc1cccc(C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)c1 ZINC000447567236 1109584643 /nfs/dbraw/zinc/58/46/43/1109584643.db2.gz ACDKLORPAVAXOO-DEOSSOPVSA-N 2 0 364.533 4.443 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccnn3-c3ccccc3)cc2)C1 ZINC000447931665 1109682108 /nfs/dbraw/zinc/68/21/08/1109682108.db2.gz OVDDYHOFNVIDKZ-HXUWFJFHSA-N 2 0 374.532 4.394 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)CC1 ZINC000527116373 1109698989 /nfs/dbraw/zinc/69/89/89/1109698989.db2.gz RGSWTVVOQPXKHS-QGZVFWFLSA-N 2 0 352.950 4.266 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc4cc[nH]c4c3)cc2)C[C@H](C)O1 ZINC000527634053 1109791235 /nfs/dbraw/zinc/79/12/35/1109791235.db2.gz JAXTWIHBFBALOM-ROUUACIJSA-N 2 0 363.505 4.067 20 0 FIADRP c1ccc(COc2cccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)c2)cc1 ZINC000448549531 1109826838 /nfs/dbraw/zinc/82/68/38/1109826838.db2.gz BCCRHGHIRLRBMV-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000527849878 1109847540 /nfs/dbraw/zinc/84/75/40/1109847540.db2.gz MCHSDCNUPFETFS-OALUTQOASA-N 2 0 366.553 4.198 20 0 FIADRP Cc1cccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C(C)C)c1 ZINC000527889062 1109850620 /nfs/dbraw/zinc/85/06/20/1109850620.db2.gz XYYBNONKNGXQDI-PKTZIBPZSA-N 2 0 352.522 4.049 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)OC)c1 ZINC000527917378 1109861540 /nfs/dbraw/zinc/86/15/40/1109861540.db2.gz CXLSBWYPBOSTQA-HSQYWUDLSA-N 2 0 360.542 4.015 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CC/C=C/c2ccc(Br)cc2)CC1 ZINC000527935177 1109870824 /nfs/dbraw/zinc/87/08/24/1109870824.db2.gz SIZKXVFIRLSFSJ-HWKANZROSA-N 2 0 351.332 4.315 20 0 FIADRP C[NH+](C)C[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000528009101 1109884821 /nfs/dbraw/zinc/88/48/21/1109884821.db2.gz NPMPQSSKCCHYDQ-IBGZPJMESA-N 2 0 370.368 4.060 20 0 FIADRP Cc1cnc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)s1 ZINC000449077999 1109974516 /nfs/dbraw/zinc/97/45/16/1109974516.db2.gz SXKFJPRJNSFNRP-UHFFFAOYSA-N 2 0 351.519 4.470 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449148527 1109985338 /nfs/dbraw/zinc/98/53/38/1109985338.db2.gz KJCVAKFGOKYGBP-LEWJYISDSA-N 2 0 362.945 4.102 20 0 FIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+]C3CCC(OC4CCCC4)CC3)C2)cc1 ZINC000449295752 1110019718 /nfs/dbraw/zinc/01/97/18/1110019718.db2.gz VBAVDKNWZDGRMG-ZJOBEGKPSA-N 2 0 356.554 4.369 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000449343236 1110034901 /nfs/dbraw/zinc/03/49/01/1110034901.db2.gz IXGLJMWFHLZNFB-DHIUTWEWSA-N 2 0 370.581 4.474 20 0 FIADRP CSC1(C[NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH+](C)CC1 ZINC000449339732 1110041467 /nfs/dbraw/zinc/04/14/67/1110041467.db2.gz UZISPJASNCXWPP-AEFFLSMTSA-N 2 0 352.975 4.393 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@H]2CCO[C@@H](C)C2)CC3)cc1 ZINC001168112374 1110155963 /nfs/dbraw/zinc/15/59/63/1110155963.db2.gz DJURAVQYYRKIOA-UNMCSNQZSA-N 2 0 356.554 4.241 20 0 FIADRP CCOc1ccc(C[N@H+](CCCn2ccnc2)CC2CC(F)(F)C2)cc1 ZINC000450650656 1110324572 /nfs/dbraw/zinc/32/45/72/1110324572.db2.gz NMALICZIKBMTLP-UHFFFAOYSA-N 2 0 363.452 4.219 20 0 FIADRP CC(=O)c1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000450653483 1110325376 /nfs/dbraw/zinc/32/53/76/1110325376.db2.gz PPZICULQOWSXRM-UHFFFAOYSA-N 2 0 351.494 4.023 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)C[N@@H+]1Cc1ccccc1 ZINC000538407790 1111129108 /nfs/dbraw/zinc/12/91/08/1111129108.db2.gz KUSCVWRJMRZQJO-KHSAKVFQSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@H](CCc1cccn1C)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000566216199 1111167003 /nfs/dbraw/zinc/16/70/03/1111167003.db2.gz UKGJVQPBMMKKDE-CTNGQTDRSA-N 2 0 351.538 4.133 20 0 FIADRP C[N@@H+](Cc1ccc(OCC(F)F)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538730473 1111267072 /nfs/dbraw/zinc/26/70/72/1111267072.db2.gz NTZHGXOZZIMNMR-HXUWFJFHSA-N 2 0 374.475 4.284 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000539039412 1111394359 /nfs/dbraw/zinc/39/43/59/1111394359.db2.gz AKJUZZLPEQKFDP-KPQWGBOZSA-N 2 0 374.569 4.406 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccccc2Br)[C@@H](C)C1 ZINC000539053398 1111401712 /nfs/dbraw/zinc/40/17/12/1111401712.db2.gz FYAWWTPEQSRAGQ-YOEHRIQHSA-N 2 0 353.348 4.047 20 0 FIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000539062219 1111408119 /nfs/dbraw/zinc/40/81/19/1111408119.db2.gz UGNXNVWVANXOIX-ZRBLBEILSA-N 2 0 374.569 4.140 20 0 FIADRP Clc1ccc2sc(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)nc2c1 ZINC000539122631 1111442239 /nfs/dbraw/zinc/44/22/39/1111442239.db2.gz MBYUCNOWXVQYEJ-UHFFFAOYSA-N 2 0 363.958 4.489 20 0 FIADRP CC[C@H](C[NH2+]C1CC[NH+](CC)CC1)Cc1cccc(Br)c1 ZINC000462105666 1111495212 /nfs/dbraw/zinc/49/52/12/1111495212.db2.gz QDZGRYNDHWHGHD-HNNXBMFYSA-N 2 0 353.348 4.092 20 0 FIADRP C[NH+]1CCC(C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)CC1 ZINC000462117520 1111503375 /nfs/dbraw/zinc/50/33/75/1111503375.db2.gz CFMAOMIANJUSDS-UHFFFAOYSA-N 2 0 358.476 4.050 20 0 FIADRP CCC1(C[NH2+]C2CC[NH+](CC3CC3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000539296158 1111505696 /nfs/dbraw/zinc/50/56/96/1111505696.db2.gz ZNWONQNTRSWLII-UHFFFAOYSA-N 3 0 369.597 4.143 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H]1[C@@H]3c4ccccc4C[C@H]13)c1ccccc1O2 ZINC000539392824 1111540512 /nfs/dbraw/zinc/54/05/12/1111540512.db2.gz GEYJKCURVHQCEW-PIATZUFCSA-N 2 0 374.528 4.150 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000643522273 1111542482 /nfs/dbraw/zinc/54/24/82/1111542482.db2.gz KTPOTPZSFLMIBB-SWLSCSKDSA-N 2 0 367.324 4.280 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000552062516 1111562913 /nfs/dbraw/zinc/56/29/13/1111562913.db2.gz ZZXNOASOXDEVDS-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000552087479 1111569638 /nfs/dbraw/zinc/56/96/38/1111569638.db2.gz JHRIZYDTVDCJJE-WTIAFYNJSA-N 2 0 356.554 4.334 20 0 FIADRP C[C@H](O)[C@@](C)(C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)Cc1ccccc1 ZINC000477854485 1111578700 /nfs/dbraw/zinc/57/87/00/1111578700.db2.gz BKXPEKXQYMKZRY-CDPNLFKUSA-N 2 0 372.597 4.249 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)[C@H](C)C1 ZINC000477855786 1111579282 /nfs/dbraw/zinc/57/92/82/1111579282.db2.gz IUSUUQNLMCZSAM-WBMJQRKESA-N 2 0 354.325 4.337 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000477869548 1111591230 /nfs/dbraw/zinc/59/12/30/1111591230.db2.gz XUSZAONIWSWPDE-WQGACYEGSA-N 2 0 354.325 4.336 20 0 FIADRP COc1ccsc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552273246 1111654649 /nfs/dbraw/zinc/65/46/49/1111654649.db2.gz AIHWDMYENPOHPE-UHFFFAOYSA-N 2 0 356.535 4.245 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2ccccc2Cl)cc1 ZINC000643536572 1111773756 /nfs/dbraw/zinc/77/37/56/1111773756.db2.gz VENLRVQLKQKVHW-UXHICEINSA-N 2 0 356.897 4.170 20 0 FIADRP Cc1ccc([C@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479268206 1111982595 /nfs/dbraw/zinc/98/25/95/1111982595.db2.gz CFMGTHPPDDNCTN-NFBKMPQASA-N 2 0 357.586 4.090 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479338329 1111999541 /nfs/dbraw/zinc/99/95/41/1111999541.db2.gz VUWSXEBYVIQHJT-QFIPXVFZSA-N 2 0 360.505 4.101 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000479368080 1112001760 /nfs/dbraw/zinc/00/17/60/1112001760.db2.gz XSPXOXKUZUCUEO-SGTLLEGYSA-N 2 0 367.306 4.113 20 0 FIADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cc(Br)ccc21 ZINC000479367204 1112001973 /nfs/dbraw/zinc/00/19/73/1112001973.db2.gz WEEBUOHCQHLBOQ-FZKQIMNGSA-N 2 0 363.343 4.245 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000479368081 1112001996 /nfs/dbraw/zinc/00/19/96/1112001996.db2.gz XSPXOXKUZUCUEO-XIKOKIGWSA-N 2 0 367.306 4.113 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)[C@@H](C)C1 ZINC000479525673 1112052355 /nfs/dbraw/zinc/05/23/55/1112052355.db2.gz IFIZLZVYNVTENJ-RYGJVYDSSA-N 2 0 350.934 4.054 20 0 FIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccccc3OCC[NH+](C)C)cc2c(C)c1 ZINC000479558035 1112072046 /nfs/dbraw/zinc/07/20/46/1112072046.db2.gz WDTKXMKKPAAFLD-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP CC(C)N(CC[NH+]1CCCCCC1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000553753925 1112079985 /nfs/dbraw/zinc/07/99/85/1112079985.db2.gz FGQVUMXUVLFRRR-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP COc1cc([C@H](C)NCc2ccccc2C[NH+]2CCCCC2)c(F)cn1 ZINC000554047828 1112174499 /nfs/dbraw/zinc/17/44/99/1112174499.db2.gz IZFNOGIXEHPUTA-INIZCTEOSA-N 2 0 357.473 4.066 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000479889568 1112187045 /nfs/dbraw/zinc/18/70/45/1112187045.db2.gz VRHCHULXRYRVIA-SBUREZEXSA-N 2 0 368.496 4.071 20 0 FIADRP COc1cc2c(NCC3CCN(c4cc[nH+]cc4)CC3)cc[nH+]c2cc1F ZINC000480119230 1112290278 /nfs/dbraw/zinc/29/02/78/1112290278.db2.gz RYJXTKLUOBGPIL-UHFFFAOYSA-N 2 0 366.440 4.106 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480142234 1112299386 /nfs/dbraw/zinc/29/93/86/1112299386.db2.gz AYXYDQXMNUOFNI-KRWDZBQOSA-N 2 0 359.514 4.402 20 0 FIADRP COc1cc(C)c([C@@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1OC ZINC000480143773 1112300704 /nfs/dbraw/zinc/30/07/04/1112300704.db2.gz GUAMJHMSURZKQH-GOSISDBHSA-N 2 0 356.510 4.185 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCO[C@@H](C(F)(F)F)C2)C1 ZINC000554349380 1112311184 /nfs/dbraw/zinc/31/11/84/1112311184.db2.gz KTWBMRTYDJJZOM-AYOQOUSVSA-N 2 0 370.459 4.118 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000554369450 1112320205 /nfs/dbraw/zinc/32/02/05/1112320205.db2.gz GYHBPDIQENWHAC-AOIWGVFYSA-N 2 0 371.500 4.181 20 0 FIADRP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480242226 1112346507 /nfs/dbraw/zinc/34/65/07/1112346507.db2.gz AHIULBHQCDBKCI-QGZVFWFLSA-N 2 0 372.557 4.276 20 0 FIADRP COc1cc2c(NCc3ccc(CC[NH+](C)C)cc3)cc[nH+]c2cc1F ZINC000480324175 1112389009 /nfs/dbraw/zinc/38/90/09/1112389009.db2.gz DMLGVBCFCMHHNE-UHFFFAOYSA-N 2 0 353.441 4.099 20 0 FIADRP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000667671070 1112423917 /nfs/dbraw/zinc/42/39/17/1112423917.db2.gz GSBIPVRXJVCUIN-IBGZPJMESA-N 2 0 355.551 4.426 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1)N1CC[NH+](C)CC1 ZINC000480538646 1112466979 /nfs/dbraw/zinc/46/69/79/1112466979.db2.gz SBFPIQXYYQNOET-YKSBVNFPSA-N 2 0 365.565 4.276 20 0 FIADRP CC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000480539051 1112467456 /nfs/dbraw/zinc/46/74/56/1112467456.db2.gz UNDKFTWNSMICTP-SFHVURJKSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000480539685 1112467504 /nfs/dbraw/zinc/46/75/04/1112467504.db2.gz VWOTVKOKIJBNBZ-FQEVSTJZSA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000480617505 1112511063 /nfs/dbraw/zinc/51/10/63/1112511063.db2.gz RJILBOWXMQLJBG-RBUKOAKNSA-N 2 0 374.573 4.379 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCO2 ZINC000480636651 1112523586 /nfs/dbraw/zinc/52/35/86/1112523586.db2.gz CVSUNBKZMJXRTP-QZTJIDSGSA-N 2 0 366.505 4.498 20 0 FIADRP C[C@H]([NH2+]CCCNc1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480690155 1112547494 /nfs/dbraw/zinc/54/74/94/1112547494.db2.gz ACEXOFQEMKBSFW-ICSRJNTNSA-N 2 0 355.501 4.128 20 0 FIADRP CC(C)C[C@H](CNC(=O)Nc1cccc(C[NH3+])c1)[NH2+][C@H](C)c1ccccc1 ZINC000667727644 1112551601 /nfs/dbraw/zinc/55/16/01/1112551601.db2.gz DXDHLQFHJLUWTJ-DYESRHJHSA-N 2 0 368.525 4.032 20 0 FIADRP CC[NH+](CC)[C@@H](CNC(=O)Nc1cccc(C[NH3+])c1)c1ccccc1Cl ZINC000667732517 1112558497 /nfs/dbraw/zinc/55/84/97/1112558497.db2.gz LFOBRQWNPJNOBD-IBGZPJMESA-N 2 0 374.916 4.003 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000480723164 1112571847 /nfs/dbraw/zinc/57/18/47/1112571847.db2.gz RJYFKHPTYTVZRC-NRFANRHFSA-N 2 0 356.485 4.323 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480779067 1112593136 /nfs/dbraw/zinc/59/31/36/1112593136.db2.gz JVEGGIYQGVOFKY-NRFANRHFSA-N 2 0 365.993 4.435 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)C1 ZINC000481308038 1112881750 /nfs/dbraw/zinc/88/17/50/1112881750.db2.gz AFOPMMRLTRKIRB-GCJKJVERSA-N 2 0 356.485 4.050 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2c(s1)CCCC2 ZINC000481326684 1112901582 /nfs/dbraw/zinc/90/15/82/1112901582.db2.gz YYISMRCEMYDHKO-INIZCTEOSA-N 2 0 358.551 4.418 20 0 FIADRP CC1(C)CC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c2ccccc21 ZINC000481659988 1113015935 /nfs/dbraw/zinc/01/59/35/1113015935.db2.gz QWBOAQLKUFWIJT-BHDDXSALSA-N 2 0 356.554 4.157 20 0 FIADRP FC(F)(F)Oc1ccc2c(NCc3ccc4c[nH+]cn4c3)cc[nH+]c2c1 ZINC000899873935 1113036830 /nfs/dbraw/zinc/03/68/30/1113036830.db2.gz JKKQBQPWULAAEZ-UHFFFAOYSA-N 2 0 358.323 4.393 20 0 FIADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877866 1113041254 /nfs/dbraw/zinc/04/12/54/1113041254.db2.gz KGCNLWXUFBEUKJ-CXAGYDPISA-N 2 0 365.399 4.054 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccc(OC)c3)CC2)cc1 ZINC000481746276 1113060561 /nfs/dbraw/zinc/06/05/61/1113060561.db2.gz PVMBACFPJAZGDV-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000481738611 1113062882 /nfs/dbraw/zinc/06/28/82/1113062882.db2.gz FABDBCZICIWHNH-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP c1cncc([C@@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C2CCC2)c1 ZINC000481929952 1113138135 /nfs/dbraw/zinc/13/81/35/1113138135.db2.gz YCGDJJSHFPGZSB-QHCPKHFHSA-N 2 0 365.521 4.187 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3cc(Br)ccc32)C1 ZINC000482343614 1113229778 /nfs/dbraw/zinc/22/97/78/1113229778.db2.gz LIAWHCXJUMKDQX-KDOFPFPSSA-N 2 0 351.332 4.146 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000482341717 1113229897 /nfs/dbraw/zinc/22/98/97/1113229897.db2.gz CBWHIBFTILUASH-HSZRJFAPSA-N 2 0 370.512 4.440 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000482444770 1113257801 /nfs/dbraw/zinc/25/78/01/1113257801.db2.gz AMKAWVRSPHBYLK-FQEVSTJZSA-N 2 0 356.510 4.413 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CCC2 ZINC000482442952 1113258202 /nfs/dbraw/zinc/25/82/02/1113258202.db2.gz ZYHSOWFROUIPPV-RDPSFJRHSA-N 2 0 364.533 4.227 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482458898 1113266834 /nfs/dbraw/zinc/26/68/34/1113266834.db2.gz AZMGNYNJFGKUGV-DNVCBOLYSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(C(C)(C)C)cs1 ZINC000482541176 1113288497 /nfs/dbraw/zinc/28/84/97/1113288497.db2.gz DZXPGHMBLOFKOT-HKUYNNGSSA-N 2 0 371.594 4.483 20 0 FIADRP OCC[NH+]1CCC(C[NH2+][C@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000482539761 1113290272 /nfs/dbraw/zinc/29/02/72/1113290272.db2.gz SPMWLDMCZFXUKB-XMMPIXPASA-N 2 0 366.549 4.045 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482548651 1113290950 /nfs/dbraw/zinc/29/09/50/1113290950.db2.gz NCMLQXAHWQQHHW-JTSKRJEESA-N 2 0 367.512 4.306 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc2cc(OC)ccc2c1 ZINC000482867867 1113381625 /nfs/dbraw/zinc/38/16/25/1113381625.db2.gz PBFAQYQXUBVXSR-FYYLOGMGSA-N 2 0 370.537 4.126 20 0 FIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000482873128 1113385502 /nfs/dbraw/zinc/38/55/02/1113385502.db2.gz KELPWFXHHMLAIO-SFTDATJTSA-N 2 0 372.578 4.167 20 0 FIADRP CCC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000483213085 1113466643 /nfs/dbraw/zinc/46/66/43/1113466643.db2.gz LKXBVYLXBUKBHA-OXJNMPFZSA-N 2 0 350.934 4.272 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC000483276402 1113478368 /nfs/dbraw/zinc/47/83/68/1113478368.db2.gz NAAJYYYSENOOFV-RXVVDRJESA-N 2 0 357.542 4.264 20 0 FIADRP C[C@@H]1[C@H](N[C@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000569244747 1113485829 /nfs/dbraw/zinc/48/58/29/1113485829.db2.gz MKTKQFCSTCLZGO-OYYPCOLYSA-N 2 0 363.549 4.075 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000658355401 1113668226 /nfs/dbraw/zinc/66/82/26/1113668226.db2.gz INAHGEMHFAYZGT-SFHVURJKSA-N 2 0 367.459 4.189 20 0 FIADRP C[C@H]1CSCC[NH+](Cc2cccc(C[N@H+]3CCSC[C@H](C)C3)c2)C1 ZINC000488198905 1113876468 /nfs/dbraw/zinc/87/64/68/1113876468.db2.gz KPOSVDUOONUWSL-QZTJIDSGSA-N 2 0 364.624 4.056 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CC[C@H]([NH+]4CCCCC4)C3)c2cc1OCC ZINC000488243315 1113887403 /nfs/dbraw/zinc/88/74/03/1113887403.db2.gz WHESPAUXXFXYHB-KRWDZBQOSA-N 2 0 369.509 4.097 20 0 FIADRP Clc1ccc(OCC[NH+]2CCC(C[NH+]3CCCC3)CC2)c(Cl)c1 ZINC000488423865 1113925751 /nfs/dbraw/zinc/92/57/51/1113925751.db2.gz YXBDNMDJRWGCSX-UHFFFAOYSA-N 2 0 357.325 4.180 20 0 FIADRP C[C@H](c1ccc(Br)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488548324 1113950407 /nfs/dbraw/zinc/95/04/07/1113950407.db2.gz OZAXTOBIOJDBLY-OAHLLOKOSA-N 2 0 351.332 4.318 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000489568678 1114137999 /nfs/dbraw/zinc/13/79/99/1114137999.db2.gz SOFKFIGCSWFLMR-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490110502 1114215794 /nfs/dbraw/zinc/21/57/94/1114215794.db2.gz BVCSBULQLSMXFQ-DEOSSOPVSA-N 2 0 365.565 4.010 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cn1 ZINC000490120708 1114220776 /nfs/dbraw/zinc/22/07/76/1114220776.db2.gz WHTOZNPJXKEUIK-FVJLSDCUSA-N 2 0 371.500 4.071 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490961374 1114355980 /nfs/dbraw/zinc/35/59/80/1114355980.db2.gz BRHDVZLQKYXIAV-RDPSFJRHSA-N 2 0 369.597 4.192 20 0 FIADRP CCCC[N@H+](C)CCNC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000491036704 1114365000 /nfs/dbraw/zinc/36/50/00/1114365000.db2.gz ZBSRADPOMQKFBY-UHFFFAOYSA-N 2 0 374.573 4.305 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000571210997 1114452736 /nfs/dbraw/zinc/45/27/36/1114452736.db2.gz UYCFFHFZZUFVNH-KOUNCHBCSA-N 2 0 363.549 4.453 20 0 FIADRP CCCn1nc(C)c(CN2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1C ZINC000571567019 1114482141 /nfs/dbraw/zinc/48/21/41/1114482141.db2.gz CMXVMRCOYOOHBA-HSZRJFAPSA-N 2 0 366.553 4.008 20 0 FIADRP C[C@@H](C[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1)C[NH+]1CCCC1 ZINC000588177743 1114549178 /nfs/dbraw/zinc/54/91/78/1114549178.db2.gz CWZSHSQSOJNKQR-ZDUSSCGKSA-N 2 0 355.309 4.091 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccccc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000588710053 1114601926 /nfs/dbraw/zinc/60/19/26/1114601926.db2.gz PEESBIJSROAVGP-HOTGVXAUSA-N 2 0 370.459 4.027 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]CC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000589650646 1114821945 /nfs/dbraw/zinc/82/19/45/1114821945.db2.gz IUGJOAADKNNSPW-UHFFFAOYSA-N 2 0 358.913 4.102 20 0 FIADRP C[NH+](C)CC1CC[NH+](CCCCOc2cccc(C(F)(F)F)c2)CC1 ZINC000590125442 1114897291 /nfs/dbraw/zinc/89/72/91/1114897291.db2.gz RVOCGCBELBSJCG-UHFFFAOYSA-N 2 0 358.448 4.138 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590786736 1114974169 /nfs/dbraw/zinc/97/41/69/1114974169.db2.gz KSVSMNXEOJRWAB-IBGZPJMESA-N 2 0 373.585 4.498 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000573609579 1115146795 /nfs/dbraw/zinc/14/67/95/1115146795.db2.gz BRYBNLGBFNXSNI-HIFRSBDPSA-N 2 0 374.941 4.275 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168401470 1115174941 /nfs/dbraw/zinc/17/49/41/1115174941.db2.gz WXAHNBUWDKXYGI-WMZHIEFXSA-N 2 0 352.497 4.185 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000479875396 1115250112 /nfs/dbraw/zinc/25/01/12/1115250112.db2.gz QHTBCKWFIUQCRM-BXWFABGCSA-N 2 0 372.475 4.493 20 0 FIADRP Cc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000574395582 1115359416 /nfs/dbraw/zinc/35/94/16/1115359416.db2.gz CGXZRMMUEPSFGC-DYESRHJHSA-N 2 0 351.494 4.008 20 0 FIADRP c1cn(-c2cccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)cn1 ZINC000574633461 1115430551 /nfs/dbraw/zinc/43/05/51/1115430551.db2.gz UJYRLWGBMOBXHY-ULPXVVAUSA-N 2 0 372.516 4.158 20 0 FIADRP CCC(O)(CC)C(C)(C)C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000574704942 1115440366 /nfs/dbraw/zinc/44/03/66/1115440366.db2.gz SUAQXTKCNWQDAD-LJQANCHMSA-N 2 0 374.569 4.142 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(C(=O)OC)cc32)c1 ZINC000594494897 1115449845 /nfs/dbraw/zinc/44/98/45/1115449845.db2.gz KIULFKFVFQTXPO-QFIPXVFZSA-N 2 0 366.505 4.092 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(C(=O)OC)cc32)c1 ZINC000594494896 1115450347 /nfs/dbraw/zinc/45/03/47/1115450347.db2.gz KIULFKFVFQTXPO-JOCHJYFZSA-N 2 0 366.505 4.092 20 0 FIADRP COC(=O)CC(C)(C)C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000595016052 1115504132 /nfs/dbraw/zinc/50/41/32/1115504132.db2.gz GPDIXFTZMWZYRW-XSLAUPDRSA-N 2 0 372.553 4.140 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cnn(-c3cc(C)ccc3C)c2C)CC1 ZINC000574909949 1115513944 /nfs/dbraw/zinc/51/39/44/1115513944.db2.gz SGGCFLHUXNOSAQ-SFHVURJKSA-N 2 0 354.542 4.180 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)s2)c1 ZINC000598962773 1115771696 /nfs/dbraw/zinc/77/16/96/1115771696.db2.gz KPJUKMMNVBKWKU-UHFFFAOYSA-N 2 0 374.550 4.445 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000669703968 1115831414 /nfs/dbraw/zinc/83/14/14/1115831414.db2.gz ZUTIUHNIKAXKHO-BVAFDOMYSA-N 2 0 356.554 4.082 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]CC2(c3cccc(Cl)c3)CC2)cc1 ZINC000606914891 1115983086 /nfs/dbraw/zinc/98/30/86/1115983086.db2.gz VEJQBASEHIICSL-UHFFFAOYSA-N 2 0 358.913 4.102 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000534059328 1116153841 /nfs/dbraw/zinc/15/38/41/1116153841.db2.gz NPZKYRRVOQGWAG-MRXNPFEDSA-N 2 0 357.723 4.021 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535231022 1116283268 /nfs/dbraw/zinc/28/32/68/1116283268.db2.gz UWSFTATWGFMBNA-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]Cc2ccc(CN3CCOCC3)cc2)cc1 ZINC000535232344 1116283549 /nfs/dbraw/zinc/28/35/49/1116283549.db2.gz DEMIWMLGIXJRQR-SFHVURJKSA-N 2 0 370.562 4.482 20 0 FIADRP CN(Cc1cccc(C(F)(F)F)c1)C1CC[NH+](C[C@H]2CCCOC2)CC1 ZINC000535405767 1116303228 /nfs/dbraw/zinc/30/32/28/1116303228.db2.gz JCUJGFHWQSKASM-QGZVFWFLSA-N 2 0 370.459 4.028 20 0 FIADRP CSc1cccc([C@H]([NH2+]CCn2ccnc2)c2ccc(F)c(F)c2)c1 ZINC000491281439 1116371240 /nfs/dbraw/zinc/37/12/40/1116371240.db2.gz AXAIKQMPMALFGA-IBGZPJMESA-N 2 0 359.445 4.262 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Br)c2)C[C@H]1C ZINC000539821344 1116385808 /nfs/dbraw/zinc/38/58/08/1116385808.db2.gz UKZVOTMMSLJZBD-DAYGRLMNSA-N 2 0 353.348 4.357 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CCCC[N@@H+]3CCC[C@@H]3CO)cc2)c1 ZINC000462746523 1117749459 /nfs/dbraw/zinc/74/94/59/1117749459.db2.gz URTCMVVQEBYLHK-XMMPIXPASA-N 2 0 366.549 4.297 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccccc2OCc2ccccc2)CC1 ZINC000462766121 1117755497 /nfs/dbraw/zinc/75/54/97/1117755497.db2.gz IMSMMCRSDFHMJI-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP COc1ccc(F)cc1C[NH2+][C@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000462783170 1117765183 /nfs/dbraw/zinc/76/51/83/1117765183.db2.gz JVUJAMRTFAWBPV-HXUWFJFHSA-N 2 0 353.441 4.179 20 0 FIADRP Cc1n[nH]cc1C[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462799138 1117769562 /nfs/dbraw/zinc/76/95/62/1117769562.db2.gz RGFGEUVKFQGCDT-OAQYLSRUSA-N 2 0 358.505 4.200 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000462799657 1117783827 /nfs/dbraw/zinc/78/38/27/1117783827.db2.gz VUJJHADUGPWFDS-ILWGZMRPSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H]2CCN(c3ccccc3F)C2)CC1 ZINC000462801557 1117785131 /nfs/dbraw/zinc/78/51/31/1117785131.db2.gz CKQSURSHAWEUPS-KNKQGSTJSA-N 2 0 373.560 4.285 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@]2(C)CCOC2)c2ccc(F)cc2)CC1 ZINC000462802371 1117785665 /nfs/dbraw/zinc/78/56/65/1117785665.db2.gz LCPUUVLMNPXQLF-YADHBBJMSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000462848255 1117819075 /nfs/dbraw/zinc/81/90/75/1117819075.db2.gz OMYZPCTXEUQOQE-OTWHNJEPSA-N 2 0 362.558 4.404 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000540136991 1117900448 /nfs/dbraw/zinc/90/04/48/1117900448.db2.gz COYFFVYXDSICKS-VLSUOOLDSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(-c2ccccc2)cc1 ZINC000540158411 1117903206 /nfs/dbraw/zinc/90/32/06/1117903206.db2.gz QUHVESKPOGMCKR-NTUVXCKYSA-N 2 0 364.533 4.382 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000540170945 1117912116 /nfs/dbraw/zinc/91/21/16/1117912116.db2.gz NGLJQSCSCOHKIM-BZUAXINKSA-N 2 0 374.447 4.125 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000540165233 1117918519 /nfs/dbraw/zinc/91/85/19/1117918519.db2.gz ZYGNMLLQIWLPAG-OFAXGOBFSA-N 2 0 374.569 4.284 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463044512 1117938737 /nfs/dbraw/zinc/93/87/37/1117938737.db2.gz SAIOUJCFSOVAJQ-SJORKVTESA-N 2 0 352.404 4.129 20 0 FIADRP Cc1cc([C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CC2)ccc1F ZINC000540299887 1117975322 /nfs/dbraw/zinc/97/53/22/1117975322.db2.gz UNPKEIOAMOEXAE-QFIPXVFZSA-N 2 0 356.485 4.315 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCCCC[NH+]2CCCCC2)CCN1Cc1ccccc1 ZINC000463132611 1117983761 /nfs/dbraw/zinc/98/37/61/1117983761.db2.gz SLZFKAAHHDAHAM-FYYLOGMGSA-N 2 0 357.586 4.285 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000540406741 1118037137 /nfs/dbraw/zinc/03/71/37/1118037137.db2.gz LXJVKTGACQDTAK-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP CC(C)(C[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C[NH+]1CCCC1 ZINC000463250511 1118054306 /nfs/dbraw/zinc/05/43/06/1118054306.db2.gz MOQNCPNNDYLDKS-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP CCC[NH+](CCC)CCCN[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540460145 1118065674 /nfs/dbraw/zinc/06/56/74/1118065674.db2.gz BPEFDXGGZISTLM-OAQYLSRUSA-N 2 0 373.585 4.076 20 0 FIADRP Fc1ccc(C2(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)CC2)c(F)c1 ZINC000463289943 1118086218 /nfs/dbraw/zinc/08/62/18/1118086218.db2.gz RAZBVEJSFWIWPB-UHFFFAOYSA-N 2 0 370.487 4.293 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)[C@H](C)C1 ZINC000540551849 1118123352 /nfs/dbraw/zinc/12/33/52/1118123352.db2.gz VORAGIPJXIHYBE-DENIHFKCSA-N 2 0 374.569 4.044 20 0 FIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000540708054 1118196110 /nfs/dbraw/zinc/19/61/10/1118196110.db2.gz MSJJAKRYPUVTDX-IFMALSPDSA-N 2 0 356.510 4.205 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1C(C)(C)C ZINC000540989826 1118339938 /nfs/dbraw/zinc/33/99/38/1118339938.db2.gz XEKBIARIFZMRBR-RXVVDRJESA-N 2 0 366.549 4.402 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cc2c(s1)CCC2 ZINC000540990770 1118340591 /nfs/dbraw/zinc/34/05/91/1118340591.db2.gz RRLGANRYPHADLG-OXQOHEQNSA-N 2 0 370.562 4.044 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)CC2)c1 ZINC000464073780 1118432106 /nfs/dbraw/zinc/43/21/06/1118432106.db2.gz JKOCYOXZVMMEOE-SLFFLAALSA-N 2 0 362.583 4.145 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(-n3ccnc3)cs2)c1 ZINC000541373160 1118492165 /nfs/dbraw/zinc/49/21/65/1118492165.db2.gz IERNSNAMNYPCHY-UHFFFAOYSA-N 2 0 354.523 4.064 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2ccccc2)s1 ZINC000541745719 1118623930 /nfs/dbraw/zinc/62/39/30/1118623930.db2.gz QGJVNAYAMKHFKK-QGZVFWFLSA-N 2 0 357.567 4.092 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000541913872 1118698966 /nfs/dbraw/zinc/69/89/66/1118698966.db2.gz ATIINYFGIMHEOC-BJKOFHAPSA-N 2 0 364.533 4.274 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000541913875 1118699058 /nfs/dbraw/zinc/69/90/58/1118699058.db2.gz ATIINYFGIMHEOC-ZEQRLZLVSA-N 2 0 364.533 4.274 20 0 FIADRP C[N@H+](CCCCOc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845144 1118718955 /nfs/dbraw/zinc/71/89/55/1118718955.db2.gz DCSAGGCVRVFABG-QFIPXVFZSA-N 2 0 352.522 4.300 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1OC ZINC000173306427 1119031656 /nfs/dbraw/zinc/03/16/56/1119031656.db2.gz QCCUYZUHUZSLIE-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173331168 1119033487 /nfs/dbraw/zinc/03/34/87/1119033487.db2.gz LOCSCLMQEXGKRP-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2ccccc2)c1 ZINC000492223661 1119050796 /nfs/dbraw/zinc/05/07/96/1119050796.db2.gz LTZJIRORCGNOPG-VWNXMTODSA-N 2 0 366.549 4.219 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2ccccc2)c1 ZINC000492223658 1119051019 /nfs/dbraw/zinc/05/10/19/1119051019.db2.gz LTZJIRORCGNOPG-ISKFKSNPSA-N 2 0 366.549 4.219 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000492251450 1119057836 /nfs/dbraw/zinc/05/78/36/1119057836.db2.gz HVSLCUCRPCWUDC-VXKWHMMOSA-N 2 0 372.940 4.256 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000178281703 1119382099 /nfs/dbraw/zinc/38/20/99/1119382099.db2.gz MUEGPOZSDBQLTH-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1ccc(OCc2ccccc2)cc1 ZINC000311821913 1119390764 /nfs/dbraw/zinc/39/07/64/1119390764.db2.gz QOIJKFPAGQKHEI-DNVFCKCGSA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311890647 1119393454 /nfs/dbraw/zinc/39/34/54/1119393454.db2.gz DEAUDQNNPMULBG-WMZHIEFXSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000178618467 1119398817 /nfs/dbraw/zinc/39/88/17/1119398817.db2.gz RUFISDMBTVUSIO-GOSISDBHSA-N 2 0 363.505 4.416 20 0 FIADRP Cc1nc2c(s1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000178635521 1119399086 /nfs/dbraw/zinc/39/90/86/1119399086.db2.gz HCXZYGMKFSLYAX-IBGZPJMESA-N 2 0 355.551 4.331 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)[C@@H]2CCCO[C@@H]21 ZINC000312112556 1119403051 /nfs/dbraw/zinc/40/30/51/1119403051.db2.gz NBTSMUCCBCCROV-KJJMTIBFSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)c1ccnn1-c1ccccc1 ZINC000467316090 1119425243 /nfs/dbraw/zinc/42/52/43/1119425243.db2.gz VJVGBHSLMAYPKE-HXUWFJFHSA-N 2 0 374.532 4.230 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccnn1-c1ccccc1 ZINC000467314698 1119425393 /nfs/dbraw/zinc/42/53/93/1119425393.db2.gz WVAQOHOIGFBHBR-LJQANCHMSA-N 2 0 360.505 4.319 20 0 FIADRP C[C@@H]1CC[NH+](Cc2ccccc2C[N@@H+]2CCS[C@@H](C)CC2)CCS1 ZINC000494025218 1119526942 /nfs/dbraw/zinc/52/69/42/1119526942.db2.gz AFJRJISIOAATNG-HDICACEKSA-N 2 0 364.624 4.341 20 0 FIADRP Cc1nc2ccc(C[NH2+]C3CCN(c4cccc(C)n4)CC3)cc2s1 ZINC000494069202 1119536671 /nfs/dbraw/zinc/53/66/71/1119536671.db2.gz NFQFBYBRNBNVJV-UHFFFAOYSA-N 2 0 352.507 4.067 20 0 FIADRP CC(C)C[NH+]1CCC(NCc2ccc(Br)c(Cl)c2)CC1 ZINC000494068534 1119536800 /nfs/dbraw/zinc/53/68/00/1119536800.db2.gz IGPYWMIHLNQSDU-UHFFFAOYSA-N 2 0 359.739 4.313 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(SCC)c2)[C@H](C)C1 ZINC000185538565 1119670294 /nfs/dbraw/zinc/67/02/94/1119670294.db2.gz MDGJRILQRGYYAX-XLIONFOSSA-N 2 0 350.572 4.025 20 0 FIADRP CCOCCCN1CC[C@H]([NH2+]Cc2c(C)cc(C)c(C(C)=O)c2C)[C@H](C)C1 ZINC000187020569 1119761795 /nfs/dbraw/zinc/76/17/95/1119761795.db2.gz GHFACCINHKTJSK-GCJKJVERSA-N 2 0 374.569 4.041 20 0 FIADRP CCCc1csc(C[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)n1 ZINC000494307928 1119824989 /nfs/dbraw/zinc/82/49/89/1119824989.db2.gz HANLZEBCCPVJOJ-UHFFFAOYSA-N 2 0 373.566 4.106 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(-n2ccnc2C)nc1)c1ccc2c(c1)CCCO2 ZINC000153076444 1119895548 /nfs/dbraw/zinc/89/55/48/1119895548.db2.gz PKURQKYBZKGQSW-FQEVSTJZSA-N 2 0 362.477 4.142 20 0 FIADRP Clc1ccc(N2CCC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c(Cl)c1 ZINC000189453235 1119898215 /nfs/dbraw/zinc/89/82/15/1119898215.db2.gz BEBPRBNURUORCJ-IXDOHACOSA-N 2 0 368.352 4.179 20 0 FIADRP COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)c1 ZINC000542484502 1119905768 /nfs/dbraw/zinc/90/57/68/1119905768.db2.gz HIPXXFPBPOTRDC-AOMKIAJQSA-N 2 0 362.477 4.167 20 0 FIADRP CC(C)N(C)c1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000190707197 1119945463 /nfs/dbraw/zinc/94/54/63/1119945463.db2.gz QFEPLHCAHDSWGS-UHFFFAOYSA-N 2 0 366.553 4.202 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(N(C)C(C)C)nc1 ZINC000190706570 1119945603 /nfs/dbraw/zinc/94/56/03/1119945603.db2.gz NIHCOZAZEKTFPW-UHFFFAOYSA-N 2 0 354.542 4.058 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cnn1C(C)C ZINC000191211050 1119965611 /nfs/dbraw/zinc/96/56/11/1119965611.db2.gz QAVSHPUTSMZWSX-SFHVURJKSA-N 2 0 354.542 4.335 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccccc2F)CC1 ZINC001168467180 1119996740 /nfs/dbraw/zinc/99/67/40/1119996740.db2.gz GRCRQBAFXJOISV-QGZVFWFLSA-N 2 0 358.476 4.398 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000494613445 1119998625 /nfs/dbraw/zinc/99/86/25/1119998625.db2.gz JOUHWNLFCBRIAO-UHFFFAOYSA-N 2 0 365.359 4.405 20 0 FIADRP CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000192727627 1120078446 /nfs/dbraw/zinc/07/84/46/1120078446.db2.gz JZJUYAZFAHHKKK-PKTZIBPZSA-N 2 0 357.586 4.061 20 0 FIADRP c1coc(-c2ncc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)s2)c1 ZINC000193070589 1120097642 /nfs/dbraw/zinc/09/76/42/1120097642.db2.gz QWXMJAQNBQHRPJ-UHFFFAOYSA-N 2 0 373.547 4.466 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1F ZINC000542500501 1120227505 /nfs/dbraw/zinc/22/75/05/1120227505.db2.gz ZGFSJQRGLHBWSF-HNAYVOBHSA-N 2 0 362.439 4.147 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2ccccc2Cl)CC1 ZINC001168470508 1120265747 /nfs/dbraw/zinc/26/57/47/1120265747.db2.gz ZREZJROHMPESIK-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000495005693 1120426593 /nfs/dbraw/zinc/42/65/93/1120426593.db2.gz PCTWYNUAXLZEOC-SJORKVTESA-N 2 0 354.485 4.493 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000495415655 1120792257 /nfs/dbraw/zinc/79/22/57/1120792257.db2.gz SCQIBWVTUMQCPE-YSZBQJHXSA-N 2 0 374.544 4.488 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(Br)cc2)CC1 ZINC000232968845 1120795627 /nfs/dbraw/zinc/79/56/27/1120795627.db2.gz ZKMMTVZCUHTNHR-HNNXBMFYSA-N 2 0 353.348 4.234 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495434250 1120808970 /nfs/dbraw/zinc/80/89/70/1120808970.db2.gz REDPQJITYKWERW-MIZPHKNDSA-N 2 0 374.532 4.434 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000234323893 1120914496 /nfs/dbraw/zinc/91/44/96/1120914496.db2.gz NBKNWJQSZNZHTR-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2)C[C@@H](C)O1 ZINC000237412107 1120977009 /nfs/dbraw/zinc/97/70/09/1120977009.db2.gz IRVMEVAEDKZYQN-IAGOWNOFSA-N 2 0 358.913 4.239 20 0 FIADRP Fc1ccc(NC2CC[NH+](Cc3ccc(-n4ccnc4)cc3)CC2)cc1 ZINC000237871721 1120985404 /nfs/dbraw/zinc/98/54/04/1120985404.db2.gz YEJYGIIWIDRNSD-UHFFFAOYSA-N 2 0 350.441 4.088 20 0 FIADRP O[C@@H](C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccc2ccccc2c1 ZINC000915714997 1121037284 /nfs/dbraw/zinc/03/72/84/1121037284.db2.gz SZUQOSDPZYTFKB-DEOSSOPVSA-N 2 0 366.549 4.461 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2cc(C)ccc2C)c1 ZINC000056184863 1121323005 /nfs/dbraw/zinc/32/30/05/1121323005.db2.gz KSOLKYRFVNUOBI-IBGZPJMESA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1OC(F)F ZINC000397998022 1121331851 /nfs/dbraw/zinc/33/18/51/1121331851.db2.gz UKFHSTLNTUHOGH-VQIMIIECSA-N 2 0 360.448 4.288 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(C(C)C)cc3)cc2)CC1 ZINC000061070178 1121506807 /nfs/dbraw/zinc/50/68/07/1121506807.db2.gz WNANBAVYRKRGBE-UHFFFAOYSA-N 2 0 365.565 4.237 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+][C@H](CC[NH+](C)C)c3ccccc3)CCO2)cc1 ZINC001168585275 1121518909 /nfs/dbraw/zinc/51/89/09/1121518909.db2.gz GYWROEFWBTWCPT-WWNPGLIZSA-N 2 0 368.521 4.198 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Br)s1 ZINC000123617715 1121619338 /nfs/dbraw/zinc/61/93/38/1121619338.db2.gz UVGFHLXPESGIBS-LBPRGKRZSA-N 2 0 353.329 4.423 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OCC ZINC000123721230 1121625600 /nfs/dbraw/zinc/62/56/00/1121625600.db2.gz ILAUSJWVWVIDKE-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c1 ZINC000123912926 1121645378 /nfs/dbraw/zinc/64/53/78/1121645378.db2.gz LQMVQLKVMOVEMD-INIZCTEOSA-N 2 0 365.521 4.219 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(Cc3ccccc3)c2)c1 ZINC000123976777 1121651996 /nfs/dbraw/zinc/65/19/96/1121651996.db2.gz RTGLRJSLWIZHET-IBGZPJMESA-N 2 0 362.521 4.234 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124655456 1121712086 /nfs/dbraw/zinc/71/20/86/1121712086.db2.gz HROINLYQUWYUSO-FGTMMUONSA-N 2 0 356.510 4.302 20 0 FIADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000671754081 1121753543 /nfs/dbraw/zinc/75/35/43/1121753543.db2.gz QLGLYCARKRWYNY-RBZQAINGSA-N 2 0 363.549 4.213 20 0 FIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000125453233 1121780528 /nfs/dbraw/zinc/78/05/28/1121780528.db2.gz PNKXGWVGYKMBNQ-MRXNPFEDSA-N 2 0 374.550 4.328 20 0 FIADRP COCc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)o1 ZINC000125554264 1121791082 /nfs/dbraw/zinc/79/10/82/1121791082.db2.gz ARWHRRDEHLYNEB-QZTJIDSGSA-N 2 0 356.510 4.194 20 0 FIADRP C[C@@H]([NH2+]CC1(c2ccc(Br)s2)CCC1)C1CC[NH+](C)CC1 ZINC000671765039 1121808093 /nfs/dbraw/zinc/80/80/93/1121808093.db2.gz XPNYIILEEUTWJA-CYBMUJFWSA-N 2 0 371.388 4.252 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1Br ZINC000125724706 1121817457 /nfs/dbraw/zinc/81/74/57/1121817457.db2.gz JUKPZXDQHUNNHO-GJZGRUSLSA-N 2 0 369.347 4.229 20 0 FIADRP Cc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000126762904 1121984053 /nfs/dbraw/zinc/98/40/53/1121984053.db2.gz PNJMXWJPXFJYEV-QZTJIDSGSA-N 2 0 355.501 4.298 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3c(F)cccc3F)cc2)C1 ZINC000917008898 1121997618 /nfs/dbraw/zinc/99/76/18/1121997618.db2.gz USPYFVWZCSGBGR-IERDGZPVSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001168611648 1122009168 /nfs/dbraw/zinc/00/91/68/1122009168.db2.gz WJOYKVYUNLVRHQ-YLJYHZDGSA-N 2 0 360.542 4.156 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)c1 ZINC000186367352 1122063428 /nfs/dbraw/zinc/06/34/28/1122063428.db2.gz PHIFIJLQFCRKLK-UHFFFAOYSA-N 2 0 368.521 4.463 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cccs2)CC1 ZINC000127236791 1122067891 /nfs/dbraw/zinc/06/78/91/1122067891.db2.gz WLAYFJHSUULOBQ-JKSUJKDBSA-N 2 0 361.530 4.441 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091333605 1122141485 /nfs/dbraw/zinc/14/14/85/1122141485.db2.gz FMBIVKPLOCUJJF-LJQANCHMSA-N 2 0 370.368 4.062 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC001168619660 1122167135 /nfs/dbraw/zinc/16/71/35/1122167135.db2.gz ZLUHQBNBAOWUMR-OFNKIYASSA-N 2 0 372.553 4.302 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168626995 1122187947 /nfs/dbraw/zinc/18/79/47/1122187947.db2.gz ZVRJXQBEBCIYRH-BPBCIEFSSA-N 2 0 360.542 4.143 20 0 FIADRP COCCC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000282287248 1122229506 /nfs/dbraw/zinc/22/95/06/1122229506.db2.gz LLLJYBJDYMUNCK-OAQYLSRUSA-N 2 0 362.464 4.284 20 0 FIADRP CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000128983796 1122484320 /nfs/dbraw/zinc/48/43/20/1122484320.db2.gz FTUOYDPZXMLKAH-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP CS[C@H]1CCC[C@@H]([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000129308265 1122567583 /nfs/dbraw/zinc/56/75/83/1122567583.db2.gz BOYMVNILFJBRNV-UXHICEINSA-N 2 0 350.547 4.096 20 0 FIADRP C[C@@H]1C[C@H](N[C@H]2CC[NH+](C)[C@H](c3ccccc3)C2)C[N@@H+]1Cc1ccccc1 ZINC000556104969 1122656302 /nfs/dbraw/zinc/65/63/02/1122656302.db2.gz OANNHPYKNHDELQ-DLTYFMDKSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)s2)C[C@H](C)O1 ZINC000069833379 1122690500 /nfs/dbraw/zinc/69/05/00/1122690500.db2.gz KCPGUUBYAZTRNO-GASCZTMLSA-N 2 0 364.942 4.301 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(=O)OC)cc1 ZINC000556178778 1122718072 /nfs/dbraw/zinc/71/80/72/1122718072.db2.gz ISLFBGVYDQMBFL-KNQAVFIVSA-N 2 0 366.505 4.036 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCCC[NH+]2CCCC2)C3)cc1 ZINC000556232898 1122749490 /nfs/dbraw/zinc/74/94/90/1122749490.db2.gz LOMLTGBMQLYOGX-NUNAXRQHSA-N 3 0 355.570 4.038 20 0 FIADRP CC1(C)CCCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230582 1122757137 /nfs/dbraw/zinc/75/71/37/1122757137.db2.gz OUFMFCHCHOHKOT-FCHUYYIVSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]C2c3ccccc3-c3ccccc32)C[C@H](C)O1 ZINC000498451300 1122801229 /nfs/dbraw/zinc/80/12/29/1122801229.db2.gz GDUCQBWXPIENCH-ROUUACIJSA-N 2 0 350.506 4.235 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)c1 ZINC000556589593 1122984336 /nfs/dbraw/zinc/98/43/36/1122984336.db2.gz NMPZORBQFNJLKT-OAHLLOKOSA-N 2 0 361.917 4.436 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498805386 1123022784 /nfs/dbraw/zinc/02/27/84/1123022784.db2.gz KFLXBFBOSXHYAY-YMPZKCBVSA-N 2 0 372.528 4.119 20 0 FIADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000556868726 1123149873 /nfs/dbraw/zinc/14/98/73/1123149873.db2.gz BMLHNFLWICWXPQ-VAMGGRTRSA-N 2 0 355.551 4.232 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(C)c1OC ZINC000556871489 1123153886 /nfs/dbraw/zinc/15/38/86/1123153886.db2.gz MUHNTMZEVSVOEF-HNNXBMFYSA-N 2 0 360.473 4.064 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000131791152 1123187496 /nfs/dbraw/zinc/18/74/96/1123187496.db2.gz CBIFVIANFGLJPQ-CUWPLCDZSA-N 2 0 362.558 4.119 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1ccc2n[nH]cc2c1 ZINC000556923530 1123232903 /nfs/dbraw/zinc/23/29/03/1123232903.db2.gz KWIJFDYDYRLPFL-PZMSFCMUSA-N 2 0 360.505 4.124 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C(C)(C)c1ccccc1 ZINC000132608813 1123300090 /nfs/dbraw/zinc/30/00/90/1123300090.db2.gz JMEDIRXSKDCIPT-IBGZPJMESA-N 2 0 366.549 4.099 20 0 FIADRP CCOc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499201979 1123322071 /nfs/dbraw/zinc/32/20/71/1123322071.db2.gz KWEYDIIHLDWHDP-WBDAEOGXSA-N 2 0 364.533 4.413 20 0 FIADRP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000557038394 1123331033 /nfs/dbraw/zinc/33/10/33/1123331033.db2.gz QYIFTPJDLOVDIF-UHFFFAOYSA-N 2 0 368.569 4.212 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499218599 1123332931 /nfs/dbraw/zinc/33/29/31/1123332931.db2.gz YPJYKMJERIHLGH-XNBWIAOKSA-N 2 0 356.554 4.103 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499231279 1123339667 /nfs/dbraw/zinc/33/96/67/1123339667.db2.gz UTCPZCBFWQFIAD-FDTGPBLFSA-N 2 0 364.533 4.411 20 0 FIADRP CCOc1cc(CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1OC ZINC000133883146 1123556471 /nfs/dbraw/zinc/55/64/71/1123556471.db2.gz LPOZFFQCDAETQV-UHFFFAOYSA-N 2 0 374.569 4.413 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000237504938 1123635956 /nfs/dbraw/zinc/63/59/56/1123635956.db2.gz PQNNNDCDCJPTPN-SFHVURJKSA-N 2 0 365.521 4.482 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccccc1 ZINC000615316045 1123988570 /nfs/dbraw/zinc/98/85/70/1123988570.db2.gz HXXRXNPFWLUMFE-RTBURBONSA-N 2 0 365.521 4.035 20 0 FIADRP COCc1ccccc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245657217 1124170247 /nfs/dbraw/zinc/17/02/47/1124170247.db2.gz DUTKYMSQUCPYPY-WBDAEOGXSA-N 2 0 350.506 4.118 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2[C@@H]4c5ccccc5C[C@H]24)C3)cc1 ZINC000245661214 1124177270 /nfs/dbraw/zinc/17/72/70/1124177270.db2.gz FTYJDMQEVJSUHT-KXSDHGPUSA-N 2 0 358.529 4.358 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2[C@@H]4CCO[C@@H]4C24CCCC4)C3)cc1 ZINC000245695111 1124204331 /nfs/dbraw/zinc/20/43/31/1124204331.db2.gz KYRYLTQLEWPNSF-UKIFCOJHSA-N 2 0 366.549 4.119 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000474598284 1124216925 /nfs/dbraw/zinc/21/69/25/1124216925.db2.gz KQQQNQVHQDQRTG-UZROPOIGSA-N 2 0 364.496 4.223 20 0 FIADRP CCO[C@@H]1C[C@@H]([NH2+]C2CCN([C@H](C)c3ccncc3)CC2)C1(CC)CC ZINC000245843408 1124261245 /nfs/dbraw/zinc/26/12/45/1124261245.db2.gz DXMHYXMAECIDAO-DUXKGJEZSA-N 2 0 359.558 4.180 20 0 FIADRP CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)CCO1 ZINC000245989826 1124305395 /nfs/dbraw/zinc/30/53/95/1124305395.db2.gz QOPCBIMFAYLBFT-AGHHOFFYSA-N 2 0 362.558 4.261 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)CCO1 ZINC000245989829 1124306052 /nfs/dbraw/zinc/30/60/52/1124306052.db2.gz QOPCBIMFAYLBFT-ZNLUXHQJSA-N 2 0 362.558 4.261 20 0 FIADRP C[C@@H](C[C@H]1CCOC1)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000765895166 1124338783 /nfs/dbraw/zinc/33/87/83/1124338783.db2.gz DEPHBIIWYIRHJG-NZQKXSOJSA-N 2 0 358.570 4.126 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1C ZINC000542852114 1124465488 /nfs/dbraw/zinc/46/54/88/1124465488.db2.gz QPCMNONXZYERAX-REWPJTCUSA-N 2 0 366.549 4.419 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1SC ZINC000246508059 1124519392 /nfs/dbraw/zinc/51/93/92/1124519392.db2.gz TXCKMGQWZMOVDN-IAGOWNOFSA-N 2 0 350.572 4.436 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000246528711 1124524674 /nfs/dbraw/zinc/52/46/74/1124524674.db2.gz GGTKMPVJGFPPMH-IXDOHACOSA-N 2 0 374.475 4.425 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+]3CCCC[C@@H]3C[C@@H]3CCC[NH+]3C)CCO2)cc1 ZINC001168662268 1124562679 /nfs/dbraw/zinc/56/26/79/1124562679.db2.gz DODNCVJDCFUZEH-GNXKAVGDSA-N 2 0 372.553 4.254 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000247015816 1124581983 /nfs/dbraw/zinc/58/19/83/1124581983.db2.gz KOSIWDIGSRAVOA-RMFNQSEZSA-N 2 0 369.475 4.250 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000247059379 1124585915 /nfs/dbraw/zinc/58/59/15/1124585915.db2.gz NRXWHOAJWLGMKD-QZTJIDSGSA-N 2 0 372.557 4.276 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3c2cnn3C)C1 ZINC000247183223 1124597407 /nfs/dbraw/zinc/59/74/07/1124597407.db2.gz VHAUQHVAIAGUQI-HMFYCAOWSA-N 2 0 366.553 4.065 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000247190115 1124597694 /nfs/dbraw/zinc/59/76/94/1124597694.db2.gz VSMYYTMQGZMOCK-KURKYZTESA-N 2 0 354.542 4.057 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)C1 ZINC000247204591 1124599299 /nfs/dbraw/zinc/59/92/99/1124599299.db2.gz WMVSWWYAYKREHW-YJBOKZPZSA-N 2 0 371.550 4.128 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000765922255 1124611804 /nfs/dbraw/zinc/61/18/04/1124611804.db2.gz WYJBGKYEEMIFHK-MRXNPFEDSA-N 2 0 359.901 4.060 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)CC2 ZINC000248168510 1124749020 /nfs/dbraw/zinc/74/90/20/1124749020.db2.gz UFUJQNMTDIWFTG-SCWSEQNSSA-N 2 0 356.535 4.417 20 0 FIADRP COCC[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412042 1124764651 /nfs/dbraw/zinc/76/46/51/1124764651.db2.gz ZYRFVYKYAJVYOM-FBBABVLZSA-N 2 0 362.533 4.016 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1 ZINC000248456346 1124771819 /nfs/dbraw/zinc/77/18/19/1124771819.db2.gz SFDTZJHHWAXYGU-IERDGZPVSA-N 2 0 358.913 4.148 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000248458537 1124772539 /nfs/dbraw/zinc/77/25/39/1124772539.db2.gz UVIHBJFPTVXANJ-YADHBBJMSA-N 2 0 370.924 4.148 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccsc1 ZINC000249120536 1124844910 /nfs/dbraw/zinc/84/49/10/1124844910.db2.gz TWULWQJTIDCKCS-LEWJYISDSA-N 2 0 358.551 4.336 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215054 1124891075 /nfs/dbraw/zinc/89/10/75/1124891075.db2.gz YDYJDAKIGCXANJ-OAQYLSRUSA-N 2 0 351.494 4.110 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000089214717 1124891180 /nfs/dbraw/zinc/89/11/80/1124891180.db2.gz KPZHOTLREYDFMF-OAQYLSRUSA-N 2 0 351.494 4.110 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)F)c1 ZINC000089215101 1124891285 /nfs/dbraw/zinc/89/12/85/1124891285.db2.gz BYPDQNAMJSIWNT-HNNXBMFYSA-N 2 0 361.436 4.250 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215498 1124891552 /nfs/dbraw/zinc/89/15/52/1124891552.db2.gz BLVASNLZFMQCKW-MSOLQXFVSA-N 2 0 353.510 4.088 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000089520331 1124913554 /nfs/dbraw/zinc/91/35/54/1124913554.db2.gz ZSJVKBKDDFDEBK-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@H]([NH2+]C1(c2ccc(Br)cc2)CCC1)C1CC[NH+](C)CC1 ZINC000679015116 1125004026 /nfs/dbraw/zinc/00/40/26/1125004026.db2.gz DMDSRSTXGUUOFG-AWEZNQCLSA-N 2 0 351.332 4.148 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2cc(F)ccc2o1 ZINC000092821186 1125244919 /nfs/dbraw/zinc/24/49/19/1125244919.db2.gz KHUSEQVGLAJPRD-UHFFFAOYSA-N 2 0 368.456 4.100 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000093399090 1125318655 /nfs/dbraw/zinc/31/86/55/1125318655.db2.gz SKBLFVHHFBCZRX-NRFANRHFSA-N 2 0 356.510 4.185 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2)ccc1OC ZINC000182285281 1125323754 /nfs/dbraw/zinc/32/37/54/1125323754.db2.gz YKPZUTVBPOAWMG-KKSFZXQISA-N 2 0 374.500 4.060 20 0 FIADRP C(=C\C[N@@H+]1CCC=C(c2ccco2)C1)\C[NH+]1CCC=C(c2ccco2)C1 ZINC000511145363 370688748 /nfs/dbraw/zinc/68/87/48/370688748.db2.gz VMTDARFAMUKKMC-UPHRSURJSA-N 2 0 350.462 4.307 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ncc(Br)cc1F ZINC000186902535 568007363 /nfs/dbraw/zinc/00/73/63/568007363.db2.gz FCIQNNPWHQDOSJ-STQMWFEESA-N 2 0 360.315 4.144 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ncc(Br)cc1F ZINC000186902519 568007371 /nfs/dbraw/zinc/00/73/71/568007371.db2.gz FCIQNNPWHQDOSJ-OLZOCXBDSA-N 2 0 360.315 4.144 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ncc(Br)cc1F ZINC000187012229 568044897 /nfs/dbraw/zinc/04/48/97/568044897.db2.gz LDHQWFAEZVWXIA-AWEZNQCLSA-N 2 0 372.326 4.146 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C)c(C)c2)CC1 ZINC000521431763 568048041 /nfs/dbraw/zinc/04/80/41/568048041.db2.gz RTCDMRCLXQBJDT-LJQANCHMSA-N 2 0 359.558 4.074 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)ccc1OCc1cccs1 ZINC000067507221 568076361 /nfs/dbraw/zinc/07/63/61/568076361.db2.gz MFHJLPABODSMNK-GOSISDBHSA-N 2 0 374.550 4.156 20 0 FIADRP CN(C)[C@H](C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)c1ccsc1 ZINC000563119847 568224590 /nfs/dbraw/zinc/22/45/90/568224590.db2.gz JPUMPQLUMXKNFC-NHCUHLMSSA-N 2 0 369.578 4.138 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)ccc1OC ZINC000182505905 1125539548 /nfs/dbraw/zinc/53/95/48/1125539548.db2.gz HZMIWOWGPIBDON-OAHLLOKOSA-N 2 0 361.917 4.436 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000152774725 1125649647 /nfs/dbraw/zinc/64/96/47/1125649647.db2.gz LQFITOKNWYXJJS-INIZCTEOSA-N 2 0 360.473 4.016 20 0 FIADRP C[C@@H](Cc1ccccc1F)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000619766645 1125688092 /nfs/dbraw/zinc/68/80/92/1125688092.db2.gz RVEGCQHHJCTSGX-SFHVURJKSA-N 2 0 356.485 4.021 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCCC(C)(C)CO)cc1C[NH+]1CCCCC1 ZINC000183015992 1125721214 /nfs/dbraw/zinc/72/12/14/1125721214.db2.gz YBIGPGXFAKPYMC-GOSISDBHSA-N 2 0 362.558 4.130 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)C2CCOCC2)cc1C[NH+]1CCCCC1 ZINC000183130480 1125754648 /nfs/dbraw/zinc/75/46/48/1125754648.db2.gz NTMSXBFVVKSFCK-QZTJIDSGSA-N 2 0 360.542 4.147 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[NH2+]C4(CCC4)C2)CCC3)cc1 ZINC000643545821 1079658204 /nfs/dbraw/zinc/65/82/04/1079658204.db2.gz COQXRDOZAYJNDF-IAGOWNOFSA-N 2 0 353.535 4.452 20 0 FIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000620120299 1125783621 /nfs/dbraw/zinc/78/36/21/1125783621.db2.gz DZUUQBBKILYGTN-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc3oc(C(=O)OC)cc3c2)CC1 ZINC000610213406 1079973294 /nfs/dbraw/zinc/97/32/94/1079973294.db2.gz CXHNWINXFSQWNC-UHFFFAOYSA-N 2 0 372.509 4.163 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ccc(SC(F)F)cc2)CC1 ZINC000154536689 1080232250 /nfs/dbraw/zinc/23/22/50/1080232250.db2.gz HXTXFYVPGLNUKO-MRXNPFEDSA-N 2 0 371.541 4.070 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180119342 1080451075 /nfs/dbraw/zinc/45/10/75/1080451075.db2.gz JWTKLXRRLNNOTM-XMSQKQJNSA-N 2 0 371.956 4.045 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cnn(C4CCC4)c3)cc2)C1 ZINC001648792077 1080503810 /nfs/dbraw/zinc/50/38/10/1080503810.db2.gz HJZDVMSTSQJZGQ-SFHVURJKSA-N 2 0 352.526 4.130 20 0 FIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](C[C@H]3[C@H](c4ccccc4)C3(F)F)C2)CC1 ZINC001167255141 1080914235 /nfs/dbraw/zinc/91/42/35/1080914235.db2.gz DVYUJJPTSLZWKM-GIVPXCGWSA-N 2 0 362.508 4.479 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OCc1cccs1 ZINC000530674595 1080979460 /nfs/dbraw/zinc/97/94/60/1080979460.db2.gz CFISXURXCNQSPW-QZTJIDSGSA-N 2 0 374.550 4.298 20 0 FIADRP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001648811050 1081124734 /nfs/dbraw/zinc/12/47/34/1081124734.db2.gz CXMJBWJLPGNQKY-KDURUIRLSA-N 2 0 356.558 4.465 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2cc3n(n2)CCCC3)cc1 ZINC000655714406 1081131219 /nfs/dbraw/zinc/13/12/19/1081131219.db2.gz CJFVTJNOKXYMQT-UHFFFAOYSA-N 2 0 374.532 4.238 20 0 FIADRP c1cc(SCC[NH+]2CCCC2)ccc1NC1CC[NH+](CC2CC2)CC1 ZINC000651960075 1081146207 /nfs/dbraw/zinc/14/62/07/1081146207.db2.gz PMRGRDBXHZTFSR-UHFFFAOYSA-N 2 0 359.583 4.161 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000655745315 1081165205 /nfs/dbraw/zinc/16/52/05/1081165205.db2.gz LOVPWDGVOWJESO-XXBNENTESA-N 2 0 371.569 4.116 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805432 1081210550 /nfs/dbraw/zinc/21/05/50/1081210550.db2.gz OBMUSRPJYFNUDD-DIGLBZAJSA-N 2 0 369.372 4.162 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000655805590 1081213774 /nfs/dbraw/zinc/21/37/74/1081213774.db2.gz PTVAVMNYTNDBQV-CVAIRZPRSA-N 2 0 360.448 4.307 20 0 FIADRP COc1ccc([C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C(C)C)c(Br)c1 ZINC000655804443 1081213933 /nfs/dbraw/zinc/21/39/33/1081213933.db2.gz YTFLHEYVHQQMAN-QWQRMKEZSA-N 2 0 369.347 4.085 20 0 FIADRP Clc1cccc(Oc2ccccc2)c1C[NH2+]CCCC[NH+]1CCOCC1 ZINC001648814175 1081218036 /nfs/dbraw/zinc/21/80/36/1081218036.db2.gz HYXGCQXELGWHLX-UHFFFAOYSA-N 2 0 374.912 4.334 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC000655851246 1081260057 /nfs/dbraw/zinc/26/00/57/1081260057.db2.gz CPDTVCHVGUKXQV-UGKGYDQZSA-N 2 0 356.554 4.163 20 0 FIADRP c1cc(C[N@@H+](CCc2noc3ccccc32)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000655938835 1081364775 /nfs/dbraw/zinc/36/47/75/1081364775.db2.gz FHJTYZVCYADOCJ-FQEVSTJZSA-N 2 0 367.518 4.076 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2OCCc4ccccc42)C3)cc1 ZINC000683692377 1081390703 /nfs/dbraw/zinc/39/07/03/1081390703.db2.gz PQIIPDWDWGNWIU-PIATZUFCSA-N 2 0 362.517 4.086 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000683765979 1081518901 /nfs/dbraw/zinc/51/89/01/1081518901.db2.gz NYGRPACJCFWKFE-UHFFFAOYSA-N 2 0 363.505 4.245 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](C)CC2)C(C)C)c(Br)c1 ZINC000580131905 1081708377 /nfs/dbraw/zinc/70/83/77/1081708377.db2.gz IYCLQTQNLVLJFA-SFHVURJKSA-N 2 0 369.347 4.086 20 0 FIADRP Cn1cc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c2ccc(F)cc21 ZINC000471604891 1082053613 /nfs/dbraw/zinc/05/36/13/1082053613.db2.gz YIZKEUUWQNXGEJ-UHFFFAOYSA-N 2 0 357.517 4.247 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398201909 1082117048 /nfs/dbraw/zinc/11/70/48/1082117048.db2.gz PXNDEWGKKDHYMU-WMZHIEFXSA-N 2 0 352.522 4.476 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2csc3c2cccc3Br)CC1 ZINC000580903807 1082213941 /nfs/dbraw/zinc/21/39/41/1082213941.db2.gz XSFUAUZYNDASLI-UHFFFAOYSA-N 2 0 351.313 4.015 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[N@H+](CCOCC3CCCC3)C2)cc1 ZINC000656404948 1082331135 /nfs/dbraw/zinc/33/11/35/1082331135.db2.gz HIYFBLANNAOSJU-ZJZGAYNASA-N 2 0 368.565 4.036 20 0 FIADRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000430546227 1082426937 /nfs/dbraw/zinc/42/69/37/1082426937.db2.gz JKAFWQHJWWONHF-SFHVURJKSA-N 2 0 365.521 4.321 20 0 FIADRP [NH3+][C@@H]1CCCC[C@H]1NCc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000581304924 1082447778 /nfs/dbraw/zinc/44/77/78/1082447778.db2.gz JMCMNTGTPMOYRX-HUUCEWRRSA-N 2 0 360.914 4.076 20 0 FIADRP CCC[N@H+](CC)C[C@@H](C)NC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000581399657 1082526610 /nfs/dbraw/zinc/52/66/10/1082526610.db2.gz ZFDZHOGHERHKBM-QGZVFWFLSA-N 2 0 351.966 4.014 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccncc2OCC[NH+](C)C)C[C@H](c2ccccc2)C1 ZINC000581570562 1082670004 /nfs/dbraw/zinc/67/00/04/1082670004.db2.gz BCWBRBAGQHQLHQ-VLCRHTCISA-N 2 0 367.537 4.084 20 0 FIADRP CSC1(C[NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC[NH+](C)CC1 ZINC000581637290 1082734683 /nfs/dbraw/zinc/73/46/83/1082734683.db2.gz ORIAJRXWSMYDNS-INIZCTEOSA-N 2 0 359.366 4.398 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2ccc(C)o2)c1 ZINC000647172382 1082791595 /nfs/dbraw/zinc/79/15/95/1082791595.db2.gz UQNBOCMUVFICMA-UHFFFAOYSA-N 2 0 366.509 4.120 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cncc(Br)c1 ZINC000581678617 1082795014 /nfs/dbraw/zinc/79/50/14/1082795014.db2.gz VCEHMDLUNXBOEM-GJZGRUSLSA-N 2 0 354.336 4.007 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F ZINC000581780633 1082902455 /nfs/dbraw/zinc/90/24/55/1082902455.db2.gz NBEUVCKSTFKYGX-RHSMWYFYSA-N 2 0 352.404 4.034 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H](Cc2ccccc2)c2ccc(OC)cc2)CC1 ZINC000581914059 1083034998 /nfs/dbraw/zinc/03/49/98/1083034998.db2.gz MLMAWCLTMOTEQA-QHCPKHFHSA-N 2 0 352.522 4.443 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000430758101 1083145951 /nfs/dbraw/zinc/14/59/51/1083145951.db2.gz YZBXQAQJWXFOCM-AJKMGBEJSA-N 2 0 369.322 4.153 20 0 FIADRP Cc1cccc([C@H](C)[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000430925463 1083238767 /nfs/dbraw/zinc/23/87/67/1083238767.db2.gz LSFDMVVHMZZLJW-FQEVSTJZSA-N 2 0 357.586 4.184 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCCc4cccnc43)C3(CCC3)C2)cc1 ZINC000658318721 1083405832 /nfs/dbraw/zinc/40/58/32/1083405832.db2.gz SJLVZDQOFSVSEW-VXKWHMMOSA-N 2 0 361.533 4.351 20 0 FIADRP COCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658318663 1083405903 /nfs/dbraw/zinc/40/59/03/1083405903.db2.gz RTAAYXDWVARCHR-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP CC(C)n1cc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000658320214 1083407011 /nfs/dbraw/zinc/40/70/11/1083407011.db2.gz RUZDZRMPUAYGLH-DENIHFKCSA-N 2 0 366.553 4.417 20 0 FIADRP C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000658339391 1083415667 /nfs/dbraw/zinc/41/56/67/1083415667.db2.gz JTTDAQOBKHZTMN-LTKAXEJJSA-N 2 0 366.549 4.184 20 0 FIADRP [NH3+][C@@H](CCC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000582001096 1083475709 /nfs/dbraw/zinc/47/57/09/1083475709.db2.gz WKJOMGQSTLYPFQ-QFIPXVFZSA-N 2 0 365.521 4.134 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1cccc(OC(C)(C)C)n1 ZINC000548487951 1083490005 /nfs/dbraw/zinc/49/00/05/1083490005.db2.gz GDCARKXTJHSJJE-GHTZIAJQSA-N 2 0 367.537 4.259 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1cccc(OC(C)(C)C)n1 ZINC000548487954 1083490416 /nfs/dbraw/zinc/49/04/16/1083490416.db2.gz GDCARKXTJHSJJE-RXVVDRJESA-N 2 0 367.537 4.259 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000510952622 1083529611 /nfs/dbraw/zinc/52/96/11/1083529611.db2.gz RXRCXPFDJBRLLG-NRFANRHFSA-N 2 0 357.586 4.140 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3Cl)C2)[C@@H](C)C1 ZINC000510979878 1083554943 /nfs/dbraw/zinc/55/49/43/1083554943.db2.gz FSHYRVLFJBIYCQ-RJPLPAITSA-N 2 0 364.961 4.313 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)cc1)C1CC1 ZINC000458296566 1083812688 /nfs/dbraw/zinc/81/26/88/1083812688.db2.gz YJDHNIMQVLTTHO-UHFFFAOYSA-N 2 0 365.521 4.293 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@@H](C)[C@@H]3CCC[NH2+]C3)c2C1 ZINC000236720933 1083973100 /nfs/dbraw/zinc/97/31/00/1083973100.db2.gz SCUXUQKVEFZBBW-QZTJIDSGSA-N 2 0 357.542 4.013 20 0 FIADRP c1cn(-c2csc(C[NH2+]C[C@H]3CCCO[C@@H]3c3ccccc3)c2)cn1 ZINC001648924805 1084003690 /nfs/dbraw/zinc/00/36/90/1084003690.db2.gz SPEDUVFSSVZBLX-YLJYHZDGSA-N 2 0 353.491 4.191 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCC[NH+](C)C2CCCCC2)cc1)C1CC1 ZINC000511389992 1084160383 /nfs/dbraw/zinc/16/03/83/1084160383.db2.gz GVRYMSWBEDUFEU-UHFFFAOYSA-N 2 0 371.569 4.055 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CNCc1ncc(Cl)s1 ZINC000472080484 1084252558 /nfs/dbraw/zinc/25/25/58/1084252558.db2.gz PIOHJMTWFXAXMC-UHFFFAOYSA-N 2 0 361.898 4.311 20 0 FIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000537969585 1084319522 /nfs/dbraw/zinc/31/95/22/1084319522.db2.gz GYNFNZWWFGOFQR-BZUAXINKSA-N 2 0 358.979 4.202 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cc2n(n1)CCC2 ZINC000414108954 1084578340 /nfs/dbraw/zinc/57/83/40/1084578340.db2.gz GSTHIOVKBIXIRM-MRXNPFEDSA-N 2 0 372.944 4.046 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1csc(-c2ccccc2)n1 ZINC000414106889 1084579522 /nfs/dbraw/zinc/57/95/22/1084579522.db2.gz YARHSHDONTXDKO-KZNAEPCWSA-N 2 0 373.566 4.350 20 0 FIADRP FC(F)(F)c1cccc(CCC[NH2+]Cc2ccnn2-c2cc[nH+]cc2)c1 ZINC000657330949 1084599399 /nfs/dbraw/zinc/59/93/99/1084599399.db2.gz IJMAZZUVQQSFEM-UHFFFAOYSA-N 2 0 360.383 4.009 20 0 FIADRP c1c2ccncc2sc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000657335323 1084622949 /nfs/dbraw/zinc/62/29/49/1084622949.db2.gz NQBUIWRSTRKXNY-GOSISDBHSA-N 2 0 351.519 4.298 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000657367962 1084761399 /nfs/dbraw/zinc/76/13/99/1084761399.db2.gz RRWSSSKBCKOYHR-CALCHBBNSA-N 2 0 373.566 4.098 20 0 FIADRP Brc1ccc([C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)cc1 ZINC000414184196 1084762559 /nfs/dbraw/zinc/76/25/59/1084762559.db2.gz NRGFSBLETVSIIM-GOSISDBHSA-N 2 0 356.267 4.338 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cnn1-c1cccc(Cl)c1 ZINC000414202362 1084799742 /nfs/dbraw/zinc/79/97/42/1084799742.db2.gz ZCDNGXYTROYBRL-NVXWUHKLSA-N 2 0 360.933 4.217 20 0 FIADRP CSC1(C[NH2+][C@H]2CCSc3c(Cl)cccc32)CC[NH+](C)CC1 ZINC000582271110 1084822940 /nfs/dbraw/zinc/82/29/40/1084822940.db2.gz JQDCTXJUMIOKRS-HNNXBMFYSA-N 2 0 356.988 4.294 20 0 FIADRP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657429693 1085003509 /nfs/dbraw/zinc/00/35/09/1085003509.db2.gz IRBPUQVJXZQRGM-LPHOPBHVSA-N 2 0 351.519 4.297 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)CC1 ZINC000472584094 1085049317 /nfs/dbraw/zinc/04/93/17/1085049317.db2.gz GOVNTAOTMZVGSZ-XXFRDUSWSA-N 2 0 369.597 4.361 20 0 FIADRP COc1ccc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000310886270 1085073569 /nfs/dbraw/zinc/07/35/69/1085073569.db2.gz JIICXMRKIWSNQE-NRFANRHFSA-N 2 0 358.913 4.350 20 0 FIADRP COc1ccc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000310886271 1085074058 /nfs/dbraw/zinc/07/40/58/1085074058.db2.gz JIICXMRKIWSNQE-OAQYLSRUSA-N 2 0 358.913 4.350 20 0 FIADRP COc1ncc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000582681517 1085368368 /nfs/dbraw/zinc/36/83/68/1085368368.db2.gz YIWUAVMEGBNDOG-XYJFISCASA-N 2 0 373.928 4.305 20 0 FIADRP C[C@@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)C1CC[NH2+]CC1 ZINC000237345144 1085403576 /nfs/dbraw/zinc/40/35/76/1085403576.db2.gz XNASFUIUEROBTJ-SFHVURJKSA-N 2 0 371.569 4.415 20 0 FIADRP CC(C)(C)[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657534697 1085449125 /nfs/dbraw/zinc/44/91/25/1085449125.db2.gz CTUAXVUYEPWCRE-PMACEKPBSA-N 2 0 350.591 4.462 20 0 FIADRP CC1(C)CC([NH2+][C@H]2CCc3cc(Br)ccc32)CC(C)(C)[NH2+]1 ZINC000040226562 1085550704 /nfs/dbraw/zinc/55/07/04/1085550704.db2.gz DNMURIJWNLPTJG-INIZCTEOSA-N 2 0 351.332 4.335 20 0 FIADRP COCc1ccc(C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000549549502 1085672447 /nfs/dbraw/zinc/67/24/47/1085672447.db2.gz UDVDABGUWCVAKZ-OALUTQOASA-N 2 0 352.522 4.079 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000657613511 1085689080 /nfs/dbraw/zinc/68/90/80/1085689080.db2.gz MFRDZSCDJHAPPD-UHFFFAOYSA-N 2 0 369.456 4.164 20 0 FIADRP FC(F)(F)c1cscc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613950 1085699368 /nfs/dbraw/zinc/69/93/68/1085699368.db2.gz YJLALVNTHOCMFP-UHFFFAOYSA-N 2 0 369.456 4.164 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613877 1085699740 /nfs/dbraw/zinc/69/97/40/1085699740.db2.gz VOOCFBFUTNIQGO-KRWDZBQOSA-N 2 0 357.929 4.168 20 0 FIADRP CC1(C)CC([NH2+]Cc2cccc(OCc3ccccn3)c2)CC(C)(C)[NH2+]1 ZINC000236739947 1085719435 /nfs/dbraw/zinc/71/94/35/1085719435.db2.gz GXSPXNWYDWPAGQ-UHFFFAOYSA-N 2 0 353.510 4.059 20 0 FIADRP O[C@@H](C[C@H]1CCCCC[N@@H+]1CCC[NH+]1CCCCC1)c1cccs1 ZINC000161401388 1085722128 /nfs/dbraw/zinc/72/21/28/1085722128.db2.gz KUFUJPWLNSLKDW-MOPGFXCFSA-N 2 0 350.572 4.292 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]C2CC[NH+](C3CCCC3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000537941080 1085849743 /nfs/dbraw/zinc/84/97/43/1085849743.db2.gz HJCRVUZFTUVCEF-IRLDBZIGSA-N 3 0 369.597 4.284 20 0 FIADRP C[C@H]([NH2+]CC1(C[NH2+][C@@H](C)C2CCC(F)CC2)COC1)C1CCC(F)CC1 ZINC000662001800 1086002009 /nfs/dbraw/zinc/00/20/09/1086002009.db2.gz OTVYNXLZLSZXGW-VPWCILEZSA-N 2 0 372.544 4.016 20 0 FIADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1 ZINC000583048077 1086088707 /nfs/dbraw/zinc/08/87/07/1086088707.db2.gz KZFLEYQOFHHZBQ-VXKWHMMOSA-N 2 0 367.537 4.146 20 0 FIADRP C[C@](O)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000248880229 1086178223 /nfs/dbraw/zinc/17/82/23/1086178223.db2.gz KLYRBXOUCDBINF-BJESRGMDSA-N 2 0 356.554 4.103 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H](CO)c2ccccc2Cl)CC1 ZINC000583162204 1086326281 /nfs/dbraw/zinc/32/62/81/1086326281.db2.gz OWIQEXDZYHAJPZ-CBGDNZLLSA-N 2 0 364.961 4.049 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@H](C(=O)OC(C)(C)C)C2CC2)CC1 ZINC001167658708 1086388351 /nfs/dbraw/zinc/38/83/51/1086388351.db2.gz KOWORSNPDQJQNL-PXNSSMCTSA-N 2 0 364.574 4.083 20 0 FIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662294416 1086399360 /nfs/dbraw/zinc/39/93/60/1086399360.db2.gz VXXXQKUTTHXZEF-RHSMWYFYSA-N 2 0 374.916 4.163 20 0 FIADRP CC(C)Oc1ccnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167659947 1086408618 /nfs/dbraw/zinc/40/86/18/1086408618.db2.gz XYLXAZGUYHDWEC-IBGZPJMESA-N 2 0 359.558 4.345 20 0 FIADRP C[C@@H](c1ccc(F)cc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662326731 1086418273 /nfs/dbraw/zinc/41/82/73/1086418273.db2.gz AYMXWXSHJCPEKN-AWEZNQCLSA-N 2 0 374.479 4.096 20 0 FIADRP Cc1cccc([C@@H](C)[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c1 ZINC000662327732 1086418517 /nfs/dbraw/zinc/41/85/17/1086418517.db2.gz UIYFHJHKJLRKTH-QGZVFWFLSA-N 2 0 352.526 4.126 20 0 FIADRP CC(C)(C)c1ccc(N2CCC([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000161598384 1086423833 /nfs/dbraw/zinc/42/38/33/1086423833.db2.gz WBSZPMZAFUQQDS-IFMALSPDSA-N 2 0 355.570 4.169 20 0 FIADRP CC(C)[C@@H](O)[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccccc1 ZINC000657745657 1086466062 /nfs/dbraw/zinc/46/60/62/1086466062.db2.gz JOYMRONJULOLSS-DNQXCXABSA-N 2 0 366.549 4.041 20 0 FIADRP CN1CCC([NH2+][C@@H]2CCCSc3ccc(Br)cc32)CC1 ZINC000663437357 1086541880 /nfs/dbraw/zinc/54/18/80/1086541880.db2.gz MSFAUBCQHYEWCM-OAHLLOKOSA-N 2 0 355.345 4.060 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCSc3ccc(Br)cc32)CC1 ZINC000663443867 1086546538 /nfs/dbraw/zinc/54/65/38/1086546538.db2.gz RYYYSZYGJOUWHC-MRXNPFEDSA-N 2 0 367.356 4.228 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H](c3ncc[nH]3)c3ccccc3)CC2)c1 ZINC000126458142 1086623708 /nfs/dbraw/zinc/62/37/08/1086623708.db2.gz JSORTJOZJWCLJD-FQEVSTJZSA-N 2 0 366.534 4.062 20 0 FIADRP CCc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000150972024 1086658445 /nfs/dbraw/zinc/65/84/45/1086658445.db2.gz BTGQYKDLBXRKEM-UHFFFAOYSA-N 2 0 356.510 4.003 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167834824 1086690399 /nfs/dbraw/zinc/69/03/99/1086690399.db2.gz NAYQAPAUOKBXST-OALUTQOASA-N 2 0 369.594 4.217 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126712035 1086701530 /nfs/dbraw/zinc/70/15/30/1086701530.db2.gz HETGRUDAHXQOTK-YCRPNKLZSA-N 2 0 371.475 4.055 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(COc2cccc(OC)c2)CC1 ZINC001167837893 1086711739 /nfs/dbraw/zinc/71/17/39/1086711739.db2.gz NHWDPXIOTDLFSC-LJQANCHMSA-N 2 0 362.558 4.297 20 0 FIADRP CCC[N@H+]([C@@H](C)CCC[NH+](CC)CC)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167839576 1086716379 /nfs/dbraw/zinc/71/63/79/1086716379.db2.gz ALTOXBWLAANDAZ-OALUTQOASA-N 2 0 369.594 4.218 20 0 FIADRP CCC[N@H+]([C@H](C)CCC[NH+](CC)CC)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167839581 1086716413 /nfs/dbraw/zinc/71/64/13/1086716413.db2.gz ALTOXBWLAANDAZ-RTBURBONSA-N 2 0 369.594 4.218 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000127420435 1086720633 /nfs/dbraw/zinc/72/06/33/1086720633.db2.gz SSMWHEIVTMVQSZ-AZUAARDMSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CCCO1 ZINC000432413230 1086736058 /nfs/dbraw/zinc/73/60/58/1086736058.db2.gz LMBGGSLROUUIKV-HNAYVOBHSA-N 2 0 370.459 4.247 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167841741 1086739383 /nfs/dbraw/zinc/73/93/83/1086739383.db2.gz PZHOLNHBJFOKKR-OALUTQOASA-N 2 0 369.594 4.076 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4)cc3)C2)C1 ZINC000650705406 1086749326 /nfs/dbraw/zinc/74/93/26/1086749326.db2.gz GFJGPMZVMVFFFL-ZLNRFVROSA-N 2 0 350.506 4.072 20 0 FIADRP CC(C)(C)OC1CC(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000432425782 1086752430 /nfs/dbraw/zinc/75/24/30/1086752430.db2.gz NPYAXAZCRNXDNI-NVFTXBOLSA-N 2 0 370.581 4.470 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cc(-c4ccccc4)cs3)C2)C1 ZINC000650706383 1086755673 /nfs/dbraw/zinc/75/56/73/1086755673.db2.gz JOZAIIWBBDWPOF-YFVAEKQCSA-N 2 0 356.535 4.133 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCN2CCCO[C@H](C)C2)cc1 ZINC000432430009 1086757488 /nfs/dbraw/zinc/75/74/88/1086757488.db2.gz RJRVIGFAGMOSGL-QZTJIDSGSA-N 2 0 350.572 4.339 20 0 FIADRP CN(C)Cc1cnc(C[NH2+]CCSCc2cccc3ccccc32)s1 ZINC000512128228 1086795806 /nfs/dbraw/zinc/79/58/06/1086795806.db2.gz FYOJRARTIPUALN-UHFFFAOYSA-N 2 0 371.575 4.381 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(Cc3ccccc3)nc2C)C1 ZINC000151122581 1086942139 /nfs/dbraw/zinc/94/21/39/1086942139.db2.gz VKWYSGHHMYUKPA-QFBILLFUSA-N 2 0 357.567 4.425 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OC)cc1Br ZINC000650756684 1086968359 /nfs/dbraw/zinc/96/83/59/1086968359.db2.gz HSIJHOSERJAXBB-ZDUSSCGKSA-N 2 0 363.299 4.028 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cnn(-c2cccc(Cl)c2)c1C ZINC000650757917 1086972699 /nfs/dbraw/zinc/97/26/99/1086972699.db2.gz DWGMVRZAEFRQFI-HNNXBMFYSA-N 2 0 368.912 4.404 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CCC2CC[NH2+]CC2)c2ccco2)cc1 ZINC000650762916 1086991933 /nfs/dbraw/zinc/99/19/33/1086991933.db2.gz NJOFEFHFVIVYLN-GOSISDBHSA-N 2 0 363.299 4.111 20 0 FIADRP c1coc(COCc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2)c1 ZINC000583928704 1087037735 /nfs/dbraw/zinc/03/77/35/1087037735.db2.gz ABPAVJVBVYFEBO-XPWALMASSA-N 2 0 368.521 4.397 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000584173224 1087201127 /nfs/dbraw/zinc/20/11/27/1087201127.db2.gz ZVXKTDOBRPKQHA-MBSDFSHPSA-N 2 0 363.505 4.075 20 0 FIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000657834448 1087214426 /nfs/dbraw/zinc/21/44/26/1087214426.db2.gz KBFYWRHNGZDPDH-OCCSQVGLSA-N 2 0 360.851 4.364 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]Cc2cnccn2)c1 ZINC000584217394 1087224101 /nfs/dbraw/zinc/22/41/01/1087224101.db2.gz DPOMMMXWTOHMSQ-UHFFFAOYSA-N 2 0 358.489 4.029 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cncc(Br)c1 ZINC000657838495 1087250321 /nfs/dbraw/zinc/25/03/21/1087250321.db2.gz BRWLJCREZFLJAT-OAGGEKHMSA-N 2 0 368.363 4.253 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(SC2CCCC2)cc1 ZINC000151883636 1087357583 /nfs/dbraw/zinc/35/75/83/1087357583.db2.gz JRYFERURADPJCB-QGZVFWFLSA-N 2 0 362.583 4.076 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCc2nc3c(s2)CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000089667539 1087390307 /nfs/dbraw/zinc/39/03/07/1087390307.db2.gz LQDSVNSLCSISAY-PKOBYXMFSA-N 2 0 369.578 4.207 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCc2nc3c(s2)CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000089667544 1087390374 /nfs/dbraw/zinc/39/03/74/1087390374.db2.gz LQDSVNSLCSISAY-HKUYNNGSSA-N 2 0 369.578 4.207 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCCc2nc3ccccc3n2C)CC1 ZINC000090050256 1087401341 /nfs/dbraw/zinc/40/13/41/1087401341.db2.gz VRGQPLYWPORKMW-RXVVDRJESA-N 2 0 368.569 4.139 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)C1CCCC1 ZINC000091284638 1087426186 /nfs/dbraw/zinc/42/61/86/1087426186.db2.gz XHCQXZHNPGIHIB-QFIPXVFZSA-N 2 0 353.510 4.292 20 0 FIADRP CC(C)[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091283693 1087426376 /nfs/dbraw/zinc/42/63/76/1087426376.db2.gz IHQVIGAIFVNAFV-LJQANCHMSA-N 2 0 371.491 4.018 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2cnccc2o1 ZINC000657866440 1087440461 /nfs/dbraw/zinc/44/04/61/1087440461.db2.gz BZNZENJXOKHHHO-INIZCTEOSA-N 2 0 353.466 4.009 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(F)cn1 ZINC000092752550 1087447575 /nfs/dbraw/zinc/44/75/75/1087447575.db2.gz XPMYTBULPJKDOZ-INIZCTEOSA-N 2 0 353.441 4.297 20 0 FIADRP c1nc(-c2ccccn2)sc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000093769374 1087456015 /nfs/dbraw/zinc/45/60/15/1087456015.db2.gz FIRPJGOEBWZDEL-UHFFFAOYSA-N 2 0 370.566 4.293 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657869106 1087471855 /nfs/dbraw/zinc/47/18/55/1087471855.db2.gz YCTQHXAVHLJJGZ-MRXNPFEDSA-N 2 0 369.534 4.478 20 0 FIADRP C[C@@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000685470346 1087577557 /nfs/dbraw/zinc/57/75/57/1087577557.db2.gz HIVURJHGMAQTIL-XXBNENTESA-N 2 0 361.533 4.462 20 0 FIADRP C[N@H+](Cc1ccc(OCC[NH+]2CCCC2)cc1)C1CCC(F)(F)CC1 ZINC000685473453 1087579737 /nfs/dbraw/zinc/57/97/37/1087579737.db2.gz CHDMERYCSKBCMS-UHFFFAOYSA-N 2 0 352.469 4.171 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685661497 1087665739 /nfs/dbraw/zinc/66/57/39/1087665739.db2.gz UOPUZMXIEIOQDU-GOUWZUTHSA-N 2 0 364.533 4.407 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CCCC[N@H+](C)C3CC3)cc2cc1OC ZINC000658030526 1087699638 /nfs/dbraw/zinc/69/96/38/1087699638.db2.gz DJLSDIWLTCMALL-MRXNPFEDSA-N 2 0 356.510 4.382 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)cc2cc1OC ZINC000658034162 1087703846 /nfs/dbraw/zinc/70/38/46/1087703846.db2.gz COIBQOQUXITMLV-SJORKVTESA-N 2 0 356.510 4.240 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1F ZINC000658067433 1087710080 /nfs/dbraw/zinc/71/00/80/1087710080.db2.gz OBUSNINHXAYIDR-OAHLLOKOSA-N 2 0 366.546 4.089 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068583 1087710214 /nfs/dbraw/zinc/71/02/14/1087710214.db2.gz GOTCVUNNFCJAMI-SFHVURJKSA-N 2 0 360.542 4.015 20 0 FIADRP COc1ccc([C@H](CC(C)C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658070783 1087711027 /nfs/dbraw/zinc/71/10/27/1087711027.db2.gz QKFQSBRWNVVNBZ-QHCPKHFHSA-N 2 0 374.569 4.263 20 0 FIADRP Cc1cc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)ccc1Oc1cccnc1 ZINC000414772263 1087734768 /nfs/dbraw/zinc/73/47/68/1087734768.db2.gz BOPVSHIKQGYFLG-PMACEKPBSA-N 2 0 351.494 4.004 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc2c(s1)CCCC2 ZINC000658142533 1087735493 /nfs/dbraw/zinc/73/54/93/1087735493.db2.gz YMMKNYMCNWKEOG-UZLBHIALSA-N 2 0 370.562 4.044 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc2ccccc2c1 ZINC000658147229 1087739028 /nfs/dbraw/zinc/73/90/28/1087739028.db2.gz XJPLDLDNVGOSLW-MHECFPHRSA-N 2 0 360.501 4.257 20 0 FIADRP CC(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000658137677 1087741862 /nfs/dbraw/zinc/74/18/62/1087741862.db2.gz HXRPQUBAPMNQCG-FDDCHVKYSA-N 2 0 352.522 4.227 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658138441 1087743954 /nfs/dbraw/zinc/74/39/54/1087743954.db2.gz NKRUEKQGOBFRCF-GGAORHGYSA-N 2 0 364.533 4.037 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H]3CCCc4ccc(Cl)cc43)cc2)C1 ZINC000658140704 1087745021 /nfs/dbraw/zinc/74/50/21/1087745021.db2.gz UVBFYYHNCSENIL-UNMCSNQZSA-N 2 0 370.924 4.074 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccoc1 ZINC000658139243 1087746063 /nfs/dbraw/zinc/74/60/63/1087746063.db2.gz PMVQZBZRJBYDES-FGZHOGPDSA-N 2 0 356.510 4.113 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccn1 ZINC000658164432 1087759276 /nfs/dbraw/zinc/75/92/76/1087759276.db2.gz CYPCPXSTHYTPDF-QFIPXVFZSA-N 2 0 352.526 4.066 20 0 FIADRP CC1(C)[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C[C@H]1c1ccccc1 ZINC000658164301 1087759341 /nfs/dbraw/zinc/75/93/41/1087759341.db2.gz CLUAWTAFKKJETP-XZOQPEGZSA-N 2 0 363.549 4.466 20 0 FIADRP CCO[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C12CCCCC2 ZINC000658166762 1087761840 /nfs/dbraw/zinc/76/18/40/1087761840.db2.gz ONHFFQABZVIDTF-YADHBBJMSA-N 2 0 371.569 4.011 20 0 FIADRP C[C@H](CCc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166249 1087762594 /nfs/dbraw/zinc/76/25/94/1087762594.db2.gz NHZGJVTXDIMBEV-GOSISDBHSA-N 2 0 355.501 4.044 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CCC2)o1 ZINC000658166306 1087762655 /nfs/dbraw/zinc/76/26/55/1087762655.db2.gz NSEOWILFEYXJRU-QFIPXVFZSA-N 2 0 353.510 4.326 20 0 FIADRP C[C@@H]([NH2+][C@H]1CSCc2ccc(Br)cc21)C1CC[NH+](C)CC1 ZINC000658189399 1087778602 /nfs/dbraw/zinc/77/86/02/1087778602.db2.gz RWBRVFGMAMTYGD-PXAZEXFGSA-N 2 0 369.372 4.057 20 0 FIADRP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]CCc1cn3c(n1)CCCC3)CC2 ZINC000134314140 1087907186 /nfs/dbraw/zinc/90/71/86/1087907186.db2.gz XHGVXABDSMSLHD-MRXNPFEDSA-N 2 0 350.293 4.346 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1 ZINC000424373450 1087961332 /nfs/dbraw/zinc/96/13/32/1087961332.db2.gz GXCHFHZDOMNSHZ-GOSISDBHSA-N 2 0 350.506 4.326 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000472602159 1088028137 /nfs/dbraw/zinc/02/81/37/1088028137.db2.gz UKPHSMLNJMFNBF-UHFFFAOYSA-N 2 0 350.506 4.422 20 0 FIADRP CC(C)c1ccc([C@H]([NH3+])CN[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000423233539 1088078224 /nfs/dbraw/zinc/07/82/24/1088078224.db2.gz DQCXVFRYTRLTEQ-YTFSRNRJSA-N 2 0 351.538 4.235 20 0 FIADRP [NH3+]CC1CC[NH+](Cc2ccc(NCc3nccc4ccccc43)cc2)CC1 ZINC001167704193 1088112034 /nfs/dbraw/zinc/11/20/34/1088112034.db2.gz DKARZXSWUQOVDT-UHFFFAOYSA-N 2 0 360.505 4.018 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414808317 1088180175 /nfs/dbraw/zinc/18/01/75/1088180175.db2.gz FCKWSMJRYJLFDF-HUUCEWRRSA-N 2 0 359.901 4.175 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000414812619 1088225760 /nfs/dbraw/zinc/22/57/60/1088225760.db2.gz XOFSAXOAQGSOKR-UZLBHIALSA-N 2 0 371.912 4.199 20 0 FIADRP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414815572 1088244936 /nfs/dbraw/zinc/24/49/36/1088244936.db2.gz XQESNTDGUSOJER-QGZVFWFLSA-N 2 0 362.521 4.166 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@H]2[NH2+]Cc3ccccc32)cc1 ZINC000659285865 1088415695 /nfs/dbraw/zinc/41/56/95/1088415695.db2.gz SMEXWIPTMJZDDG-HTAPYJJXSA-N 2 0 363.505 4.234 20 0 FIADRP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000513819060 1088415489 /nfs/dbraw/zinc/41/54/89/1088415489.db2.gz PECMLFJWXQHLJM-IBGZPJMESA-N 2 0 352.522 4.335 20 0 FIADRP C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+][C@@H]1CCN(C)[C@H](C)C1 ZINC000311258131 1088473806 /nfs/dbraw/zinc/47/38/06/1088473806.db2.gz MMPRNPYEFMUDGF-MKXGPGLRSA-N 2 0 367.578 4.017 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1OC ZINC000514089122 1088736262 /nfs/dbraw/zinc/73/62/62/1088736262.db2.gz OOVRJZPASMYSRC-GOSISDBHSA-N 2 0 368.521 4.459 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(c2ccc(F)cc2C)CC1 ZINC000430100218 1088989705 /nfs/dbraw/zinc/98/97/05/1088989705.db2.gz LOZAWFOHBNWWAJ-UHFFFAOYSA-N 2 0 364.468 4.403 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000312390445 1089060200 /nfs/dbraw/zinc/06/02/00/1089060200.db2.gz CTQUTUVUNQEUCI-ICSRJNTNSA-N 2 0 366.505 4.021 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000415028577 1089062779 /nfs/dbraw/zinc/06/27/79/1089062779.db2.gz YYSJPDJZAZBHMC-GFCCVEGCSA-N 2 0 353.329 4.395 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 ZINC000415048934 1089086060 /nfs/dbraw/zinc/08/60/60/1089086060.db2.gz GQYPWEUBJJBPRL-GOSISDBHSA-N 2 0 360.885 4.071 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)s2)cs1 ZINC000415086613 1089148827 /nfs/dbraw/zinc/14/88/27/1089148827.db2.gz JTWINUMXDXZNEK-GVDBMIGSSA-N 2 0 361.580 4.233 20 0 FIADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000415093804 1089152966 /nfs/dbraw/zinc/15/29/66/1089152966.db2.gz WCGCHMJKUGGZNW-ZBFHGGJFSA-N 2 0 371.352 4.162 20 0 FIADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000415116911 1089176405 /nfs/dbraw/zinc/17/64/05/1089176405.db2.gz IKNUQZMPWHOWFD-AUUYWEPGSA-N 2 0 370.368 4.078 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)s3)CC2)C1 ZINC000415119903 1089182569 /nfs/dbraw/zinc/18/25/69/1089182569.db2.gz FUHFNWSEDOPCCM-ICSRJNTNSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3F)CC2)C1 ZINC000415122059 1089184355 /nfs/dbraw/zinc/18/43/55/1089184355.db2.gz JIQTXVFHZFMEBC-JTHBVZDNSA-N 2 0 368.496 4.211 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000415125028 1089187845 /nfs/dbraw/zinc/18/78/45/1089187845.db2.gz KZKIVLVHOXMZTF-CTNGQTDRSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000415130371 1089194954 /nfs/dbraw/zinc/19/49/54/1089194954.db2.gz QSEPIWWVGYYSDW-TZIWHRDSSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000415137793 1089200689 /nfs/dbraw/zinc/20/06/89/1089200689.db2.gz YLEKUYWXDQGFLA-NHCUHLMSSA-N 2 0 356.535 4.133 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(OC)cc1Br ZINC000313954119 1089287827 /nfs/dbraw/zinc/28/78/27/1089287827.db2.gz ARXXIBWCCKLSRI-CQSZACIVSA-N 2 0 357.336 4.058 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549235996 1089313655 /nfs/dbraw/zinc/31/36/55/1089313655.db2.gz TYVMBANGISUOPS-UQAQOTMJSA-N 2 0 364.533 4.059 20 0 FIADRP CCOC[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549235836 1089314696 /nfs/dbraw/zinc/31/46/96/1089314696.db2.gz OYWGTUJRHNWNGU-PXWCZTGZSA-N 2 0 350.934 4.269 20 0 FIADRP CCC(CC)(CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000514789610 1089470866 /nfs/dbraw/zinc/47/08/66/1089470866.db2.gz MFZXAZBQILXFFG-MSOLQXFVSA-N 2 0 367.537 4.346 20 0 FIADRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000514820712 1089499426 /nfs/dbraw/zinc/49/94/26/1089499426.db2.gz NUKURJMGPFZKNO-HNNXBMFYSA-N 2 0 358.498 4.156 20 0 FIADRP Cc1ncc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cn1 ZINC000549270380 1089511101 /nfs/dbraw/zinc/51/11/01/1089511101.db2.gz WECDZKVUGSGTJU-VCYXJBJXSA-N 2 0 370.928 4.142 20 0 FIADRP CC[N@H+](CCC(=O)Nc1ccccc1-c1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC000435629936 1089817101 /nfs/dbraw/zinc/81/71/01/1089817101.db2.gz VUHWWVJXWXBTLX-FQEVSTJZSA-N 2 0 365.521 4.146 20 0 FIADRP c1ccc(C[NH+]2CCC(NC[C@@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000435745649 1089921808 /nfs/dbraw/zinc/92/18/08/1089921808.db2.gz OVPBNYGBQIVAIM-QHCPKHFHSA-N 2 0 355.570 4.038 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)N1CCC(CCC[NH+](CC)CC)CC1 ZINC000415926153 1089999014 /nfs/dbraw/zinc/99/90/14/1089999014.db2.gz YWLDSPJOFAWIOP-UHFFFAOYSA-N 2 0 374.573 4.162 20 0 FIADRP CC[NH+](CC)[C@@H](CNC(=O)Nc1ccc(C[NH3+])cc1)c1ccccc1Cl ZINC000415964917 1090042530 /nfs/dbraw/zinc/04/25/30/1090042530.db2.gz WZHQTNNDHLDUSQ-IBGZPJMESA-N 2 0 374.916 4.003 20 0 FIADRP C[C@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(Cl)c1 ZINC000188074263 1090160165 /nfs/dbraw/zinc/16/01/65/1090160165.db2.gz XOKQDYSCJSLLSD-QGZVFWFLSA-N 2 0 372.940 4.190 20 0 FIADRP C[C@H]([NH2+]CCn1ccnc1)c1ccc(Br)cc1C(F)(F)F ZINC000188097738 1090169253 /nfs/dbraw/zinc/16/92/53/1090169253.db2.gz MYNQNOMFFVPBNP-JTQLQIEISA-N 2 0 362.193 4.015 20 0 FIADRP COCC[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549421566 1090318175 /nfs/dbraw/zinc/31/81/75/1090318175.db2.gz ROBDRBHKHNGFOY-BUHWKMJWSA-N 2 0 350.934 4.269 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)[C@@H]1C[C@H]1c1cccs1 ZINC000417313682 1090806979 /nfs/dbraw/zinc/80/69/79/1090806979.db2.gz PWDXHUNAJXFUOJ-FFZOFVMBSA-N 2 0 358.551 4.013 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](CC2CCC2)[C@@H](C)c2ccccc2)CC1 ZINC000500073470 1091023107 /nfs/dbraw/zinc/02/31/07/1091023107.db2.gz JRNYTHYOTDIRGO-NRFANRHFSA-N 2 0 357.586 4.266 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1cccc(F)c1 ZINC000759811442 1091158256 /nfs/dbraw/zinc/15/82/56/1091158256.db2.gz REWBPJJCOKPEHV-SFHVURJKSA-N 2 0 369.528 4.249 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc(CO[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC001167753357 1091171325 /nfs/dbraw/zinc/17/13/25/1091171325.db2.gz HKKGACOCGWDMRG-VLCRHTCISA-N 2 0 359.558 4.150 20 0 FIADRP CC[NH+]1CCC(NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000390560335 1091262101 /nfs/dbraw/zinc/26/21/01/1091262101.db2.gz LHBIUSFEULAGBR-UHFFFAOYSA-N 2 0 365.565 4.153 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000500402916 1091439670 /nfs/dbraw/zinc/43/96/70/1091439670.db2.gz LBSCZGAPHUKJQB-VLIAUNLRSA-N 2 0 352.869 4.254 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccccc3-c3ccnn3C)CC2)CC1 ZINC000511716260 1091569903 /nfs/dbraw/zinc/56/99/03/1091569903.db2.gz SPKAAUXUOAINLN-UHFFFAOYSA-N 2 0 366.553 4.220 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@@H]3O)CC1)CCS2 ZINC000187377384 1091878758 /nfs/dbraw/zinc/87/87/58/1091878758.db2.gz RRSYBIGFBYGNEY-HKBOAZHASA-N 2 0 374.594 4.198 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4cccc5cccnc54)C3)C2)cc1 ZINC000512237841 1091944008 /nfs/dbraw/zinc/94/40/08/1091944008.db2.gz WTPYPGUPFMGXJI-XMMPIXPASA-N 2 0 357.501 4.333 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](CCC(C)C)c3ccoc3)cn2)CC1 ZINC000428214389 1092266763 /nfs/dbraw/zinc/26/67/63/1092266763.db2.gz CWNOBZDNFMVKSY-OAQYLSRUSA-N 2 0 370.541 4.084 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012183 1092345805 /nfs/dbraw/zinc/34/58/05/1092345805.db2.gz XOPDXFYFDRLVNU-IRJINJETSA-N 3 0 365.565 4.279 20 0 FIADRP CC(C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC000236701426 1092412642 /nfs/dbraw/zinc/41/26/42/1092412642.db2.gz ZXAVDNVMUXQRIN-UHFFFAOYSA-N 2 0 356.485 4.325 20 0 FIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000665271635 1092420589 /nfs/dbraw/zinc/42/05/89/1092420589.db2.gz PMMPUFPVFVSJGG-LSUHJGNXSA-N 2 0 361.533 4.146 20 0 FIADRP Cc1ncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000428248509 1092573955 /nfs/dbraw/zinc/57/39/55/1092573955.db2.gz LXAAIIDQNFNGDM-CEWLAPEOSA-N 2 0 355.551 4.232 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000521272302 1092614762 /nfs/dbraw/zinc/61/47/62/1092614762.db2.gz XIWRYGOYFZTGEZ-KZNAEPCWSA-N 2 0 356.432 4.033 20 0 FIADRP COc1c(F)cccc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001143533475 1092700867 /nfs/dbraw/zinc/70/08/67/1092700867.db2.gz CIGIWDCLJQWVRQ-VQTJNVASSA-N 2 0 368.496 4.178 20 0 FIADRP COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000549726898 1092723424 /nfs/dbraw/zinc/72/34/24/1092723424.db2.gz OOVTUCSVMSVAJG-WIYYLYMNSA-N 2 0 364.574 4.133 20 0 FIADRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000521514024 1092734456 /nfs/dbraw/zinc/73/44/56/1092734456.db2.gz FVPDYZSUHKLJOK-QAPCUYQASA-N 2 0 361.942 4.380 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442782357 1092760515 /nfs/dbraw/zinc/76/05/15/1092760515.db2.gz PXBTWDHFFZQEPR-GGPKGHCWSA-N 2 0 373.544 4.381 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442788578 1092768165 /nfs/dbraw/zinc/76/81/65/1092768165.db2.gz CMMPWZSMFOKCOZ-QXAKKESOSA-N 2 0 372.475 4.288 20 0 FIADRP C[N@@H+]1CCN(CC[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1(C)C ZINC000442872947 1092820730 /nfs/dbraw/zinc/82/07/30/1092820730.db2.gz OGQYYCMMMGIAPL-FQEVSTJZSA-N 2 0 357.542 4.136 20 0 FIADRP CC[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1 ZINC000442873285 1092820863 /nfs/dbraw/zinc/82/08/63/1092820863.db2.gz KFFOPCSKOMERAG-KRWDZBQOSA-N 2 0 358.357 4.060 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000549818003 1092844377 /nfs/dbraw/zinc/84/43/77/1092844377.db2.gz KTUNHNHTOCXRII-NNWRFLSQSA-N 2 0 372.553 4.000 20 0 FIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(-c2ccccc2)c1 ZINC000442894472 1092848495 /nfs/dbraw/zinc/84/84/95/1092848495.db2.gz ZOBRGLNIPRBFEU-IBGZPJMESA-N 2 0 351.538 4.030 20 0 FIADRP COc1ccc(CC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168014551 1092849738 /nfs/dbraw/zinc/84/97/38/1092849738.db2.gz LUQXEEUIQWKFOH-OALUTQOASA-N 2 0 352.522 4.269 20 0 FIADRP Brc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3C[C@H]4C[C@H]4C3)CC2)cc1 ZINC001167911165 1092858982 /nfs/dbraw/zinc/85/89/82/1092858982.db2.gz AGPHEXKOXOVFDT-IZZQQSIFSA-N 2 0 363.343 4.049 20 0 FIADRP O[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000245687131 1092948627 /nfs/dbraw/zinc/94/86/27/1092948627.db2.gz JSNSZOWWXUAFAC-YUMYIRISSA-N 2 0 370.924 4.159 20 0 FIADRP Cc1ccccc1[C@@H]([C@@H](C)NC1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000443200632 1092988060 /nfs/dbraw/zinc/98/80/60/1092988060.db2.gz VYKMHXPHALEBKH-HYBUGGRVSA-N 2 0 365.565 4.240 20 0 FIADRP CC(C)c1nc([C@H](C)[NH2+]CCc2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000469775144 1093122573 /nfs/dbraw/zinc/12/25/73/1093122573.db2.gz JILAMHVODXTTKL-INIZCTEOSA-N 2 0 361.555 4.100 20 0 FIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H](C)C2CCC(F)(F)CC2)CC1 ZINC000474073820 1093188312 /nfs/dbraw/zinc/18/83/12/1093188312.db2.gz PKKFIISLUWYLJI-JKSUJKDBSA-N 2 0 351.485 4.411 20 0 FIADRP C[C@H]1CC(NC2CC[NH+](C3CCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168020362 1093213729 /nfs/dbraw/zinc/21/37/29/1093213729.db2.gz MRBJFYRHVJPWEJ-OALUTQOASA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@H](CO)CC2CCCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168021544 1093242286 /nfs/dbraw/zinc/24/22/86/1093242286.db2.gz PWZKNZHCIZDPNG-YDLSIGKMSA-N 2 0 358.570 4.349 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H](O)c2ccc(F)c(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168021967 1093260694 /nfs/dbraw/zinc/26/06/94/1093260694.db2.gz RQSFYNODOZLZBX-BXYJTDFISA-N 2 0 374.475 4.029 20 0 FIADRP Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000443587544 1093287388 /nfs/dbraw/zinc/28/73/88/1093287388.db2.gz GQGSJXXOZQESFD-FQEVSTJZSA-N 2 0 371.569 4.218 20 0 FIADRP Fc1ccccc1Oc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1F ZINC000647786486 1093306199 /nfs/dbraw/zinc/30/61/99/1093306199.db2.gz QRIYKMWRUDYREB-BRWVUGGUSA-N 2 0 358.432 4.235 20 0 FIADRP CCc1nc(C)c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433127949 1093312361 /nfs/dbraw/zinc/31/23/61/1093312361.db2.gz KDBWTHFPFJPUDN-UHFFFAOYSA-N 2 0 353.510 4.034 20 0 FIADRP C[C@H]1CC(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168022648 1093312976 /nfs/dbraw/zinc/31/29/76/1093312976.db2.gz AVOOOVGUTFYMBP-KCRBMJMASA-N 2 0 355.570 4.033 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1ccc([S@@](C)=O)cc1 ZINC000411484948 1093337844 /nfs/dbraw/zinc/33/78/44/1093337844.db2.gz PPBZHNXRBDHYCO-WXTAPIANSA-N 2 0 370.562 4.261 20 0 FIADRP CC(C)n1ncc2cc(CN3CCC[C@@H](C[N@@H+]4CCCC[C@H]4C)C3)cnc21 ZINC000113934823 1093515700 /nfs/dbraw/zinc/51/57/00/1093515700.db2.gz YNPGLJAHBBXFRH-RTBURBONSA-N 2 0 369.557 4.099 20 0 FIADRP C[C@@H]1CC([NH2+][C@H]2CCc3ccc(O)cc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168030225 1093575567 /nfs/dbraw/zinc/57/55/67/1093575567.db2.gz UXVMJCWOHMCJGA-HMFYCAOWSA-N 2 0 364.533 4.281 20 0 FIADRP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000433319451 1093579590 /nfs/dbraw/zinc/57/95/90/1093579590.db2.gz OLPNWPQBTMBRAR-QFIPXVFZSA-N 2 0 369.553 4.061 20 0 FIADRP COc1ccc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1C[NH3+] ZINC001168031704 1093651506 /nfs/dbraw/zinc/65/15/06/1093651506.db2.gz BJZXSJNWPXEIQW-UPHUGPLXSA-N 2 0 353.510 4.007 20 0 FIADRP C[C@@H]1CC([NH2+]C(C)(C)Cc2ccccn2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032463 1093654510 /nfs/dbraw/zinc/65/45/10/1093654510.db2.gz GKSQEXZNSHZJBV-RTBURBONSA-N 2 0 351.538 4.434 20 0 FIADRP C[C@H]1CC(N[C@@H]2CC[N@@H+](C3CCCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032980 1093681543 /nfs/dbraw/zinc/68/15/43/1093681543.db2.gz JHHOUJFWGZETEP-IRFCIJBXSA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3nccnc23)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036239 1093848489 /nfs/dbraw/zinc/84/84/89/1093848489.db2.gz VGZCHOCJDFQIIM-RMFSNUHRSA-N 2 0 360.505 4.161 20 0 FIADRP COCc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513498948 1094172134 /nfs/dbraw/zinc/17/21/34/1094172134.db2.gz CTWRQCDPIKBCIH-XXBNENTESA-N 2 0 352.522 4.223 20 0 FIADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000513679422 1094264374 /nfs/dbraw/zinc/26/43/74/1094264374.db2.gz WZYLSPHOLSKMCZ-FUBOCBINSA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501090420 1094490044 /nfs/dbraw/zinc/49/00/44/1094490044.db2.gz MPFWIQNYOJTVFC-HXUWFJFHSA-N 2 0 351.966 4.043 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1OC ZINC000474793553 1094630535 /nfs/dbraw/zinc/63/05/35/1094630535.db2.gz DWCVPUAYNLHXEP-IAGOWNOFSA-N 2 0 360.542 4.192 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000501645162 1094837386 /nfs/dbraw/zinc/83/73/86/1094837386.db2.gz HTOBHAVFWXCMGR-UHFFFAOYSA-N 2 0 373.585 4.113 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000474876634 1094838169 /nfs/dbraw/zinc/83/81/69/1094838169.db2.gz DPIRSMLFCTXFEJ-CEXWTWQISA-N 2 0 362.558 4.153 20 0 FIADRP COc1ccc2c(c1)[C@H]([N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1)CCO2 ZINC000420296736 1094855172 /nfs/dbraw/zinc/85/51/72/1094855172.db2.gz DRJNZFNXULHETF-PGRDOPGGSA-N 2 0 366.505 4.021 20 0 FIADRP CCC[N@H+](CC[C@H]1CCC[NH2+]C1)CC(=O)Nc1cc(Cl)ccc1Cl ZINC000420322950 1094869091 /nfs/dbraw/zinc/86/90/91/1094869091.db2.gz SWVZTAMKFJHUGK-CQSZACIVSA-N 2 0 372.340 4.034 20 0 FIADRP CC[N@H+](Cc1cc(C)nc(-c2ccc(Cl)cc2)n1)[C@H]1CCC[NH2+]CC1 ZINC000420318070 1094881006 /nfs/dbraw/zinc/88/10/06/1094881006.db2.gz VOIAKVPGLDILRF-IBGZPJMESA-N 2 0 358.917 4.069 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[N@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)cc1 ZINC000420376659 1094912837 /nfs/dbraw/zinc/91/28/37/1094912837.db2.gz QYENFPPUXNTWMA-DOTOQJQBSA-N 2 0 361.555 4.319 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[N@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)cc1 ZINC000420376667 1094913288 /nfs/dbraw/zinc/91/32/88/1094913288.db2.gz QYENFPPUXNTWMA-RDJZCZTQSA-N 2 0 361.555 4.319 20 0 FIADRP CCOC(=O)CC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168045052 1095025170 /nfs/dbraw/zinc/02/51/70/1095025170.db2.gz ILSCDGHXGMHMFW-RTBURBONSA-N 2 0 372.553 4.093 20 0 FIADRP CC(C)O[C@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000428306980 1095048554 /nfs/dbraw/zinc/04/85/54/1095048554.db2.gz RFNKCXQYRWUZTO-HSZRJFAPSA-N 2 0 367.537 4.396 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCCC23CCOCC3)cc1 ZINC000502254651 1095272979 /nfs/dbraw/zinc/27/29/79/1095272979.db2.gz NVPPJGPGUNJRRB-DENIHFKCSA-N 2 0 356.554 4.500 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000502282634 1095304832 /nfs/dbraw/zinc/30/48/32/1095304832.db2.gz OJYBICSKGRBHDW-IEBWSBKVSA-N 2 0 362.558 4.045 20 0 FIADRP COc1cccc(Cl)c1C[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000502327430 1095384964 /nfs/dbraw/zinc/38/49/64/1095384964.db2.gz RWLLYCRDMZMSOJ-HNNXBMFYSA-N 2 0 359.901 4.261 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)oc1C ZINC000502369956 1095421307 /nfs/dbraw/zinc/42/13/07/1095421307.db2.gz ZDNSXKLBDUGMQW-LJQANCHMSA-N 2 0 355.526 4.149 20 0 FIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000502453303 1095473958 /nfs/dbraw/zinc/47/39/58/1095473958.db2.gz PCLOEDOWMSGZCC-PGRDOPGGSA-N 2 0 356.510 4.206 20 0 FIADRP Fc1cccc(F)c1C1(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)CCC1 ZINC000414510898 1095530789 /nfs/dbraw/zinc/53/07/89/1095530789.db2.gz WCXCGPNTIXLABT-UHFFFAOYSA-N 2 0 357.448 4.040 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000421378700 1095576721 /nfs/dbraw/zinc/57/67/21/1095576721.db2.gz VWPAKLQCDZFGAW-UHFFFAOYSA-N 2 0 366.553 4.188 20 0 FIADRP FC(F)(F)C1CCN(C2CC([NH2+]Cc3cccc(C4CC4)c3)C2)CC1 ZINC000421405401 1095604430 /nfs/dbraw/zinc/60/44/30/1095604430.db2.gz YWFDXWRVMVPLPJ-UHFFFAOYSA-N 2 0 352.444 4.459 20 0 FIADRP C[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)c1cnn(C2CCCC2)c1 ZINC000502699729 1095724255 /nfs/dbraw/zinc/72/42/55/1095724255.db2.gz ZKXWNPRVBSMNCD-LJQANCHMSA-N 2 0 366.553 4.356 20 0 FIADRP CC[NH+](CC)C1CCN(C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051875 1095855891 /nfs/dbraw/zinc/85/58/91/1095855891.db2.gz JRHQNJNFTXNQME-PMACEKPBSA-N 2 0 357.586 4.234 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000421881995 1095973672 /nfs/dbraw/zinc/97/36/72/1095973672.db2.gz RRSKROOQJRCCJR-CBNMVNINSA-N 2 0 357.929 4.481 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCCOc3c(Br)cccc32)CC1 ZINC000421881692 1095974376 /nfs/dbraw/zinc/97/43/76/1095974376.db2.gz RLXJZJZKRUAPAP-KVULBXGLSA-N 2 0 367.331 4.125 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000421890171 1095977567 /nfs/dbraw/zinc/97/75/67/1095977567.db2.gz XTUCDFZIFLJGOQ-VMBOVVBDSA-N 2 0 367.331 4.125 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000503074295 1096051692 /nfs/dbraw/zinc/05/16/92/1096051692.db2.gz QJOPOUFOBPDRHL-QUCCMNQESA-N 2 0 374.573 4.246 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccsc2S1 ZINC000272774855 1096211359 /nfs/dbraw/zinc/21/13/59/1096211359.db2.gz UETWOXFXJOGREN-FNHZYXHNSA-N 2 0 374.575 4.030 20 0 FIADRP CCCOc1ccc(Oc2ncccc2C[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000422698498 1096456923 /nfs/dbraw/zinc/45/69/23/1096456923.db2.gz ZOENLYLWBZATDE-UHFFFAOYSA-N 2 0 369.509 4.270 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1CN[C@H]1CC[NH2+]CC[C@@H]1C ZINC000422693216 1096462933 /nfs/dbraw/zinc/46/29/33/1096462933.db2.gz LHZXIXUHINZGMQ-HKUYNNGSSA-N 2 0 369.509 4.140 20 0 FIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422759267 1096475014 /nfs/dbraw/zinc/47/50/14/1096475014.db2.gz KZCCUZVMXRNPRE-IEBWSBKVSA-N 2 0 362.395 4.051 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)NCC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000422760724 1096475774 /nfs/dbraw/zinc/47/57/74/1096475774.db2.gz LFLUPUXOKWAHJG-MSOLQXFVSA-N 2 0 366.553 4.163 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000422742737 1096478235 /nfs/dbraw/zinc/47/82/35/1096478235.db2.gz HABDFOQNRSAFOW-UZLBHIALSA-N 2 0 372.582 4.034 20 0 FIADRP c1ccc(SCCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422754626 1096483847 /nfs/dbraw/zinc/48/38/47/1096483847.db2.gz JPYDMGGJFUDWGO-FPOVZHCZSA-N 2 0 354.519 4.014 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422795381 1096492619 /nfs/dbraw/zinc/49/26/19/1096492619.db2.gz HLVNUWKFUDIKAF-IEBWSBKVSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc2cc(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422799492 1096493811 /nfs/dbraw/zinc/49/38/11/1096493811.db2.gz XAGDRFOHBXONAE-ISKFKSNPSA-N 2 0 374.484 4.194 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422789659 1096498539 /nfs/dbraw/zinc/49/85/39/1096498539.db2.gz OSNIGGZHYWPMTB-HOCLYGCPSA-N 2 0 365.399 4.110 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000422830014 1096500448 /nfs/dbraw/zinc/50/04/48/1096500448.db2.gz QMLLAJQLUXZKOP-GOSISDBHSA-N 3 0 366.553 4.076 20 0 FIADRP COc1cccc([C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2cc(F)ccc2OC)c1 ZINC000422824997 1096500591 /nfs/dbraw/zinc/50/05/91/1096500591.db2.gz OVODNMHTDWURLX-YCRPNKLZSA-N 2 0 360.473 4.039 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000422832169 1096501701 /nfs/dbraw/zinc/50/17/01/1096501701.db2.gz UTWMUJIRBQSDGN-CADBVGFASA-N 2 0 350.453 4.176 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000422880928 1096510848 /nfs/dbraw/zinc/51/08/48/1096510848.db2.gz XVDNKVNBKKXYNA-BLLLJJGKSA-N 2 0 367.946 4.176 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422880807 1096511121 /nfs/dbraw/zinc/51/11/21/1096511121.db2.gz OTBOAZKARGMSCM-CDHQVMDDSA-N 2 0 355.913 4.209 20 0 FIADRP Fc1ccc(Oc2ccnc(CN[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2)cc1 ZINC000422886279 1096513180 /nfs/dbraw/zinc/51/31/80/1096513180.db2.gz IRNMASFDOKZXPK-YPAWHYETSA-N 2 0 369.484 4.413 20 0 FIADRP CC1CC[NH+](CCc2cccc(NC(=O)CC[C@H]3CCCC[N@@H+]3C)c2)CC1 ZINC000503663794 1096513776 /nfs/dbraw/zinc/51/37/76/1096513776.db2.gz QRFRTOXHPGTGSX-JOCHJYFZSA-N 2 0 371.569 4.164 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1nc(-c2ccc(Br)cc2)cs1 ZINC000422887218 1096514363 /nfs/dbraw/zinc/51/43/63/1096514363.db2.gz AMAHCESMPKMTHC-VXGBXAGGSA-N 2 0 368.344 4.351 20 0 FIADRP CC(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422891060 1096515486 /nfs/dbraw/zinc/51/54/86/1096515486.db2.gz UOVLJVKBDJUGOM-YTFSRNRJSA-N 2 0 370.581 4.369 20 0 FIADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000422870107 1096515990 /nfs/dbraw/zinc/51/59/90/1096515990.db2.gz YLQLTTAXNSEAPR-ZRZPHAQCSA-N 2 0 351.494 4.107 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(OC(C)C)c1 ZINC000422872336 1096517006 /nfs/dbraw/zinc/51/70/06/1096517006.db2.gz GQYOIQGMPLYMFM-OFNKIYASSA-N 2 0 366.505 4.128 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000422874669 1096518036 /nfs/dbraw/zinc/51/80/36/1096518036.db2.gz OCMXHEFAWNIHSZ-KGLIPLIRSA-N 2 0 357.473 4.188 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422897360 1096518375 /nfs/dbraw/zinc/51/83/75/1096518375.db2.gz ZSRZYBZCWNYCRJ-AMHTUMDSSA-N 2 0 366.505 4.380 20 0 FIADRP Cc1c2cc(F)ccc2oc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422897792 1096519510 /nfs/dbraw/zinc/51/95/10/1096519510.db2.gz CVHSUWPUTMVOFH-XMSQKQJNSA-N 2 0 366.436 4.226 20 0 FIADRP c1c2ccccc2sc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422902786 1096520609 /nfs/dbraw/zinc/52/06/09/1096520609.db2.gz NOYUNSWYBKUXSW-RXVVDRJESA-N 2 0 350.487 4.247 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(C)cc1)c1ccc(F)cc1Cl ZINC000422892426 1096523448 /nfs/dbraw/zinc/52/34/48/1096523448.db2.gz YNPSYAORIQNLCH-FXAWDEMLSA-N 2 0 364.892 4.220 20 0 FIADRP C[C@@H]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@@H](C[NH3+])C1 ZINC000414704266 1096525678 /nfs/dbraw/zinc/52/56/78/1096525678.db2.gz DGFJNNHFVNNSNW-YLJYHZDGSA-N 2 0 372.557 4.042 20 0 FIADRP C[C@H]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@H](C[NH3+])C1 ZINC000414704264 1096526414 /nfs/dbraw/zinc/52/64/14/1096526414.db2.gz DGFJNNHFVNNSNW-PXNSSMCTSA-N 2 0 372.557 4.042 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)cc1OC ZINC000422925466 1096526425 /nfs/dbraw/zinc/52/64/25/1096526425.db2.gz VILLQIJFXYRVAO-BUNACBEFSA-N 2 0 374.912 4.306 20 0 FIADRP Cc1nn(-c2ccccc2)cc1CCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422964021 1096533978 /nfs/dbraw/zinc/53/39/78/1096533978.db2.gz KFWICMMXLXQLOH-DNVJHFABSA-N 2 0 366.553 4.014 20 0 FIADRP CC[C@H](C)C(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422945760 1096535756 /nfs/dbraw/zinc/53/57/56/1096535756.db2.gz NTZAARMZJUWGAE-VRXWPRPYSA-N 2 0 357.542 4.072 20 0 FIADRP CC(C)[C@H]([NH3+])CCN(C)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414708126 1096537249 /nfs/dbraw/zinc/53/72/49/1096537249.db2.gz ILYKBNOUTQSALM-HXUWFJFHSA-N 2 0 374.573 4.288 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(c3ccccc3Cl)CCOCC2)c2ccccc21 ZINC000422954946 1096538817 /nfs/dbraw/zinc/53/88/17/1096538817.db2.gz IPYGXLCKRHQLRB-UXHICEINSA-N 2 0 356.897 4.123 20 0 FIADRP C[C@H]([NH3+])C1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000414710600 1096545417 /nfs/dbraw/zinc/54/54/17/1096545417.db2.gz LOGNNJXCFCYDFU-KRWDZBQOSA-N 2 0 372.557 4.042 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]CC1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC000423008069 1096547743 /nfs/dbraw/zinc/54/77/43/1096547743.db2.gz ZGAVQXIREIBJIF-DZFGPLHGSA-N 2 0 358.570 4.138 20 0 FIADRP CC(C)(C)c1ccc(C(C)(C)C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000423015079 1096550338 /nfs/dbraw/zinc/55/03/38/1096550338.db2.gz QJOCFGHMXFSVLR-PWRODBHTSA-N 2 0 358.570 4.008 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000423052647 1096564857 /nfs/dbraw/zinc/56/48/57/1096564857.db2.gz RAQXKMJRFXFQRT-VWNXMTODSA-N 2 0 371.484 4.094 20 0 FIADRP CCCN(C)[C@@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(Cl)cc1 ZINC000423102711 1096567827 /nfs/dbraw/zinc/56/78/27/1096567827.db2.gz KKTRFOHYODPKFB-VFNWGFHPSA-N 2 0 374.960 4.236 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)ccn1 ZINC000423085749 1096570210 /nfs/dbraw/zinc/57/02/10/1096570210.db2.gz KMKUZNLDOFZNJA-MISYRCLQSA-N 2 0 369.484 4.413 20 0 FIADRP Fc1cccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423094003 1096573356 /nfs/dbraw/zinc/57/33/56/1096573356.db2.gz IWKVEJDEHJQUDE-FAHLNCGFSA-N 2 0 366.480 4.307 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423122573 1096578419 /nfs/dbraw/zinc/57/84/19/1096578419.db2.gz KAOPENDUCRXMCZ-CVEARBPZSA-N 2 0 362.477 4.448 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423119777 1096578600 /nfs/dbraw/zinc/57/86/00/1096578600.db2.gz DQXBFCXEIGBPNF-XMZIXOGTSA-N 2 0 350.304 4.023 20 0 FIADRP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423104018 1096582248 /nfs/dbraw/zinc/58/22/48/1096582248.db2.gz PMUDPNVXMUEXIA-IXDOHACOSA-N 2 0 364.942 4.110 20 0 FIADRP CSc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112050 1096585875 /nfs/dbraw/zinc/58/58/75/1096585875.db2.gz XGZVPQVDHFNTRE-NYSBEXSLSA-N 2 0 354.519 4.315 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000503922064 1096587671 /nfs/dbraw/zinc/58/76/71/1096587671.db2.gz UOBWRPDLGXSRIH-UHFFFAOYSA-N 2 0 368.569 4.050 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH+]1CCC(Cc2cc(F)cc(F)c2)CC1 ZINC000423149845 1096588126 /nfs/dbraw/zinc/58/81/26/1096588126.db2.gz BAUPXUIFFVNKOE-HNNXBMFYSA-N 2 0 359.464 4.143 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000423133186 1096590524 /nfs/dbraw/zinc/59/05/24/1096590524.db2.gz VRTVWVDRTPFVSV-SBUREZEXSA-N 2 0 368.569 4.001 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH+]1CCC(Cc2cccc(F)c2F)CC1 ZINC000423166335 1096599721 /nfs/dbraw/zinc/59/97/21/1096599721.db2.gz VNENSDVNPRYBEE-OAHLLOKOSA-N 2 0 359.464 4.143 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]C[C@H]2CCC[NH2+]C2)nc1 ZINC000423214068 1096619249 /nfs/dbraw/zinc/61/92/49/1096619249.db2.gz OJGNPGNQYFRWHF-UGKGYDQZSA-N 2 0 371.956 4.040 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccco2)cc1 ZINC000423260764 1096634178 /nfs/dbraw/zinc/63/41/78/1096634178.db2.gz QPZVIRXYYNAYHD-RDTXWAMCSA-N 2 0 363.299 4.111 20 0 FIADRP C[C@H]1C[C@H](C[NH+]2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CC[NH2+]1 ZINC000414731239 1096641543 /nfs/dbraw/zinc/64/15/43/1096641543.db2.gz AHLALPPYEAKRCO-LSDHHAIUSA-N 2 0 371.352 4.363 20 0 FIADRP Brc1ccccc1[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1 ZINC000423328122 1096648656 /nfs/dbraw/zinc/64/86/56/1096648656.db2.gz AFMRNIMXOWMLIV-IBGZPJMESA-N 2 0 357.295 4.048 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000423341272 1096651241 /nfs/dbraw/zinc/65/12/41/1096651241.db2.gz XZAKEWLTISENOK-QGZVFWFLSA-N 2 0 351.263 4.006 20 0 FIADRP Nc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423359217 1096656180 /nfs/dbraw/zinc/65/61/80/1096656180.db2.gz URWVPXAZXNVRFL-JTOYRKQZSA-N 2 0 361.533 4.431 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)(F)F)cc1 ZINC000423403046 1096672527 /nfs/dbraw/zinc/67/25/27/1096672527.db2.gz XAICQHFJIQLEMP-GOSISDBHSA-N 2 0 350.384 4.429 20 0 FIADRP Fc1cc(Br)ccc1[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000423428939 1096683419 /nfs/dbraw/zinc/68/34/19/1096683419.db2.gz GWMNWHLVKSQHIP-JQHSSLGASA-N 2 0 367.306 4.017 20 0 FIADRP COCCC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423467627 1096691892 /nfs/dbraw/zinc/69/18/92/1096691892.db2.gz BMFUEOBRDBRVKV-QZTJIDSGSA-N 2 0 369.347 4.039 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(C)c1 ZINC000423472251 1096694079 /nfs/dbraw/zinc/69/40/79/1096694079.db2.gz NBWWBYXMSBSRBT-TVTNDZMWSA-N 2 0 356.485 4.187 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)CCC3)cc1 ZINC000423472143 1096694644 /nfs/dbraw/zinc/69/46/44/1096694644.db2.gz MQNZYRYYOPQCEJ-UWWQBHOKSA-N 2 0 371.550 4.303 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000423475046 1096695583 /nfs/dbraw/zinc/69/55/83/1096695583.db2.gz PSCKDMLQYJBKRQ-MZMPZRCHSA-N 2 0 363.299 4.239 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)ccc1F ZINC000423473847 1096695962 /nfs/dbraw/zinc/69/59/62/1096695962.db2.gz OLAPYVWSPPTANO-UCLAIMLFSA-N 2 0 360.448 4.017 20 0 FIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1nc2ccc(Cl)cc2n1C ZINC000423507194 1096702057 /nfs/dbraw/zinc/70/20/57/1096702057.db2.gz PTNGTMKXFZIBOY-RHSMWYFYSA-N 2 0 356.901 4.358 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423492562 1096705631 /nfs/dbraw/zinc/70/56/31/1096705631.db2.gz NQJWFINAPAFNFB-LNSITVRQSA-N 2 0 367.324 4.266 20 0 FIADRP CCc1ccccc1[C@H]([NH3+])CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423495040 1096708192 /nfs/dbraw/zinc/70/81/92/1096708192.db2.gz BLIWTZSOCJKAGQ-PIATZUFCSA-N 2 0 363.549 4.034 20 0 FIADRP C[C@H](NC[C@@H]1C[NH2+]CCCO1)c1ccc(-c2ccccc2Cl)s1 ZINC000423512605 1096709816 /nfs/dbraw/zinc/70/98/16/1096709816.db2.gz KUZSEGKCARKLLC-KBPBESRZSA-N 2 0 350.915 4.098 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000423511989 1096710060 /nfs/dbraw/zinc/71/00/60/1096710060.db2.gz QJQYLSUFICGZHC-OWZDWXTDSA-N 2 0 362.489 4.493 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423538775 1096715746 /nfs/dbraw/zinc/71/57/46/1096715746.db2.gz HDOYKSJLFXIEGK-KPYOPSEVSA-N 2 0 368.496 4.096 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc2cc(Br)ccc2o1 ZINC000423541718 1096716252 /nfs/dbraw/zinc/71/62/52/1096716252.db2.gz LNOBYULSJLNJMJ-CQJJVWNLSA-N 2 0 363.299 4.234 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423540864 1096716417 /nfs/dbraw/zinc/71/64/17/1096716417.db2.gz QXYKQIJAVJSEOO-OAQYLSRUSA-N 2 0 356.897 4.337 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423545566 1096717170 /nfs/dbraw/zinc/71/71/70/1096717170.db2.gz XXUVCPRSRJSFSE-JOCHJYFZSA-N 2 0 354.469 4.018 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc(OCc2ccccc2)c1 ZINC000423553912 1096720349 /nfs/dbraw/zinc/72/03/49/1096720349.db2.gz WHWOEYSCHZMHMR-GUGJDKNPSA-N 2 0 350.506 4.304 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423551175 1096720362 /nfs/dbraw/zinc/72/03/62/1096720362.db2.gz TZWRJORJNMJKCS-KLIQENQMSA-N 2 0 355.551 4.466 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423555610 1096721142 /nfs/dbraw/zinc/72/11/42/1096721142.db2.gz YDQILCJBNMFHOE-BRSBDYLESA-N 2 0 353.535 4.165 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000423579729 1096725179 /nfs/dbraw/zinc/72/51/79/1096725179.db2.gz WQIFQZBOPLJLFT-GOSISDBHSA-N 2 0 369.578 4.053 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3c[nH]nc3-c3ccsc3)CC2)c1 ZINC000436278812 1098881804 /nfs/dbraw/zinc/88/18/04/1098881804.db2.gz DVFVGEADHGUHSG-UHFFFAOYSA-N 2 0 372.563 4.202 20 0 FIADRP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000436403977 1098992943 /nfs/dbraw/zinc/99/29/43/1098992943.db2.gz AUWJAMPAECOLIU-WMZOPIPTSA-N 2 0 351.469 4.307 20 0 FIADRP c1ccc(-c2ccccc2OCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459389421 1099381414 /nfs/dbraw/zinc/38/14/14/1099381414.db2.gz NPUVNJIJZGQTMQ-UHFFFAOYSA-N 2 0 373.500 4.386 20 0 FIADRP Clc1cc(Cl)cc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459388912 1099415103 /nfs/dbraw/zinc/41/51/03/1099415103.db2.gz MPTJXSRWAKTDHU-UHFFFAOYSA-N 2 0 350.293 4.190 20 0 FIADRP COc1cc(C[NH2+]C2CC[NH+](C(C)C)CC2)c(-c2ccccc2)cc1OC ZINC000067666626 1099470792 /nfs/dbraw/zinc/47/07/92/1099470792.db2.gz DTUXWNKBOXSQPW-UHFFFAOYSA-N 2 0 368.521 4.333 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)[C@@H](C)C1 ZINC000437090282 1099594221 /nfs/dbraw/zinc/59/42/21/1099594221.db2.gz AGSNXTKBMJPFAI-IZBOUPIGSA-N 2 0 358.570 4.124 20 0 FIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000516620386 1099661335 /nfs/dbraw/zinc/66/13/35/1099661335.db2.gz KIKCWIASHAENLH-KGWSWXIGSA-N 2 0 356.554 4.365 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162265433 1099670736 /nfs/dbraw/zinc/67/07/36/1099670736.db2.gz OUTSXDCCGQOMGR-JKSUJKDBSA-N 2 0 360.473 4.187 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162277226 1099672431 /nfs/dbraw/zinc/67/24/31/1099672431.db2.gz HTKAYFOLCTTZKV-JKSUJKDBSA-N 2 0 360.473 4.187 20 0 FIADRP CC(C)(C)OC1CC[NH+](CCCC[NH+]2CCC(OC(C)(C)C)CC2)CC1 ZINC000162320545 1099689225 /nfs/dbraw/zinc/68/92/25/1099689225.db2.gz GVIQYZHQWMKHKC-UHFFFAOYSA-N 2 0 368.606 4.326 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2ccsc2S1 ZINC000162502039 1099812965 /nfs/dbraw/zinc/81/29/65/1099812965.db2.gz FALPOVLVXRDNJJ-KBXCAEBGSA-N 2 0 362.564 4.404 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000414901673 1099815834 /nfs/dbraw/zinc/81/58/34/1099815834.db2.gz JAVCGDVCEUBYOT-UHFFFAOYSA-N 2 0 374.488 4.173 20 0 FIADRP C[C@@H]([NH2+]CCc1nc2ccccc2s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508691805 1099824958 /nfs/dbraw/zinc/82/49/58/1099824958.db2.gz QEPKUATUQSQHRB-MJGOQNOKSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H]([NH2+][C@H](CCCO)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713923 1099885402 /nfs/dbraw/zinc/88/54/02/1099885402.db2.gz GOOBVPBIKZZVJD-WWPVKYPJSA-N 2 0 352.522 4.000 20 0 FIADRP COc1ccc(CCC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711300 1099900905 /nfs/dbraw/zinc/90/09/05/1099900905.db2.gz AIUARZHYIXHIRP-UGKGYDQZSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508719420 1099908919 /nfs/dbraw/zinc/90/89/19/1099908919.db2.gz PMBGZVHOMMMZBP-HKUYNNGSSA-N 2 0 371.594 4.483 20 0 FIADRP C[C@@H]([NH2+]CCCCOc1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721377 1099937383 /nfs/dbraw/zinc/93/73/83/1099937383.db2.gz PGLIQDTZLOHXOY-TZIWHRDSSA-N 2 0 370.512 4.485 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508723167 1099943744 /nfs/dbraw/zinc/94/37/44/1099943744.db2.gz VHPAPWKLYIFFAW-ACIOBRDBSA-N 2 0 363.549 4.013 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@H]3CCc4c3cccc4C)CC2)oc1C ZINC000162730829 1099975931 /nfs/dbraw/zinc/97/59/31/1099975931.db2.gz ORBPYYMPDARBGS-NRFANRHFSA-N 2 0 353.510 4.089 20 0 FIADRP c1ccc(OC[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000459424739 1100155452 /nfs/dbraw/zinc/15/54/52/1100155452.db2.gz JODJTKROLUHVLO-XMMPIXPASA-N 2 0 373.500 4.460 20 0 FIADRP CC[C@@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Oc1ccccc1Cl ZINC000459451883 1100189379 /nfs/dbraw/zinc/18/93/79/1100189379.db2.gz ZRDGIQGVCFBKIJ-SFHVURJKSA-N 2 0 359.901 4.151 20 0 FIADRP c1nnsc1C[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000459516943 1100255015 /nfs/dbraw/zinc/25/50/15/1100255015.db2.gz DZHGLBTUUOTLOJ-OAQYLSRUSA-N 2 0 370.566 4.195 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@@H]2CCC[NH2+]CC2)c(-c2ccccc2Cl)n1 ZINC000666856551 1100270259 /nfs/dbraw/zinc/27/02/59/1100270259.db2.gz PDZBUGZDUWKCJV-MRXNPFEDSA-N 2 0 360.933 4.190 20 0 FIADRP C[C@@H](Cc1cc(Br)ccc1F)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000536829686 1100327981 /nfs/dbraw/zinc/32/79/81/1100327981.db2.gz YNMCOXXXKDYIBA-ZDUSSCGKSA-N 2 0 371.338 4.372 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@H]4CC[N@H+](C)C[C@H]4C)cc3)ccc2O1 ZINC000536838074 1100349700 /nfs/dbraw/zinc/34/97/00/1100349700.db2.gz GNOJDLTZNSUSCX-YVHKJVDXSA-N 2 0 350.506 4.107 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000536844289 1100356824 /nfs/dbraw/zinc/35/68/24/1100356824.db2.gz HWSNDMDHWMMEEG-PWRODBHTSA-N 2 0 362.945 4.075 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)C1 ZINC000536831715 1100369836 /nfs/dbraw/zinc/36/98/36/1100369836.db2.gz IWQUORBOCHSAPT-RTBURBONSA-N 2 0 374.573 4.235 20 0 FIADRP Cc1cccc(NC(=O)C[C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000536857374 1100373397 /nfs/dbraw/zinc/37/33/97/1100373397.db2.gz KRHDUQSVVQIWON-LJQANCHMSA-N 2 0 367.537 4.342 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536858609 1100375164 /nfs/dbraw/zinc/37/51/64/1100375164.db2.gz QZTWFYIBZIMBPR-KSZLIROESA-N 2 0 350.572 4.339 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(F)cc1 ZINC000536877390 1100399399 /nfs/dbraw/zinc/39/93/99/1100399399.db2.gz POBQPSQNADORFZ-IBGZPJMESA-N 2 0 355.501 4.079 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cc4c(cccc4F)[nH]3)CC2)C[C@@H](C)O1 ZINC000438112138 1100437508 /nfs/dbraw/zinc/43/75/08/1100437508.db2.gz DRUAGBCPRLMUKU-IAGOWNOFSA-N 2 0 373.516 4.018 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000425951569 1100446165 /nfs/dbraw/zinc/44/61/65/1100446165.db2.gz QCXJNKYFOYGXPS-NJYVYQBISA-N 2 0 355.913 4.235 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C/C=C\c3ccccc3)CC2)c1 ZINC000517540653 1100463093 /nfs/dbraw/zinc/46/30/93/1100463093.db2.gz DRFDYBZNAZEASK-WQLSENKSSA-N 2 0 363.549 4.200 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C[C@H]3C[C@H]3c3ccccc3)cc2)CC1 ZINC000517543611 1100464556 /nfs/dbraw/zinc/46/45/56/1100464556.db2.gz LBBZNLDMZUTJNY-OFNKIYASSA-N 2 0 350.506 4.053 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@@H]1CCCC[C@@H]1[NH3+])C1CCCCC1 ZINC000517571615 1100506810 /nfs/dbraw/zinc/50/68/10/1100506810.db2.gz ZDMOUPQDAGUYSO-PXNSSMCTSA-N 2 0 357.542 4.297 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC000426022353 1100676733 /nfs/dbraw/zinc/67/67/33/1100676733.db2.gz NGBUQOWFMIPSDA-NYVOZVTQSA-N 2 0 364.533 4.053 20 0 FIADRP CC[N@H+](Cc1ccccc1N1CC[NH+](CC)CC1)[C@H](C)c1cccc(O)c1 ZINC000509547059 1100934628 /nfs/dbraw/zinc/93/46/28/1100934628.db2.gz WVWGGDBOIKOAPL-LJQANCHMSA-N 2 0 367.537 4.117 20 0 FIADRP Cc1nc(C)c(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000438828354 1100949706 /nfs/dbraw/zinc/94/97/06/1100949706.db2.gz WQPBFMFIFKMVCF-UHFFFAOYSA-N 2 0 357.567 4.335 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN(C)C1CC[NH+](C(C)C)CC1 ZINC000506386964 1100955660 /nfs/dbraw/zinc/95/56/60/1100955660.db2.gz QOXZBMUVAIOUFN-UHFFFAOYSA-N 2 0 374.960 4.447 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1)c1ccc(Cl)cc1 ZINC000414974495 1101078083 /nfs/dbraw/zinc/07/80/83/1101078083.db2.gz NPUAVGJKFULOKZ-IBGZPJMESA-N 2 0 371.912 4.214 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCN(c3ccccc3F)C2)CC1 ZINC000426296590 1101220523 /nfs/dbraw/zinc/22/05/23/1101220523.db2.gz STLSMRQRZXVAFB-QFUCXCTJSA-N 2 0 359.533 4.037 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc(F)cc1 ZINC000414991362 1101291280 /nfs/dbraw/zinc/29/12/80/1101291280.db2.gz BBOYVOCWRISYLV-FXAWDEMLSA-N 2 0 372.484 4.020 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(COCc3ccccc3)cc2)[C@@H](C)C1 ZINC000470109148 1101316787 /nfs/dbraw/zinc/31/67/87/1101316787.db2.gz IFYAGSPCULNNAR-CVDCTZTESA-N 2 0 352.522 4.223 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459706668 1101323925 /nfs/dbraw/zinc/32/39/25/1101323925.db2.gz HZTZKLQUKRBFDY-IVMQYODDSA-N 2 0 350.497 4.496 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c(-c2ccccc2)cc1OC ZINC000459729282 1101347383 /nfs/dbraw/zinc/34/73/83/1101347383.db2.gz IXWZJJJTZLWOCA-GOSISDBHSA-N 2 0 368.521 4.192 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1O ZINC000426354251 1101350427 /nfs/dbraw/zinc/35/04/27/1101350427.db2.gz YQTLQYPBWXTSJL-SFHVURJKSA-N 2 0 370.537 4.352 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1OCCc2sccc21 ZINC000426355032 1101352265 /nfs/dbraw/zinc/35/22/65/1101352265.db2.gz XKWGKCOEHUQONI-TYYYZTEESA-N 2 0 370.562 4.251 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536998067 1101386602 /nfs/dbraw/zinc/38/66/02/1101386602.db2.gz DBGCSKMTFGTVAN-LJQANCHMSA-N 2 0 372.384 4.308 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000536999858 1101386848 /nfs/dbraw/zinc/38/68/48/1101386848.db2.gz DBRAPKFBJVPEMN-SFHVURJKSA-N 2 0 351.332 4.222 20 0 FIADRP Clc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)n1 ZINC000311011323 1101393576 /nfs/dbraw/zinc/39/35/76/1101393576.db2.gz PEYZZIPRZJXMML-UHFFFAOYSA-N 2 0 355.913 4.223 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000537013863 1101394291 /nfs/dbraw/zinc/39/42/91/1101394291.db2.gz UHWQVYQOXMNDCI-SFHVURJKSA-N 2 0 351.332 4.363 20 0 FIADRP CCc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)C(C)C)cc1 ZINC000537014154 1101396050 /nfs/dbraw/zinc/39/60/50/1101396050.db2.gz DGNCTQYVACPODD-DNVJHFABSA-N 2 0 358.570 4.304 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+]Cc3cccc(-c4ccncc4)c3)C2)cc1 ZINC000439476547 1101477944 /nfs/dbraw/zinc/47/79/44/1101477944.db2.gz QWOPOOSIHVGWAL-HSZRJFAPSA-N 2 0 371.528 4.403 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O2 ZINC000537173931 1101516429 /nfs/dbraw/zinc/51/64/29/1101516429.db2.gz OZOUPEZPSORWDA-HXUWFJFHSA-N 2 0 372.459 4.085 20 0 FIADRP Cc1cccc(C)c1CC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537191916 1101524498 /nfs/dbraw/zinc/52/44/98/1101524498.db2.gz GYWQNOBUXIEWPA-JOCHJYFZSA-N 2 0 364.533 4.424 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000178741871 1101534070 /nfs/dbraw/zinc/53/40/70/1101534070.db2.gz DYCZZVBJDXGRJB-GCJKJVERSA-N 2 0 365.521 4.337 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1O ZINC000426418773 1101538752 /nfs/dbraw/zinc/53/87/52/1101538752.db2.gz YDDFLRUJNQKNFL-FHWLQOOXSA-N 2 0 362.558 4.070 20 0 FIADRP Cc1ccc(Br)cc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000623878598 1101737512 /nfs/dbraw/zinc/73/75/12/1101737512.db2.gz LRIUAYMCMLBANY-CQSZACIVSA-N 2 0 351.332 4.425 20 0 FIADRP Fc1ccccc1COc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000248771094 1101891588 /nfs/dbraw/zinc/89/15/88/1101891588.db2.gz QXFQTKUSFIJWAM-UXHICEINSA-N 2 0 354.469 4.121 20 0 FIADRP CC[NH+](CC)[C@H](C(=O)Nc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000519169024 1101982067 /nfs/dbraw/zinc/98/20/67/1101982067.db2.gz IZQXYNDMNBYWDT-QFIPXVFZSA-N 2 0 365.521 4.304 20 0 FIADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000519189559 1101997368 /nfs/dbraw/zinc/99/73/68/1101997368.db2.gz DJYYZIVJQXDJFF-YMPZKCBVSA-N 2 0 370.581 4.474 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(Cl)nc3)CC2)cc1 ZINC000179115987 1102014141 /nfs/dbraw/zinc/01/41/41/1102014141.db2.gz JIKJBNHOGKOUKT-INIZCTEOSA-N 2 0 373.928 4.306 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cc(C)cc(C)c2)CC1 ZINC000519225112 1102021454 /nfs/dbraw/zinc/02/14/54/1102021454.db2.gz SSMDPNDFNXVWNC-LJQANCHMSA-N 2 0 359.558 4.074 20 0 FIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000440104590 1102032352 /nfs/dbraw/zinc/03/23/52/1102032352.db2.gz LCMFPEXMHQBSIJ-JOCHJYFZSA-N 2 0 369.553 4.061 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(OC)cc2OC)cc1 ZINC000120582594 1102235470 /nfs/dbraw/zinc/23/54/70/1102235470.db2.gz ZTIZQJZMVYCTKO-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415041035 1102268209 /nfs/dbraw/zinc/26/82/09/1102268209.db2.gz PMJBCAFLQVPYAU-GHTZIAJQSA-N 2 0 360.505 4.065 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1)CN1CC[NH+](C)CC1 ZINC000120988676 1102301910 /nfs/dbraw/zinc/30/19/10/1102301910.db2.gz DLQHWWHFQTXCHK-UXHICEINSA-N 2 0 367.537 4.013 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000519540613 1102368211 /nfs/dbraw/zinc/36/82/11/1102368211.db2.gz LPIUDSLAYWCMMO-ZWKOTPCHSA-N 2 0 365.521 4.011 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000532483214 1102425348 /nfs/dbraw/zinc/42/53/48/1102425348.db2.gz ZALBTJIERXERET-DMVWFOPNSA-N 2 0 369.372 4.304 20 0 FIADRP COc1cc(C)ccc1[C@@H](C)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485522 1102427066 /nfs/dbraw/zinc/42/70/66/1102427066.db2.gz SQTLPMXQBGSCJD-TZIWHRDSSA-N 2 0 352.522 4.219 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2ccsc2S1 ZINC000122318109 1102566176 /nfs/dbraw/zinc/56/61/76/1102566176.db2.gz FZZPTQYNBFFXLH-YOEHRIQHSA-N 2 0 362.564 4.404 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000506850698 1102578424 /nfs/dbraw/zinc/57/84/24/1102578424.db2.gz HXVAYESSCQPMOM-UHFFFAOYSA-N 2 0 354.542 4.043 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1cccs1 ZINC000550887728 1102658489 /nfs/dbraw/zinc/65/84/89/1102658489.db2.gz ZFQBEMGUCRXEAO-ICSRJNTNSA-N 2 0 370.562 4.328 20 0 FIADRP C[C@H](O)CCC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000550897448 1102673031 /nfs/dbraw/zinc/67/30/31/1102673031.db2.gz DNXCSHNLVGSMPV-RXVVDRJESA-N 2 0 350.522 4.130 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21)C1CC[NH+](C)CC1 ZINC000537649685 1102683746 /nfs/dbraw/zinc/68/37/46/1102683746.db2.gz VOCWBGUMCAFOHV-FGZHOGPDSA-N 2 0 373.610 4.077 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCCc4c(O)cccc43)cc2)CC1 ZINC000550932420 1102712063 /nfs/dbraw/zinc/71/20/63/1102712063.db2.gz WOBHNVNVBICDCW-JOCHJYFZSA-N 2 0 366.505 4.032 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000123018919 1102746492 /nfs/dbraw/zinc/74/64/92/1102746492.db2.gz KQUVIUCIOJOQJW-IBGZPJMESA-N 2 0 368.521 4.158 20 0 FIADRP COc1cccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)c1 ZINC001167979075 1102747333 /nfs/dbraw/zinc/74/73/33/1102747333.db2.gz UOYWSHLOOOMJGB-SEJPIABJSA-N 2 0 354.538 4.155 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953902 1102749034 /nfs/dbraw/zinc/74/90/34/1102749034.db2.gz KQKCZJQEGZYBSL-INIZCTEOSA-N 2 0 369.372 4.181 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000551051576 1102863170 /nfs/dbraw/zinc/86/31/70/1102863170.db2.gz RFQSEFCPURWJIC-KMDXXIMOSA-N 2 0 363.549 4.076 20 0 FIADRP CC1(C)CCC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550271814 1102904590 /nfs/dbraw/zinc/90/45/90/1102904590.db2.gz XIMBYRNLJCAVDM-YADHBBJMSA-N 2 0 370.581 4.474 20 0 FIADRP CC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CC1 ZINC000550271478 1102906135 /nfs/dbraw/zinc/90/61/35/1102906135.db2.gz SYAKOCGNLJJOOD-NJEKYYFSSA-N 2 0 356.554 4.084 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccccc2F)CC1 ZINC000506864096 1102916725 /nfs/dbraw/zinc/91/67/25/1102916725.db2.gz ZIGHXMCFSLKCBX-UHFFFAOYSA-N 2 0 358.505 4.160 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccc1O ZINC000459365373 1102928861 /nfs/dbraw/zinc/92/88/61/1102928861.db2.gz BAAGPDORBPBULB-GOSISDBHSA-N 2 0 368.521 4.455 20 0 FIADRP FC(F)Oc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1Cl ZINC000506907735 1102942249 /nfs/dbraw/zinc/94/22/49/1102942249.db2.gz DCOMDPDPUPZNDO-UHFFFAOYSA-N 2 0 358.860 4.249 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000551139305 1102944273 /nfs/dbraw/zinc/94/42/73/1102944273.db2.gz XRXMZBLETDMJKI-UHFFFAOYSA-N 2 0 365.521 4.295 20 0 FIADRP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000551199230 1102982719 /nfs/dbraw/zinc/98/27/19/1102982719.db2.gz XQDUMKAXWJALIV-MRXNPFEDSA-N 2 0 367.468 4.165 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC000537698602 1102985237 /nfs/dbraw/zinc/98/52/37/1102985237.db2.gz UVUQYQDHWMJRFK-VJBWXMMDSA-N 2 0 350.506 4.037 20 0 FIADRP Cc1cnn(CCCCC[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1 ZINC000476985501 1103005934 /nfs/dbraw/zinc/00/59/34/1103005934.db2.gz PZEFPYDJIITCSX-OAQYLSRUSA-N 2 0 360.590 4.338 20 0 FIADRP C[C@H](CC1CCCC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265352 1103025367 /nfs/dbraw/zinc/02/53/67/1103025367.db2.gz UBCBRZOUMSWCAD-NFBKMPQASA-N 2 0 370.581 4.474 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)CC1 ZINC000729682197 1103037610 /nfs/dbraw/zinc/03/76/10/1103037610.db2.gz PIPWONZLDZXCCF-UHFFFAOYSA-N 2 0 367.537 4.099 20 0 FIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000459382346 1103099641 /nfs/dbraw/zinc/09/96/41/1103099641.db2.gz DHSDRHOKKYZLMP-XIZQWUBESA-N 2 0 362.517 4.495 20 0 FIADRP COc1cc(Cl)c(C[NH2+]C[C@@H]2CCCn3cc(C)nc32)cc1Cl ZINC000532827771 1103243993 /nfs/dbraw/zinc/24/39/93/1103243993.db2.gz ANRFWLRVURZRFD-LBPRGKRZSA-N 2 0 354.281 4.174 20 0 FIADRP Cc1ccccc1OC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167985037 1103264894 /nfs/dbraw/zinc/26/48/94/1103264894.db2.gz SRDRBCICXMEVAR-WCRBZPEASA-N 2 0 354.538 4.244 20 0 FIADRP COc1ccc([C@H]([NH2+]CCCC[NH+](C)C)C(C)C)c(Br)c1 ZINC000565804484 1103317740 /nfs/dbraw/zinc/31/77/40/1103317740.db2.gz XCUICQFCVQRYTJ-QGZVFWFLSA-N 2 0 357.336 4.086 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)cc1 ZINC000551541134 1103319070 /nfs/dbraw/zinc/31/90/70/1103319070.db2.gz KSCQGJIZCJYODA-HNNXBMFYSA-N 2 0 361.917 4.436 20 0 FIADRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)cc(Br)c1 ZINC000507438113 1103390264 /nfs/dbraw/zinc/39/02/64/1103390264.db2.gz BGMKMQJTUWUDJC-MRXNPFEDSA-N 2 0 357.311 4.361 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000507459372 1103405292 /nfs/dbraw/zinc/40/52/92/1103405292.db2.gz FUGPYZVKESFTKZ-SSPYTLHUSA-N 2 0 359.517 4.211 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCCOC1 ZINC000507469528 1103415575 /nfs/dbraw/zinc/41/55/75/1103415575.db2.gz KNYJZZJHIBIXIK-XMSQKQJNSA-N 2 0 352.522 4.320 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000551948312 1103802257 /nfs/dbraw/zinc/80/22/57/1103802257.db2.gz RNQZMENXEQGDNF-UHFFFAOYSA-N 2 0 359.539 4.378 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000440813252 1103973871 /nfs/dbraw/zinc/97/38/71/1103973871.db2.gz ANPPLZAXEAAJHQ-AWEZNQCLSA-N 2 0 366.431 4.093 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCOC1CCCCC1)c1ccccc1O2 ZINC000538269496 1104091211 /nfs/dbraw/zinc/09/12/11/1104091211.db2.gz BYDKSEFFRHCGRK-OAQYLSRUSA-N 2 0 372.553 4.304 20 0 FIADRP CC(C)CSCCC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538307295 1104104069 /nfs/dbraw/zinc/10/40/69/1104104069.db2.gz MCLLVVBREGDSGB-LJQANCHMSA-N 2 0 362.583 4.344 20 0 FIADRP CCOc1ccccc1OCCN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000441386496 1104321876 /nfs/dbraw/zinc/32/18/76/1104321876.db2.gz FGROTJJZRJWSMW-PMACEKPBSA-N 2 0 360.542 4.051 20 0 FIADRP Cc1ccc2cc(C[NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)ccc2n1 ZINC000189314691 1104794693 /nfs/dbraw/zinc/79/46/93/1104794693.db2.gz ALGULKLKRJGNKW-QFIPXVFZSA-N 2 0 359.517 4.197 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCc2ccc3c(c2)CCO3)CC1 ZINC000441510075 1104958334 /nfs/dbraw/zinc/95/83/34/1104958334.db2.gz JFVMIFPSAOVTKI-UHFFFAOYSA-N 2 0 364.533 4.008 20 0 FIADRP C[C@@H]1C[C@@H]([N@H+](CCC[NH3+])C2CCCCC2)C[C@H](C)N1Cc1ccccc1 ZINC001168007999 1105151653 /nfs/dbraw/zinc/15/16/53/1105151653.db2.gz CBOQXHDJVIYEQE-JHDGKUDLSA-N 2 0 357.586 4.412 20 0 FIADRP C[C@@]1(C[NH2+]C2CCC3(CCOCC3)CC2)CCCN1Cc1ccccc1 ZINC000427895302 1105312429 /nfs/dbraw/zinc/31/24/29/1105312429.db2.gz SLSGQVDSSMZHKL-QFIPXVFZSA-N 2 0 356.554 4.370 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000325083617 1106789299 /nfs/dbraw/zinc/78/92/99/1106789299.db2.gz JORGGTIYBQWPCH-PMACEKPBSA-N 2 0 351.966 4.043 20 0 FIADRP CCC[C@@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000325083623 1106789994 /nfs/dbraw/zinc/78/99/94/1106789994.db2.gz JORGGTIYBQWPCH-WOJBJXKFSA-N 2 0 351.966 4.043 20 0 FIADRP CCOC(=O)[C@@H]1CCCC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168064980 1106885047 /nfs/dbraw/zinc/88/50/47/1106885047.db2.gz TWJZFLFPKJVHDT-NPDDRXJXSA-N 2 0 372.553 4.093 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000523035648 1106912810 /nfs/dbraw/zinc/91/28/10/1106912810.db2.gz KEKORTSMYOIMEQ-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530220505 1106914906 /nfs/dbraw/zinc/91/49/06/1106914906.db2.gz NOOIICFUAVILAO-DYXWJJEUSA-N 2 0 354.881 4.173 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000530714518 1107260857 /nfs/dbraw/zinc/26/08/57/1107260857.db2.gz HOLBCCPUVQANLJ-CTNGQTDRSA-N 2 0 368.525 4.259 20 0 FIADRP Cc1[nH+]c2ccccc2c(NCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1C ZINC000302164394 1107323253 /nfs/dbraw/zinc/32/32/53/1107323253.db2.gz OOVKHIGIIWHRPE-FQEVSTJZSA-N 2 0 361.489 4.030 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Br)cc1 ZINC000314784927 1107733064 /nfs/dbraw/zinc/73/30/64/1107733064.db2.gz KSAHRNHHDHSPAE-AWEZNQCLSA-N 2 0 360.299 4.164 20 0 FIADRP C[C@H](Cc1ccc(Br)c(F)c1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576771 1107784998 /nfs/dbraw/zinc/78/49/98/1107784998.db2.gz VYUOKJYJLFKILS-IUDNXUCKSA-N 2 0 369.322 4.126 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccsc2)cc1 ZINC000444658089 1108053351 /nfs/dbraw/zinc/05/33/51/1108053351.db2.gz AFYCSLINWWBDRQ-NJYVYQBISA-N 2 0 356.535 4.099 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](CC)CC1)c1ccncc1 ZINC000453102853 1108170736 /nfs/dbraw/zinc/17/07/36/1108170736.db2.gz QNQCGWBGSHIAGL-DYESRHJHSA-N 2 0 370.516 4.165 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccsc1 ZINC000453102391 1108170759 /nfs/dbraw/zinc/17/07/59/1108170759.db2.gz PLDHVGYOULKSPE-KXBFYZLASA-N 2 0 361.530 4.441 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c2sccc21 ZINC000453122986 1108189557 /nfs/dbraw/zinc/18/95/57/1108189557.db2.gz FLOUBWVQRUGDRX-IERDGZPVSA-N 2 0 370.562 4.433 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c2sccc21 ZINC000453122984 1108190523 /nfs/dbraw/zinc/19/05/23/1108190523.db2.gz FLOUBWVQRUGDRX-HRAATJIYSA-N 2 0 370.562 4.433 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453164077 1108234669 /nfs/dbraw/zinc/23/46/69/1108234669.db2.gz QQDZWZGEDVSFGY-HBMCJLEFSA-N 2 0 362.945 4.149 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1 ZINC000453163987 1108234752 /nfs/dbraw/zinc/23/47/52/1108234752.db2.gz FBTIXGOJYUNDBX-BHDDXSALSA-N 2 0 356.554 4.226 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453171617 1108243853 /nfs/dbraw/zinc/24/38/53/1108243853.db2.gz MNZCYZXXGGYSMO-DHWLSRIRSA-N 2 0 367.537 4.428 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1 ZINC000453211782 1108283466 /nfs/dbraw/zinc/28/34/66/1108283466.db2.gz OCNRMGNRMQWWOB-KURKYZTESA-N 2 0 352.444 4.362 20 0 FIADRP Cc1ccc(C2(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@@H]3C)CC2)c(C)c1 ZINC000453238694 1108315462 /nfs/dbraw/zinc/31/54/62/1108315462.db2.gz AGCHDRNOALSXDQ-NZQKXSOJSA-N 2 0 363.549 4.230 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)CC[NH+](C)CC1 ZINC000453256146 1108329348 /nfs/dbraw/zinc/32/93/48/1108329348.db2.gz QSBXVXVJBDADRN-KRWDZBQOSA-N 2 0 371.550 4.352 20 0 FIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000453313923 1108402610 /nfs/dbraw/zinc/40/26/10/1108402610.db2.gz DYMKUZNZCHRMJW-PLYUQDFWSA-N 2 0 358.570 4.470 20 0 FIADRP CCC1(C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)COC1 ZINC000453382501 1108467403 /nfs/dbraw/zinc/46/74/03/1108467403.db2.gz SJYOXXIXETYHOP-NRFANRHFSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000531979279 1108496712 /nfs/dbraw/zinc/49/67/12/1108496712.db2.gz MLFUCBSPSFUIKM-ZETOZRRWSA-N 2 0 365.732 4.344 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCCC[N@H+](C)C2CC2)c2ccc(F)cc2)cc1 ZINC000453402788 1108503934 /nfs/dbraw/zinc/50/39/34/1108503934.db2.gz NXDNXXLOVFYHHG-QFIPXVFZSA-N 2 0 356.485 4.388 20 0 FIADRP CCOc1cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc(Cl)c1OC ZINC000523863739 1108612077 /nfs/dbraw/zinc/61/20/77/1108612077.db2.gz YMSYNXLVCIHTJJ-QGZVFWFLSA-N 2 0 356.938 4.203 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1cc(Br)c(Cl)s1)C1CC1 ZINC000453599475 1108634187 /nfs/dbraw/zinc/63/41/87/1108634187.db2.gz RIXOXAJXXDAFEE-UHFFFAOYSA-N 2 0 351.741 4.128 20 0 FIADRP Cn1ccnc1C[N@@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453603720 1108653532 /nfs/dbraw/zinc/65/35/32/1108653532.db2.gz YMTBYLXICHQJKV-JOCHJYFZSA-N 2 0 366.553 4.077 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc21 ZINC000532214179 1108716378 /nfs/dbraw/zinc/71/63/78/1108716378.db2.gz ZIEZTFWGBDNVFD-FOVJLYNBSA-N 2 0 363.549 4.203 20 0 FIADRP Fc1ccc(CC[NH+]2CCC(N[C@@H]3CSc4ccccc43)CC2)cc1 ZINC000532223122 1108720925 /nfs/dbraw/zinc/72/09/25/1108720925.db2.gz QXYAAUODKZTWIH-HXUWFJFHSA-N 2 0 356.510 4.269 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532225245 1108723422 /nfs/dbraw/zinc/72/34/22/1108723422.db2.gz FNIJCKKMCYYFQK-IEBWSBKVSA-N 2 0 356.485 4.397 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc4ccccc4o3)CC2)CC1 ZINC000532268150 1108737821 /nfs/dbraw/zinc/73/78/21/1108737821.db2.gz WESBULZMWRAOFR-UHFFFAOYSA-N 2 0 369.553 4.061 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc3ccccc3n2)CC1 ZINC000532295995 1108747748 /nfs/dbraw/zinc/74/77/48/1108747748.db2.gz OMQMNXNFXNHIDV-UHFFFAOYSA-N 2 0 374.532 4.057 20 0 FIADRP Cc1nccn1C[C@H](C)C[NH2+]Cc1oc2ccccc2c1Br ZINC000655730557 1108811288 /nfs/dbraw/zinc/81/12/88/1108811288.db2.gz OWANXZPJZCUALT-GFCCVEGCSA-N 2 0 362.271 4.126 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000524370421 1108992125 /nfs/dbraw/zinc/99/21/25/1108992125.db2.gz JNCBCIXWEVUWIC-UHFFFAOYSA-N 2 0 374.532 4.313 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cncn2Cc2ccccc2)CC1 ZINC000445806210 1108995079 /nfs/dbraw/zinc/99/50/79/1108995079.db2.gz SXXNTONEWVKBNA-UHFFFAOYSA-N 2 0 368.569 4.265 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@@H](C)c3ccc4ccccc4c3)C2)CC1 ZINC000525267304 1109324587 /nfs/dbraw/zinc/32/45/87/1109324587.db2.gz NGQUMVROUFAXFK-CVDCTZTESA-N 2 0 351.538 4.001 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1cccc(F)c1 ZINC000446745655 1109326974 /nfs/dbraw/zinc/32/69/74/1109326974.db2.gz SPZGCEKOJFHUJH-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446889430 1109378477 /nfs/dbraw/zinc/37/84/77/1109378477.db2.gz WYTRQNQZGFFNGU-GNAXCBTBSA-N 2 0 356.554 4.427 20 0 FIADRP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](CC2CCC(C(C)(C)C)CC2)CC1 ZINC000525633042 1109462609 /nfs/dbraw/zinc/46/26/09/1109462609.db2.gz DSCFXDDDCDAJBJ-FDRBHKFBSA-N 2 0 363.634 4.329 20 0 FIADRP CCCOc1ccc(OCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000544419277 1109545963 /nfs/dbraw/zinc/54/59/63/1109545963.db2.gz AZBBBDAYOMQXBN-MOPGFXCFSA-N 2 0 360.542 4.097 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c(C)o1 ZINC000447536044 1109571683 /nfs/dbraw/zinc/57/16/83/1109571683.db2.gz KQPDIQDGYPKPNS-BZSNNMDCSA-N 2 0 356.510 4.356 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)o1 ZINC000447536046 1109571811 /nfs/dbraw/zinc/57/18/11/1109571811.db2.gz KQPDIQDGYPKPNS-KSZLIROESA-N 2 0 356.510 4.356 20 0 FIADRP CCOc1ccc([C@H](CC)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OCC ZINC000447568137 1109576946 /nfs/dbraw/zinc/57/69/46/1109576946.db2.gz HPMVZKRMDADKGV-FQEVSTJZSA-N 2 0 360.542 4.399 20 0 FIADRP CCOc1ccc([C@@H](CC)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OCC ZINC000447568138 1109577103 /nfs/dbraw/zinc/57/71/03/1109577103.db2.gz HPMVZKRMDADKGV-HXUWFJFHSA-N 2 0 360.542 4.399 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447563481 1109582889 /nfs/dbraw/zinc/58/28/89/1109582889.db2.gz QAAAYCKXEVCNRD-XQUALCHDSA-N 2 0 364.533 4.029 20 0 FIADRP Fc1cc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc(F)c1F ZINC000447591916 1109589643 /nfs/dbraw/zinc/58/96/43/1109589643.db2.gz JIHRUIYEFOTGKG-REPLKXPHSA-N 2 0 374.450 4.432 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc21 ZINC000447609738 1109602184 /nfs/dbraw/zinc/60/21/84/1109602184.db2.gz YYLYZDCQRNIAQI-NKKJXINNSA-N 2 0 364.533 4.227 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527672568 1109800337 /nfs/dbraw/zinc/80/03/37/1109800337.db2.gz AWJJYVFHJDWKCA-DWQJTFDBSA-N 2 0 356.554 4.070 20 0 FIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)c(Br)cc1F ZINC000527884546 1109849547 /nfs/dbraw/zinc/84/95/47/1109849547.db2.gz GJPGSRJWIBPRIO-LLVKDONJSA-N 2 0 361.274 4.110 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CC/C=C\c2ccc(Br)cc2)CC1 ZINC000527935180 1109870889 /nfs/dbraw/zinc/87/08/89/1109870889.db2.gz SIZKXVFIRLSFSJ-HYXAFXHYSA-N 2 0 351.332 4.315 20 0 FIADRP C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000527971032 1109871443 /nfs/dbraw/zinc/87/14/43/1109871443.db2.gz UNILYUHNZJEKBO-VGOFRKELSA-N 2 0 353.510 4.214 20 0 FIADRP Brc1cccc2c(C[NH+]3CCC(n4ccnc4)CC3)ccnc12 ZINC000449015419 1109954522 /nfs/dbraw/zinc/95/45/22/1109954522.db2.gz BWGXXLOEJOJALK-UHFFFAOYSA-N 2 0 371.282 4.031 20 0 FIADRP Fc1cccc(F)c1-c1ncc(C[N@@H+]2CC[C@H](Oc3ccncc3)C2)s1 ZINC000449046289 1109966758 /nfs/dbraw/zinc/96/67/58/1109966758.db2.gz KQLACBBNHWWVHQ-AWEZNQCLSA-N 2 0 373.428 4.137 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000449051027 1109968655 /nfs/dbraw/zinc/96/86/55/1109968655.db2.gz WLVIAJMRSKFMEG-FOIQADDNSA-N 2 0 371.525 4.398 20 0 FIADRP COCc1ccc(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)cc1 ZINC000449069434 1109972072 /nfs/dbraw/zinc/97/20/72/1109972072.db2.gz GSJRNDNMKQCOJY-IBGZPJMESA-N 2 0 352.522 4.018 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+]Cc2ccccc2-c2ccccc2C)CC1 ZINC000449080742 1109975075 /nfs/dbraw/zinc/97/50/75/1109975075.db2.gz YVQLVTHMXZNKJU-UHFFFAOYSA-N 2 0 365.565 4.169 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449112720 1109983581 /nfs/dbraw/zinc/98/35/81/1109983581.db2.gz SEHUMUPMDPXEIK-FXAWDEMLSA-N 2 0 350.934 4.067 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H](NCc2cc3ccccc3cc2OC)[C@H](C)C1 ZINC000449139407 1109983931 /nfs/dbraw/zinc/98/39/31/1109983931.db2.gz KYPIRVMERINKIL-XMSQKQJNSA-N 2 0 370.537 4.075 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1 ZINC000449184199 1109993903 /nfs/dbraw/zinc/99/39/03/1109993903.db2.gz DLBDBQIDDYIDGK-BJKOFHAPSA-N 2 0 364.533 4.129 20 0 FIADRP C[NH+](C)Cc1ccc(CN[C@@H]2CCc3cc(F)c(F)c(F)c32)cc1F ZINC000449210120 1109996373 /nfs/dbraw/zinc/99/63/73/1109996373.db2.gz VVDJXDQVRDDWLD-MRXNPFEDSA-N 2 0 352.375 4.082 20 0 FIADRP COCC[C@@H](NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccco1 ZINC000449229886 1110003488 /nfs/dbraw/zinc/00/34/88/1110003488.db2.gz FTXWZGUJXFTFOP-GHTZIAJQSA-N 2 0 356.510 4.042 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3CSc4ccccc43)CC2)cc1 ZINC000449363541 1110049612 /nfs/dbraw/zinc/04/96/12/1110049612.db2.gz MHSNOVAYFGPSSK-IBGZPJMESA-N 2 0 352.547 4.173 20 0 FIADRP CC1(C)C[N@H+](C[C@H]2CCCOC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449416286 1110056531 /nfs/dbraw/zinc/05/65/31/1110056531.db2.gz SQPOOKRHOLIBJF-IRLDBZIGSA-N 2 0 356.554 4.036 20 0 FIADRP Cc1nocc1C[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411218 1110062480 /nfs/dbraw/zinc/06/24/80/1110062480.db2.gz AOCABBKUSRATTC-OAQYLSRUSA-N 2 0 353.510 4.106 20 0 FIADRP Cc1n[nH]c(C)c1C[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449412495 1110062847 /nfs/dbraw/zinc/06/28/47/1110062847.db2.gz FSTLJDUOJXAUGU-QFIPXVFZSA-N 2 0 366.553 4.149 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@H]4CCOC5(CCC5)C4)[C@@H]3C2)cc1 ZINC000449478402 1110085013 /nfs/dbraw/zinc/08/50/13/1110085013.db2.gz KCKOWOICXAGURL-GPJHCHHRSA-N 2 0 368.565 4.226 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C2CC2)cn1 ZINC000528854471 1110135921 /nfs/dbraw/zinc/13/59/21/1110135921.db2.gz VNLIRYXNRQPCIW-QHCPKHFHSA-N 2 0 365.521 4.317 20 0 FIADRP CCOc1c(Cl)cccc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000487532829 1110169043 /nfs/dbraw/zinc/16/90/43/1110169043.db2.gz DFGKTZFXIDRJMR-UHFFFAOYSA-N 2 0 359.901 4.140 20 0 FIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cnc(C3CCCCC3)s2)C1 ZINC000538749880 1111280293 /nfs/dbraw/zinc/28/02/93/1111280293.db2.gz LJVWEZYSUFCBIC-GOSISDBHSA-N 2 0 365.587 4.124 20 0 FIADRP CN(c1ccccc1C[NH2+]CCCc1cccs1)C1CC[NH+](C)CC1 ZINC000538757363 1111284453 /nfs/dbraw/zinc/28/44/53/1111284453.db2.gz IOTCYVNQOUWIKV-UHFFFAOYSA-N 2 0 357.567 4.001 20 0 FIADRP c1[nH]nc2cc(CN3CC[C@H]4[C@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc12 ZINC000538798624 1111294744 /nfs/dbraw/zinc/29/47/44/1111294744.db2.gz PTPUWHFPLYNRIS-GGAORHGYSA-N 2 0 360.505 4.049 20 0 FIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000539062214 1111408049 /nfs/dbraw/zinc/40/80/49/1111408049.db2.gz UGNXNVWVANXOIX-RJGXRXQPSA-N 2 0 374.569 4.140 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c2ccccc12 ZINC000539072432 1111419251 /nfs/dbraw/zinc/41/92/51/1111419251.db2.gz RMCHPOUSTDYFHY-QRVBRYPASA-N 2 0 370.537 4.388 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)ccn1 ZINC000539217656 1111479705 /nfs/dbraw/zinc/47/97/05/1111479705.db2.gz OIHOIQOCQFHJKE-QFIPXVFZSA-N 2 0 371.500 4.182 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000477930991 1111605819 /nfs/dbraw/zinc/60/58/19/1111605819.db2.gz BWUPZKQLKROGHO-GMHONNGPSA-N 2 0 364.533 4.264 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H]2CCC[C@@H]21 ZINC000552258323 1111638790 /nfs/dbraw/zinc/63/87/90/1111638790.db2.gz DMMDQSWACMCYPH-DBDQLMEASA-N 2 0 352.444 4.414 20 0 FIADRP CSCc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000552338421 1111680132 /nfs/dbraw/zinc/68/01/32/1111680132.db2.gz FEDRTNBEAJOXPH-QGZVFWFLSA-N 2 0 358.551 4.341 20 0 FIADRP CCC(CC)n1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000552784943 1111804701 /nfs/dbraw/zinc/80/47/01/1111804701.db2.gz IMRVOFDMTWBPBQ-UHFFFAOYSA-N 2 0 369.557 4.378 20 0 FIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)c2ccc(C(=O)OC)o2)CC1)CC(C)C ZINC000552858815 1111833372 /nfs/dbraw/zinc/83/33/72/1111833372.db2.gz MOIJPEWRVZXCEG-QGZVFWFLSA-N 2 0 364.530 4.207 20 0 FIADRP Brc1ccc2c(c1)CCC[C@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000479072527 1111944285 /nfs/dbraw/zinc/94/42/85/1111944285.db2.gz BRSRTJXNKVEVKC-LJQANCHMSA-N 2 0 363.343 4.433 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479332410 1111994326 /nfs/dbraw/zinc/99/43/26/1111994326.db2.gz SZJXLXUQIMQNIN-DENIHFKCSA-N 2 0 366.553 4.351 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3nn(C)cc32)C1 ZINC000479343997 1112001581 /nfs/dbraw/zinc/00/15/81/1112001581.db2.gz KYHIBPPZMGFDMP-HMFYCAOWSA-N 2 0 366.553 4.065 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H](C[C@@H]3CCOC3)c3ccccc3)C2)cc1 ZINC000479462544 1112032740 /nfs/dbraw/zinc/03/27/40/1112032740.db2.gz GHJDIKSZNREOAQ-ZDXQCDESSA-N 2 0 364.533 4.266 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(F)c3)C2)[C@H](C)C1 ZINC000479526131 1112052898 /nfs/dbraw/zinc/05/28/98/1112052898.db2.gz LAAQEFCAVKYUJD-YKWDRNOUSA-N 2 0 362.533 4.188 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(Oc3ccc(F)cc3)nc2)CC1 ZINC000667543579 1112124595 /nfs/dbraw/zinc/12/45/95/1112124595.db2.gz DHALNKMPMKRXES-UHFFFAOYSA-N 2 0 357.473 4.177 20 0 FIADRP COc1cc2c(NC[C@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2cc1F ZINC000479846209 1112167769 /nfs/dbraw/zinc/16/77/69/1112167769.db2.gz ATGFNQRPYTUIIQ-GOSISDBHSA-N 2 0 355.413 4.225 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2)[C@H](C)C1 ZINC000479875399 1112173687 /nfs/dbraw/zinc/17/36/87/1112173687.db2.gz QHTBCKWFIUQCRM-MDZRGWNJSA-N 2 0 372.475 4.493 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H](CO)c3ccccc3Cl)CC2)C1 ZINC000554087894 1112198068 /nfs/dbraw/zinc/19/80/68/1112198068.db2.gz DSQFTVXWMQUISE-ZHALLVOQSA-N 2 0 364.961 4.049 20 0 FIADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000554087068 1112198155 /nfs/dbraw/zinc/19/81/55/1112198155.db2.gz UJDROACQUPLQJW-BHIFYINESA-N 2 0 358.570 4.330 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000480152158 1112304063 /nfs/dbraw/zinc/30/40/63/1112304063.db2.gz XQWANHDPUKLTAJ-GOSISDBHSA-N 2 0 360.546 4.087 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000554369452 1112320677 /nfs/dbraw/zinc/32/06/77/1112320677.db2.gz GYHBPDIQENWHAC-LNLFQRSKSA-N 2 0 371.500 4.181 20 0 FIADRP COc1ccc(C2([NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000480204656 1112331803 /nfs/dbraw/zinc/33/18/03/1112331803.db2.gz ZLXSDZRDIQMDFP-AZUAARDMSA-N 2 0 350.506 4.185 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)cc1 ZINC000480227535 1112339163 /nfs/dbraw/zinc/33/91/63/1112339163.db2.gz PYPXMVDSOQKZJN-MRXNPFEDSA-N 2 0 361.917 4.306 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc1)CC2 ZINC000480234553 1112344304 /nfs/dbraw/zinc/34/43/04/1112344304.db2.gz SCVHGKBTFZVFIX-KHCICDEESA-N 2 0 364.533 4.381 20 0 FIADRP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480242224 1112346435 /nfs/dbraw/zinc/34/64/35/1112346435.db2.gz AHIULBHQCDBKCI-KRWDZBQOSA-N 2 0 372.557 4.276 20 0 FIADRP CC[N@@H+](Cc1cc(COC)cs1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000667684030 1112452893 /nfs/dbraw/zinc/45/28/93/1112452893.db2.gz ILENFQIWXIUZTJ-LJQANCHMSA-N 2 0 358.551 4.239 20 0 FIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cccc(-c2ccccc2)c1 ZINC000480535523 1112465430 /nfs/dbraw/zinc/46/54/30/1112465430.db2.gz IYELEUMJGNVLJA-LJQANCHMSA-N 2 0 351.538 4.030 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1)N1CC[NH+](C)CC1 ZINC000480538644 1112466932 /nfs/dbraw/zinc/46/69/32/1112466932.db2.gz SBFPIQXYYQNOET-HYBUGGRVSA-N 2 0 365.565 4.276 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c(C)n1 ZINC000480601460 1112491565 /nfs/dbraw/zinc/49/15/65/1112491565.db2.gz PXADDCDDGVEYCJ-SJORKVTESA-N 2 0 352.526 4.176 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)nnn1-c1ccc(C)cc1 ZINC000480612897 1112501170 /nfs/dbraw/zinc/50/11/70/1112501170.db2.gz ODDCVVXQHBKVJU-MOPGFXCFSA-N 2 0 369.557 4.189 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000480612389 1112501187 /nfs/dbraw/zinc/50/11/87/1112501187.db2.gz LRTLBKCIECLMEP-VQIMIIECSA-N 2 0 371.491 4.162 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480614272 1112502508 /nfs/dbraw/zinc/50/25/08/1112502508.db2.gz SEHHHYKAUJSEJH-WOJBJXKFSA-N 2 0 367.537 4.156 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480630802 1112510612 /nfs/dbraw/zinc/51/06/12/1112510612.db2.gz LQSVCEMZENNSIJ-YLJYHZDGSA-N 2 0 351.966 4.043 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480632362 1112522203 /nfs/dbraw/zinc/52/22/03/1112522203.db2.gz UTQTWODZQIBRAR-KXBFYZLASA-N 2 0 372.384 4.450 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000554858681 1112532941 /nfs/dbraw/zinc/53/29/41/1112532941.db2.gz UDBLIZNJJBUCAE-ZEQRLZLVSA-N 2 0 363.549 4.309 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cccc(Cl)c2)CC1 ZINC000480695920 1112558581 /nfs/dbraw/zinc/55/85/81/1112558581.db2.gz UXKISIBONJZOAO-SFHVURJKSA-N 2 0 371.956 4.328 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccccc2CN2CC[NH+](CC)CC2)s1 ZINC000480719404 1112562010 /nfs/dbraw/zinc/56/20/10/1112562010.db2.gz XUHABVOZLZUKFB-SFHVURJKSA-N 2 0 371.594 4.299 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccccc1 ZINC000480733688 1112569448 /nfs/dbraw/zinc/56/94/48/1112569448.db2.gz BIZINGXEKISCMT-QHCPKHFHSA-N 2 0 351.538 4.065 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3OC)cc1 ZINC000480730241 1112575458 /nfs/dbraw/zinc/57/54/58/1112575458.db2.gz ONUOQMDCBMSACT-QFIPXVFZSA-N 2 0 368.521 4.193 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3ccc(OC)cc32)cc1 ZINC000480731766 1112575555 /nfs/dbraw/zinc/57/55/55/1112575555.db2.gz XWCVAOBTNAPMQW-QHCPKHFHSA-N 2 0 368.521 4.193 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1OC(F)F ZINC000480900113 1112663060 /nfs/dbraw/zinc/66/30/60/1112663060.db2.gz MHFOJOFTQUHWMC-HUUCEWRRSA-N 2 0 356.457 4.069 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCOc4ccccc43)CC2)cc1 ZINC000481544242 1112977061 /nfs/dbraw/zinc/97/70/61/1112977061.db2.gz LUBJILCLGOKKHS-JOCHJYFZSA-N 2 0 350.506 4.402 20 0 FIADRP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(OC(F)(F)F)ccc43)CC[C@H]21 ZINC000899878678 1113041778 /nfs/dbraw/zinc/04/17/78/1113041778.db2.gz VULSJPLFMPSWHW-SUMWQHHRSA-N 2 0 365.399 4.054 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[nH+]ccc2N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000899878432 1113042320 /nfs/dbraw/zinc/04/23/20/1113042320.db2.gz QMZATQHFSRTHIB-AWEZNQCLSA-N 2 0 365.399 4.198 20 0 FIADRP CN(c1cc[nH+]c2cc(OC(F)(F)F)ccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000899878195 1113042468 /nfs/dbraw/zinc/04/24/68/1113042468.db2.gz MOQDENRVHPTCJA-PBWFPOADSA-N 2 0 365.399 4.195 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)o1 ZINC000481718892 1113046752 /nfs/dbraw/zinc/04/67/52/1113046752.db2.gz CBTYSRUXFIRGJC-KRWDZBQOSA-N 2 0 356.510 4.413 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481917905 1113131824 /nfs/dbraw/zinc/13/18/24/1113131824.db2.gz PJLLACWABMNGHZ-DEOSSOPVSA-N 2 0 366.549 4.451 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cs1 ZINC000481907037 1113134440 /nfs/dbraw/zinc/13/44/40/1113134440.db2.gz GTWJTLLOCXRRPQ-PXNSSMCTSA-N 2 0 357.567 4.309 20 0 FIADRP COc1c(Br)cccc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000482010231 1113149782 /nfs/dbraw/zinc/14/97/82/1113149782.db2.gz RFVQPJUKOSQFHU-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)sc1C ZINC000482076169 1113172034 /nfs/dbraw/zinc/17/20/34/1113172034.db2.gz CTWAVPBLZWTTGH-OXJNMPFZSA-N 2 0 357.567 4.057 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)CC1 ZINC000482117366 1113173268 /nfs/dbraw/zinc/17/32/68/1113173268.db2.gz BAKZHLXIBJRFDW-SFHVURJKSA-N 2 0 368.521 4.018 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]CCCc3ccc4c(c3)CCO4)CC2)c1 ZINC000482214988 1113200940 /nfs/dbraw/zinc/20/09/40/1113200940.db2.gz BFPKRFIBIWEZOK-UHFFFAOYSA-N 2 0 370.562 4.117 20 0 FIADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482258550 1113208420 /nfs/dbraw/zinc/20/84/20/1113208420.db2.gz FMWUOGBUBKYXTQ-MOJGAOKDSA-N 2 0 374.569 4.091 20 0 FIADRP COCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000162911274 1113225178 /nfs/dbraw/zinc/22/51/78/1113225178.db2.gz MLQMETXWUVJKQP-LJQANCHMSA-N 2 0 368.521 4.158 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)[C@H](C)C1 ZINC000482334315 1113227842 /nfs/dbraw/zinc/22/78/42/1113227842.db2.gz NSAZRZFUJIJXDC-VGOFRKELSA-N 2 0 371.569 4.320 20 0 FIADRP CCc1nc2c(s1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000162920858 1113249461 /nfs/dbraw/zinc/24/94/61/1113249461.db2.gz TZEZKVXDOFCBCW-GOSISDBHSA-N 2 0 355.551 4.469 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1OC ZINC000482433635 1113253055 /nfs/dbraw/zinc/25/30/55/1113253055.db2.gz CWKVAGBFXQDVDK-IFMALSPDSA-N 2 0 352.522 4.301 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000482454231 1113265699 /nfs/dbraw/zinc/26/56/99/1113265699.db2.gz WZHJONFODZVXLX-CTNGQTDRSA-N 2 0 352.547 4.378 20 0 FIADRP CCC[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482539192 1113290935 /nfs/dbraw/zinc/29/09/35/1113290935.db2.gz VTMIMBFJLQKHQD-SFHVURJKSA-N 2 0 359.341 4.129 20 0 FIADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1cccc(OCc2ccccn2)c1 ZINC000162282694 1113451307 /nfs/dbraw/zinc/45/13/07/1113451307.db2.gz WUHKDOAAPFKCEU-LJQANCHMSA-N 2 0 353.510 4.187 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000486080701 1113500589 /nfs/dbraw/zinc/50/05/89/1113500589.db2.gz LEVPPLUHSVUNRA-WDSOQIARSA-N 2 0 372.475 4.059 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486708756 1113627270 /nfs/dbraw/zinc/62/72/70/1113627270.db2.gz KHDXSYZFXXNAEB-HRAATJIYSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000486717111 1113628623 /nfs/dbraw/zinc/62/86/23/1113628623.db2.gz MZQHMMYSCUNQFB-JXFKEZNVSA-N 2 0 351.469 4.450 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc(Cl)cs2)cc1 ZINC000486965392 1113684940 /nfs/dbraw/zinc/68/49/40/1113684940.db2.gz JOMUYKWPOHCQEH-UHFFFAOYSA-N 2 0 352.931 4.412 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)CC1 ZINC000488051318 1113846475 /nfs/dbraw/zinc/84/64/75/1113846475.db2.gz UDEROGPBDBPLCQ-CEWLAPEOSA-N 2 0 374.956 4.099 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CC1 ZINC000488051321 1113847383 /nfs/dbraw/zinc/84/73/83/1113847383.db2.gz UDEROGPBDBPLCQ-TYPHKJRUSA-N 2 0 374.956 4.099 20 0 FIADRP c1cc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000488089565 1113852691 /nfs/dbraw/zinc/85/26/91/1113852691.db2.gz POVPIMNVMKTXSM-VSKRKVRLSA-N 2 0 354.538 4.110 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 ZINC000488107722 1113855543 /nfs/dbraw/zinc/85/55/43/1113855543.db2.gz GZIBMBSDYPZAJW-YCZSINBZSA-N 2 0 354.538 4.108 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000488292411 1113902381 /nfs/dbraw/zinc/90/23/81/1113902381.db2.gz IATXSNNUVAEGKX-QGZVFWFLSA-N 2 0 356.514 4.160 20 0 FIADRP Cc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1Oc1cccnc1 ZINC000489038273 1114034743 /nfs/dbraw/zinc/03/47/43/1114034743.db2.gz RNNZHHTWEFSOCW-SFHVURJKSA-N 2 0 353.510 4.394 20 0 FIADRP Cc1cccc(C[NH+](C)Cc2ccccc2C[N@H+](C)Cc2cccc(C)n2)n1 ZINC000489620071 1114140042 /nfs/dbraw/zinc/14/00/42/1114140042.db2.gz JLLVAOKRDDUGLJ-UHFFFAOYSA-N 2 0 374.532 4.357 20 0 FIADRP COc1cc(C[N@@H+]2CCCC[C@H]2CC[NH3+])ccc1OCc1cccs1 ZINC000490088874 1114217260 /nfs/dbraw/zinc/21/72/60/1114217260.db2.gz MOFNBPHGIVYGCE-KRWDZBQOSA-N 2 0 360.523 4.039 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(F)cn1 ZINC000490120707 1114220702 /nfs/dbraw/zinc/22/07/02/1114220702.db2.gz WHTOZNPJXKEUIK-FIKGOQFSSA-N 2 0 371.500 4.071 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000490961375 1114356122 /nfs/dbraw/zinc/35/61/22/1114356122.db2.gz BRHDVZLQKYXIAV-YKSBVNFPSA-N 2 0 369.597 4.192 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccn1 ZINC000571466595 1114466260 /nfs/dbraw/zinc/46/62/60/1114466260.db2.gz BTYAFUDKVIUIDA-MSOLQXFVSA-N 2 0 353.510 4.315 20 0 FIADRP COc1ccccc1/C=C\C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000588177375 1114548924 /nfs/dbraw/zinc/54/89/24/1114548924.db2.gz JVMCYWJNVRFTLA-CLFYSBASSA-N 2 0 350.506 4.484 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000589836694 1114847145 /nfs/dbraw/zinc/84/71/45/1114847145.db2.gz QQEJKSMRVNZOOJ-INIZCTEOSA-N 2 0 368.949 4.492 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2csc(Br)c2)C1 ZINC000589837003 1114847262 /nfs/dbraw/zinc/84/72/62/1114847262.db2.gz UUHLPYSVDRZWTE-OKILXGFUSA-N 2 0 359.377 4.358 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(F)c(Cl)c3)cc2)CC1 ZINC000572945917 1114943207 /nfs/dbraw/zinc/94/32/07/1114943207.db2.gz OVXKOJWSHHJPAK-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cnn(CC(F)(F)F)c2)CC1)CC(C)C ZINC000573249274 1115086311 /nfs/dbraw/zinc/08/63/11/1115086311.db2.gz CCWANXVSYQSCGG-UHFFFAOYSA-N 2 0 374.495 4.025 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000591722099 1115121738 /nfs/dbraw/zinc/12/17/38/1115121738.db2.gz RBTKWRFHSJYQJC-UHFFFAOYSA-N 2 0 367.320 4.266 20 0 FIADRP COc1cccc(CN[C@H]2C[C@H]([NH3+])c3ccccc32)c1OC1CCCC1 ZINC000573793188 1115181490 /nfs/dbraw/zinc/18/14/90/1115181490.db2.gz WUCNMNOENGXXAW-PMACEKPBSA-N 2 0 352.478 4.251 20 0 FIADRP CCc1noc(C)c1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000573867871 1115192677 /nfs/dbraw/zinc/19/26/77/1115192677.db2.gz JYQPPULGFZCSFY-UNWVZKJWSA-N 2 0 367.537 4.326 20 0 FIADRP CCc1noc(C)c1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000573867870 1115192994 /nfs/dbraw/zinc/19/29/94/1115192994.db2.gz JYQPPULGFZCSFY-KJXAQDMKSA-N 2 0 367.537 4.326 20 0 FIADRP FC(F)(F)[C@H]1CC[NH+](CCCCCC[N@H+]2CC[C@H](C(F)(F)F)C2)C1 ZINC000761049488 1115405140 /nfs/dbraw/zinc/40/51/40/1115405140.db2.gz HWYYWNKAPHDNIB-KBPBESRZSA-N 2 0 360.386 4.315 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)c(F)c1 ZINC000574644656 1115426281 /nfs/dbraw/zinc/42/62/81/1115426281.db2.gz KPWASXHGVKPSFM-NRFANRHFSA-N 2 0 359.464 4.305 20 0 FIADRP Fc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)c(F)c1 ZINC000574644658 1115426478 /nfs/dbraw/zinc/42/64/78/1115426478.db2.gz KPWASXHGVKPSFM-OAQYLSRUSA-N 2 0 359.464 4.305 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(Br)cn1 ZINC000574811644 1115497146 /nfs/dbraw/zinc/49/71/46/1115497146.db2.gz LSQUIZZYCPZDLZ-LSDHHAIUSA-N 2 0 354.336 4.007 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(C(=O)OC)c(Cl)c1 ZINC000597043108 1115635686 /nfs/dbraw/zinc/63/56/86/1115635686.db2.gz HOVOJJAHCQKFNR-UHFFFAOYSA-N 2 0 374.912 4.258 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001168412255 1115691551 /nfs/dbraw/zinc/69/15/51/1115691551.db2.gz MBNUCMNKLJMXPA-YCAMKHIRSA-N 2 0 364.508 4.468 20 0 FIADRP C[N@H+](CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1)Cc1ccccc1 ZINC000534354017 1116187876 /nfs/dbraw/zinc/18/78/76/1116187876.db2.gz XCCIWSHIFYVRDX-FYYLOGMGSA-N 2 0 352.522 4.266 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000534797989 1116238887 /nfs/dbraw/zinc/23/88/87/1116238887.db2.gz AWESDVQHXWQPED-BDTNDASRSA-N 2 0 354.538 4.110 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311514029 1116356787 /nfs/dbraw/zinc/35/67/87/1116356787.db2.gz OEUDNMIWEYKUFT-ICSRJNTNSA-N 2 0 350.506 4.184 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]C3CCN(CC[NH+](C)C)CC3)cc2)c1 ZINC000462690319 1116391387 /nfs/dbraw/zinc/39/13/87/1116391387.db2.gz ZGCJNRXXGOTWEZ-UHFFFAOYSA-N 2 0 365.565 4.086 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000462799219 1117769710 /nfs/dbraw/zinc/76/97/10/1117769710.db2.gz XBTWBXXWNMQBJB-UHFFFAOYSA-N 2 0 368.452 4.349 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000462798215 1117779362 /nfs/dbraw/zinc/77/93/62/1117779362.db2.gz JYYAMEBOERRSGB-GOSISDBHSA-N 2 0 354.542 4.294 20 0 FIADRP Cc1cc(NC[C@@H](C(C)C)[NH+]2CCN(C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462918127 1117860541 /nfs/dbraw/zinc/86/05/41/1117860541.db2.gz GAULWMYFMNYTHV-FQEVSTJZSA-N 2 0 374.960 4.189 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000540144548 1117895696 /nfs/dbraw/zinc/89/56/96/1117895696.db2.gz ZMFBSSMJKAGGSS-SVFBPWRDSA-N 2 0 354.542 4.415 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cccc3ccccc32)[C@@H](C)C1 ZINC000540169450 1117912326 /nfs/dbraw/zinc/91/23/26/1117912326.db2.gz TUTMNJQGOOOFLU-CVDCTZTESA-N 2 0 354.538 4.109 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccc1C(F)(F)F ZINC000540170498 1117913021 /nfs/dbraw/zinc/91/30/21/1117913021.db2.gz ITRZJMXBZFVSLQ-OAGGEKHMSA-N 2 0 358.448 4.245 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000540258264 1117961966 /nfs/dbraw/zinc/96/19/66/1117961966.db2.gz FVAUDQYNXJYROR-OXJNMPFZSA-N 2 0 359.514 4.475 20 0 FIADRP Fc1ccccc1CSCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463111409 1117969218 /nfs/dbraw/zinc/96/92/18/1117969218.db2.gz PCVGHFRZAISGIR-UHFFFAOYSA-N 2 0 372.553 4.356 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(C(F)(F)F)cc1 ZINC000540301466 1117976637 /nfs/dbraw/zinc/97/66/37/1117976637.db2.gz ZRUQXZBZZNPQEN-RTBURBONSA-N 2 0 372.475 4.229 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000540315367 1117980368 /nfs/dbraw/zinc/98/03/68/1117980368.db2.gz DNGUCWMFJDQNOR-AQNXPRMDSA-N 2 0 350.934 4.005 20 0 FIADRP COc1cc([C@H](C)[NH2+]CCC[NH+]2CCCC2)ccc1OCc1ccccc1 ZINC000540354538 1117998747 /nfs/dbraw/zinc/99/87/47/1117998747.db2.gz OHKAYOXFQVKTNJ-IBGZPJMESA-N 2 0 368.521 4.411 20 0 FIADRP C[C@H](C[NH2+]C1CCN(CCc2ccccc2)CC1)Oc1ccccc1Cl ZINC000463189690 1118007652 /nfs/dbraw/zinc/00/76/52/1118007652.db2.gz JVKKYLQAYPROPI-GOSISDBHSA-N 2 0 372.940 4.404 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1nccs1 ZINC000540394209 1118028056 /nfs/dbraw/zinc/02/80/56/1118028056.db2.gz IZUOSPRGEGLDIJ-FGTMMUONSA-N 2 0 373.566 4.003 20 0 FIADRP CC(C)[NH+](CCC[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C(C)C ZINC000463203242 1118032075 /nfs/dbraw/zinc/03/20/75/1118032075.db2.gz FADAUQRPPXXQAE-UHFFFAOYSA-N 2 0 365.993 4.403 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000540418026 1118044832 /nfs/dbraw/zinc/04/48/32/1118044832.db2.gz YPUPTGMXJUVKHC-MLGOLLRUSA-N 2 0 357.361 4.163 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)c1ccccc1O2 ZINC000540491579 1118090746 /nfs/dbraw/zinc/09/07/46/1118090746.db2.gz FBPASDMLHHWQHO-HJNYFJLDSA-N 2 0 362.517 4.195 20 0 FIADRP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@H](C)CN1CC[NH+](CC)CC1 ZINC000540593960 1118138240 /nfs/dbraw/zinc/13/82/40/1118138240.db2.gz CBFUHKSHYDOUOI-RBUKOAKNSA-N 2 0 371.569 4.228 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000540988457 1118339390 /nfs/dbraw/zinc/33/93/90/1118339390.db2.gz LLWSMKWGBKXXDS-UNMCSNQZSA-N 2 0 370.924 4.074 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1F ZINC000540989947 1118340043 /nfs/dbraw/zinc/34/00/43/1118340043.db2.gz ALMLWZRMPZHMAE-LPHOPBHVSA-N 2 0 356.913 4.003 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cc2c(s1)CCC2 ZINC000540990769 1118340616 /nfs/dbraw/zinc/34/06/16/1118340616.db2.gz RRLGANRYPHADLG-OXJNMPFZSA-N 2 0 370.562 4.044 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000541087183 1118378690 /nfs/dbraw/zinc/37/86/90/1118378690.db2.gz YFUUKSZAVUZRKO-FQEVSTJZSA-N 2 0 373.585 4.464 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000464076711 1118434033 /nfs/dbraw/zinc/43/40/33/1118434033.db2.gz NCNSRUPPORUCBE-UHFFFAOYSA-N 2 0 354.542 4.438 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)(N2CCCCC2)CC1 ZINC000464080162 1118434734 /nfs/dbraw/zinc/43/47/34/1118434734.db2.gz XRKKKNNWTGDYBM-FCHUYYIVSA-N 2 0 369.597 4.109 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000541557811 1118562143 /nfs/dbraw/zinc/56/21/43/1118562143.db2.gz JKLKYYJNIXYIOB-OALUTQOASA-N 2 0 374.573 4.475 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(-c2ccccc2)s1 ZINC000541745662 1118630156 /nfs/dbraw/zinc/63/01/56/1118630156.db2.gz OZARVJVFUVRVBL-GOSISDBHSA-N 2 0 357.567 4.093 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000541914738 1118699109 /nfs/dbraw/zinc/69/91/09/1118699109.db2.gz IXBJQEQHXFUOIN-JXXFODFXSA-N 2 0 354.485 4.141 20 0 FIADRP Cc1ccccc1OCCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845138 1118718669 /nfs/dbraw/zinc/71/86/69/1118718669.db2.gz DBUDZBVTNPENLR-QFIPXVFZSA-N 2 0 352.522 4.218 20 0 FIADRP C[C@H]([NH2+]CCCOc1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492371739 1119080646 /nfs/dbraw/zinc/08/06/46/1119080646.db2.gz DQPRDTFOJCZCMD-AZUAARDMSA-N 2 0 356.485 4.095 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311633984 1119383152 /nfs/dbraw/zinc/38/31/52/1119383152.db2.gz JRNBNYBUULODQP-NNMXDRDESA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311890646 1119393617 /nfs/dbraw/zinc/39/36/17/1119393617.db2.gz DEAUDQNNPMULBG-CVDCTZTESA-N 2 0 350.506 4.184 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)[C@H]2CCCO[C@@H]21 ZINC000312112553 1119402207 /nfs/dbraw/zinc/40/22/07/1119402207.db2.gz NBTSMUCCBCCROV-CBPXPLCBSA-N 2 0 356.554 4.082 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccsc2)CC1 ZINC000178770731 1119408084 /nfs/dbraw/zinc/40/80/84/1119408084.db2.gz KYNAIGVDSYYJBT-CVEARBPZSA-N 2 0 361.530 4.441 20 0 FIADRP c1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](CC4CCCCC4)CC3)C2)cc1 ZINC000152543164 1119446131 /nfs/dbraw/zinc/44/61/31/1119446131.db2.gz GOPQCYUGKLMALZ-OAQYLSRUSA-N 2 0 355.570 4.147 20 0 FIADRP C[C@@H]1CC[NH+](Cc2ccccc2C[N@@H+]2CCS[C@H](C)CC2)CCS1 ZINC000494025219 1119526742 /nfs/dbraw/zinc/52/67/42/1119526742.db2.gz AFJRJISIOAATNG-QZTJIDSGSA-N 2 0 364.624 4.341 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000186574430 1119737317 /nfs/dbraw/zinc/73/73/17/1119737317.db2.gz DCWIVDKBNKKGRN-KSSFIOAISA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000186585236 1119737516 /nfs/dbraw/zinc/73/75/16/1119737516.db2.gz FQXGDBKWDOPQJY-WOJBJXKFSA-N 2 0 351.538 4.030 20 0 FIADRP Fc1cc(Cl)ccc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000494433479 1119858076 /nfs/dbraw/zinc/85/80/76/1119858076.db2.gz DPBPZQYJCNHDIG-UHFFFAOYSA-N 2 0 362.876 4.244 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1csc(Cl)c1 ZINC000191491855 1119979562 /nfs/dbraw/zinc/97/95/62/1119979562.db2.gz AEWWCYJONUAALL-KBXCAEBGSA-N 2 0 364.942 4.209 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(Cl)cs1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000193087561 1120098744 /nfs/dbraw/zinc/09/87/44/1120098744.db2.gz VITXRRJDXRGCMF-CYBMUJFWSA-N 2 0 367.921 4.143 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCCO2 ZINC000195133119 1120120746 /nfs/dbraw/zinc/12/07/46/1120120746.db2.gz DNRGUGFLOCQUIM-SIKLNZKXSA-N 2 0 366.505 4.021 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494916439 1120369450 /nfs/dbraw/zinc/36/94/50/1120369450.db2.gz IGHNLULHMGKCEP-DENIHFKCSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2ccc(Cl)cc2)CC1 ZINC001168473913 1120379359 /nfs/dbraw/zinc/37/93/59/1120379359.db2.gz POJNUPDMECSJDE-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C(=O)N(C)C)cc2)c1 ZINC000494925216 1120381693 /nfs/dbraw/zinc/38/16/93/1120381693.db2.gz XBFSSUXTSOHFOS-SFHVURJKSA-N 2 0 367.537 4.081 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(Cl)cs3)CC2)CC1 ZINC000494978608 1120417562 /nfs/dbraw/zinc/41/75/62/1120417562.db2.gz KDGJDDNUBNIWGG-UHFFFAOYSA-N 2 0 370.006 4.030 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495105409 1120476959 /nfs/dbraw/zinc/47/69/59/1120476959.db2.gz BRMCMPBXMWGHLH-UTKZUKDTSA-N 2 0 368.569 4.255 20 0 FIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000670153970 1120710316 /nfs/dbraw/zinc/71/03/16/1120710316.db2.gz SFLCCHJPFFMXGP-AOIWGVFYSA-N 2 0 363.343 4.433 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CC[C@H]3SCCS[C@@H]23)c1 ZINC000762612119 1120938278 /nfs/dbraw/zinc/93/82/78/1120938278.db2.gz FRMDZLQEVBBUNM-AQNXPRMDSA-N 2 0 362.608 4.142 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc(Br)ncc1F ZINC000762738589 1120956732 /nfs/dbraw/zinc/95/67/32/1120956732.db2.gz UWSCJGLFGBPKQJ-KGLIPLIRSA-N 2 0 372.326 4.146 20 0 FIADRP c1c(C[NH2+]CCC[NH+]2CCCC2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000236652898 1120968215 /nfs/dbraw/zinc/96/82/15/1120968215.db2.gz OPJMNOPVVGZASW-UHFFFAOYSA-N 2 0 374.532 4.174 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000236831104 1120970265 /nfs/dbraw/zinc/97/02/65/1120970265.db2.gz VZQLWPGRFMNTJE-UHFFFAOYSA-N 2 0 374.532 4.172 20 0 FIADRP Cc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1C ZINC000237412757 1120977022 /nfs/dbraw/zinc/97/70/22/1120977022.db2.gz UPWDGXQFHPZYSP-RTBURBONSA-N 2 0 352.522 4.202 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000397602081 1121240638 /nfs/dbraw/zinc/24/06/38/1121240638.db2.gz UVOVISVIBBQHNZ-HSZRJFAPSA-N 2 0 350.506 4.184 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000153810113 1121384820 /nfs/dbraw/zinc/38/48/20/1121384820.db2.gz TXXYCYDYDHPHGC-OAQYLSRUSA-N 2 0 356.485 4.453 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OCC ZINC000123721008 1121625889 /nfs/dbraw/zinc/62/58/89/1121625889.db2.gz ILAUSJWVWVIDKE-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000671739911 1121635755 /nfs/dbraw/zinc/63/57/55/1121635755.db2.gz COYLBAWUPHPIRA-INIZCTEOSA-N 2 0 365.477 4.370 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc3[nH]c(=O)oc3c2)cc1 ZINC000671739803 1121637572 /nfs/dbraw/zinc/63/75/72/1121637572.db2.gz XIGOYGCOYHBUFG-HNNXBMFYSA-N 2 0 353.466 4.226 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c(C)c1OC ZINC000671741413 1121638718 /nfs/dbraw/zinc/63/87/18/1121638718.db2.gz LZKYFLNPQIPMJA-QZTJIDSGSA-N 2 0 362.558 4.187 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000671741191 1121640089 /nfs/dbraw/zinc/64/00/89/1121640089.db2.gz MGZDQCBWKCNRDH-OAHLLOKOSA-N 2 0 353.466 4.224 20 0 FIADRP CC[NH2+]Cc1cccc(NC(=O)c2ccc(C[N@H+](CC)C3CC3)cc2)c1 ZINC000123903460 1121643560 /nfs/dbraw/zinc/64/35/60/1121643560.db2.gz ZHOHYQNHSARJHN-UHFFFAOYSA-N 2 0 351.494 4.033 20 0 FIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc2ccccc2o1 ZINC000124775580 1121718791 /nfs/dbraw/zinc/71/87/91/1121718791.db2.gz GTRMGMCQNIRFQP-SFHVURJKSA-N 2 0 355.526 4.034 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCCN2Cc2cccc(Cl)c2)CC1(C)C ZINC001649095864 1121755386 /nfs/dbraw/zinc/75/53/86/1121755386.db2.gz IBWWOABDZNRWBG-VQTJNVASSA-N 2 0 363.977 4.157 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cnn1-c1cccc(Cl)c1 ZINC000125289858 1121766192 /nfs/dbraw/zinc/76/61/92/1121766192.db2.gz ZUAKDFHVAGQJJD-OAHLLOKOSA-N 2 0 360.933 4.217 20 0 FIADRP COc1cc2c(cc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C)O[C@@H](C)C2 ZINC000067668237 1121787254 /nfs/dbraw/zinc/78/72/54/1121787254.db2.gz LXBBCEDRPPVRJG-KRWDZBQOSA-N 2 0 368.521 4.149 20 0 FIADRP C[C@H]([NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC000671764619 1121797258 /nfs/dbraw/zinc/79/72/58/1121797258.db2.gz KLSXMBDLIZOTEY-YWZLYKJASA-N 2 0 350.934 4.128 20 0 FIADRP COCc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)o1 ZINC000125965276 1121888894 /nfs/dbraw/zinc/88/88/94/1121888894.db2.gz UJNYZZXUROXPBK-UHFFFAOYSA-N 2 0 356.510 4.480 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)NC(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000073012464 1121914529 /nfs/dbraw/zinc/91/45/29/1121914529.db2.gz SMQFQJILBLXJGB-KRWDZBQOSA-N 2 0 354.498 4.066 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000126185224 1121930660 /nfs/dbraw/zinc/93/06/60/1121930660.db2.gz FZZPHGWCKHZKED-XXBNENTESA-N 2 0 374.532 4.028 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000126290492 1121942457 /nfs/dbraw/zinc/94/24/57/1121942457.db2.gz HBTOAXFECOGDAK-JOCHJYFZSA-N 2 0 356.485 4.050 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000126290321 1121942499 /nfs/dbraw/zinc/94/24/99/1121942499.db2.gz HBTOAXFECOGDAK-QFIPXVFZSA-N 2 0 356.485 4.050 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126728216 1121981451 /nfs/dbraw/zinc/98/14/51/1121981451.db2.gz UWELNGOMBYLGGA-BEFAXECRSA-N 2 0 373.541 4.367 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126744406 1121982070 /nfs/dbraw/zinc/98/20/70/1121982070.db2.gz MLOQGIRBDDHFIV-JKSUJKDBSA-N 2 0 359.464 4.128 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3)cc2)C1 ZINC000917006690 1121999301 /nfs/dbraw/zinc/99/93/01/1121999301.db2.gz UMMWCNVMQCAUPH-PNCHPQGNSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3)cc2)C1 ZINC000917006687 1121999335 /nfs/dbraw/zinc/99/93/35/1121999335.db2.gz UMMWCNVMQCAUPH-IEGUWTFLSA-N 2 0 370.512 4.127 20 0 FIADRP CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)CCC2 ZINC000765813123 1122103182 /nfs/dbraw/zinc/10/31/82/1122103182.db2.gz BOLNXNPLWJIMPG-DYESRHJHSA-N 2 0 370.541 4.133 20 0 FIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616198 1122108606 /nfs/dbraw/zinc/10/86/06/1122108606.db2.gz QPIRGRHMCAWEOK-NZQKXSOJSA-N 2 0 374.569 4.406 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630601 1122217433 /nfs/dbraw/zinc/21/74/33/1122217433.db2.gz QODCVAMIOVCXGE-BPBCIEFSSA-N 2 0 360.542 4.158 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)C2CCC2)o1 ZINC000542680641 1122269085 /nfs/dbraw/zinc/26/90/85/1122269085.db2.gz CZSNNGDBWXJHHX-JTHBVZDNSA-N 2 0 368.521 4.176 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(C)cc2C)c1 ZINC000056184869 1122298956 /nfs/dbraw/zinc/29/89/56/1122298956.db2.gz CXGHCZVDXXDCAV-LJQANCHMSA-N 2 0 367.537 4.262 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497860460 1122443738 /nfs/dbraw/zinc/44/37/38/1122443738.db2.gz UMSLSDRQYWQCQC-PGRDOPGGSA-N 2 0 371.569 4.383 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497867177 1122453240 /nfs/dbraw/zinc/45/32/40/1122453240.db2.gz INCDKBFVPDUZLO-UTKZUKDTSA-N 2 0 357.542 4.136 20 0 FIADRP CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000128969612 1122479983 /nfs/dbraw/zinc/47/99/83/1122479983.db2.gz XSJBUTRCGYKTSF-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP CN1CC[C@H]([NH2+]CCc2c[nH]c3ccc(F)cc23)C[C@H]1c1ccccc1 ZINC000556094303 1122648103 /nfs/dbraw/zinc/64/81/03/1122648103.db2.gz WNMUSVOIXOZIFD-UGKGYDQZSA-N 2 0 351.469 4.275 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(Br)cc2Cl)CC[N@@H+]1C ZINC000556228698 1122745277 /nfs/dbraw/zinc/74/52/77/1122745277.db2.gz DJEOUPBNTXESJZ-OCCSQVGLSA-N 2 0 373.766 4.452 20 0 FIADRP CC(C)CC[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231509 1122749107 /nfs/dbraw/zinc/74/91/07/1122749107.db2.gz WFPYVTVTSFAHED-IRLDBZIGSA-N 2 0 358.570 4.330 20 0 FIADRP Cc1nccn1CC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000556237256 1122754466 /nfs/dbraw/zinc/75/44/66/1122754466.db2.gz BSQIKTJAEZGEFC-JOCHJYFZSA-N 2 0 372.532 4.174 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC[C@@H]2CCCC[C@@H]2O)CC1 ZINC000556263525 1122773011 /nfs/dbraw/zinc/77/30/11/1122773011.db2.gz ZMPNRNZFPOYXLP-SBOSXTITSA-N 2 0 358.570 4.351 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000556868734 1123149819 /nfs/dbraw/zinc/14/98/19/1123149819.db2.gz BTXXJEGSSDPJQC-KBXCAEBGSA-N 2 0 356.432 4.358 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000556868684 1123149845 /nfs/dbraw/zinc/14/98/45/1123149845.db2.gz AGVUPCIOJJLDAV-NRFANRHFSA-N 2 0 370.541 4.151 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCOc2ccccc2)C3)cc1 ZINC000499145308 1123287335 /nfs/dbraw/zinc/28/73/35/1123287335.db2.gz FXXUMCINPJSLIS-KOUNCHBCSA-N 2 0 350.506 4.241 20 0 FIADRP CN(CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000499146006 1123287791 /nfs/dbraw/zinc/28/77/91/1123287791.db2.gz IYAJIMFFOSHVNT-VILGAWFOSA-N 2 0 363.549 4.298 20 0 FIADRP Fc1ccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499148182 1123292073 /nfs/dbraw/zinc/29/20/73/1123292073.db2.gz CAUPGXVCWGFVSM-REPLKXPHSA-N 2 0 372.459 4.129 20 0 FIADRP CC[C@@H]1CCCC[N@@H+]1CCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499214776 1123331108 /nfs/dbraw/zinc/33/11/08/1123331108.db2.gz CUZVSYPRKASBPL-BXXSPATCSA-N 2 0 355.570 4.036 20 0 FIADRP O[C@@H]1CCCC[C@H]1CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499218596 1123332757 /nfs/dbraw/zinc/33/27/57/1123332757.db2.gz YPJYKMJERIHLGH-USWKJHDZSA-N 2 0 356.554 4.103 20 0 FIADRP Fc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1F ZINC000499218922 1123334194 /nfs/dbraw/zinc/33/41/94/1123334194.db2.gz ZIZCTOMDVNGEJX-OWZKRDHZSA-N 2 0 356.460 4.293 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cnn(C)c1 ZINC000133397813 1123483723 /nfs/dbraw/zinc/48/37/23/1123483723.db2.gz VOJKNIHEIDOJNZ-QHCPKHFHSA-N 2 0 362.521 4.390 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)CCCC[NH+]3CCCC3)cc2)C1 ZINC000920768943 1123517915 /nfs/dbraw/zinc/51/79/15/1123517915.db2.gz MBHNAFSSQYFKGP-LJQANCHMSA-N 2 0 357.542 4.123 20 0 FIADRP Cc1ccccc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000237739077 1123654266 /nfs/dbraw/zinc/65/42/66/1123654266.db2.gz HRKMMLHWQPJBLJ-UHFFFAOYSA-N 2 0 352.522 4.156 20 0 FIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N(c2ccccc2)C2CCCCC2)CC1 ZINC000615462732 1124017282 /nfs/dbraw/zinc/01/72/82/1124017282.db2.gz DUEZYMKFDFDZLJ-UHFFFAOYSA-N 2 0 371.569 4.016 20 0 FIADRP COCCc1nc(C)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)s1 ZINC000245639157 1124157865 /nfs/dbraw/zinc/15/78/65/1124157865.db2.gz YCHFQNXGYDPEEW-ZACQAIPSSA-N 2 0 367.603 4.049 20 0 FIADRP C[C@@H](CCc1ccc(O)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245651386 1124167328 /nfs/dbraw/zinc/16/73/28/1124167328.db2.gz CNHDYIIOFQGEGT-IITNATTFSA-N 2 0 364.533 4.499 20 0 FIADRP CC[NH+](CC)Cc1cccc(N[C@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000245651653 1124167513 /nfs/dbraw/zinc/16/75/13/1124167513.db2.gz BHXQWEUJMWDECT-XXBNENTESA-N 2 0 366.553 4.246 20 0 FIADRP CCCC[NH+]1CCC(N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245684355 1124194860 /nfs/dbraw/zinc/19/48/60/1124194860.db2.gz JICGCDBRVKWLGJ-NUNAXRQHSA-N 2 0 355.570 4.036 20 0 FIADRP CCCC[NH+]1CCC(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245684362 1124195049 /nfs/dbraw/zinc/19/50/49/1124195049.db2.gz JICGCDBRVKWLGJ-WBDAEOGXSA-N 2 0 355.570 4.036 20 0 FIADRP OCCC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245737501 1124228797 /nfs/dbraw/zinc/22/87/97/1124228797.db2.gz RAFRUBAGZDADFU-KIHHCIJBSA-N 2 0 364.533 4.285 20 0 FIADRP COCc1cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1F ZINC000245769861 1124246260 /nfs/dbraw/zinc/24/62/60/1124246260.db2.gz XABLBCUBMJHQEH-DKUWSORSSA-N 2 0 368.496 4.257 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2ccnc2)cc1 ZINC000245844540 1124261423 /nfs/dbraw/zinc/26/14/23/1124261423.db2.gz FFFLAJLKDKEMND-DLPLYFIVSA-N 2 0 369.415 4.331 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc(C)c1F ZINC000542846556 1124442566 /nfs/dbraw/zinc/44/25/66/1124442566.db2.gz MMANULMQIAYGLM-XMSQKQJNSA-N 2 0 370.512 4.250 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc2c(s1)CCCC2 ZINC000542845589 1124446668 /nfs/dbraw/zinc/44/66/68/1124446668.db2.gz DAVXVJDWKWCNOP-UZLBHIALSA-N 2 0 370.562 4.044 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000246403063 1124486782 /nfs/dbraw/zinc/48/67/82/1124486782.db2.gz LWPUATIJGWBROO-UZLBHIALSA-N 2 0 373.928 4.134 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1 ZINC000060526662 1124571090 /nfs/dbraw/zinc/57/10/90/1124571090.db2.gz RCHSSKJISGDEBF-FQEVSTJZSA-N 2 0 374.532 4.279 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000246916805 1124573151 /nfs/dbraw/zinc/57/31/51/1124573151.db2.gz GCCWQQHCIPLPHZ-HSALFYBXSA-N 2 0 367.537 4.289 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1CN[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247018959 1124582697 /nfs/dbraw/zinc/58/26/97/1124582697.db2.gz LRXCPYHSDMVZSG-PKOBYXMFSA-N 2 0 369.509 4.235 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CC1 ZINC000247054725 1124586072 /nfs/dbraw/zinc/58/60/72/1124586072.db2.gz PCLNNGMTQLGYMA-LAUBAEHRSA-N 2 0 369.940 4.267 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000247194333 1124597510 /nfs/dbraw/zinc/59/75/10/1124597510.db2.gz UPNZHEWABIMSLW-LMVRJCEZSA-N 2 0 354.542 4.271 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)CC2 ZINC000248168507 1124748930 /nfs/dbraw/zinc/74/89/30/1124748930.db2.gz UFUJQNMTDIWFTG-BSIFCXSSSA-N 2 0 356.535 4.417 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C3CCC4(CCCO4)CC3)cc2)CC1 ZINC000564388837 1124764574 /nfs/dbraw/zinc/76/45/74/1124764574.db2.gz ILNCUOLISXXKLR-UHFFFAOYSA-N 2 0 356.554 4.500 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)s1 ZINC000248432654 1124767019 /nfs/dbraw/zinc/76/70/19/1124767019.db2.gz COTXKUFKHXLLSY-PBHICJAKSA-N 2 0 364.942 4.209 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000248458535 1124772482 /nfs/dbraw/zinc/77/24/82/1124772482.db2.gz UVIHBJFPTVXANJ-FGZHOGPDSA-N 2 0 370.924 4.148 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000249255950 1124851632 /nfs/dbraw/zinc/85/16/32/1124851632.db2.gz GNCKJSMCLYBNJU-GUDVDZBRSA-N 2 0 354.460 4.262 20 0 FIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000090417511 1124994596 /nfs/dbraw/zinc/99/45/96/1124994596.db2.gz HVHOJONUWFKUQC-MBSDFSHPSA-N 2 0 356.554 4.278 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F ZINC000090523097 1125001959 /nfs/dbraw/zinc/00/19/59/1125001959.db2.gz FHMQJSWLOZRFBD-JVPBZIDWSA-N 2 0 370.459 4.124 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1OC(F)F ZINC000090586075 1125005684 /nfs/dbraw/zinc/00/56/84/1125005684.db2.gz DVJCTGBNIQSERQ-JKSUJKDBSA-N 2 0 370.484 4.315 20 0 FIADRP Cc1cc2ncc([C@@H](C)[NH2+]C3CCC([NH+]4CCC(C)CC4)CC3)c(C)n2n1 ZINC000090775428 1125019658 /nfs/dbraw/zinc/01/96/58/1125019658.db2.gz VRJGZFSAGWXFLS-QHGAOEGBSA-N 2 0 369.557 4.040 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1nc2ccc(Cl)cc2n1C ZINC000091261386 1125059819 /nfs/dbraw/zinc/05/98/19/1125059819.db2.gz PEACFWLREHVLCI-LSDHHAIUSA-N 2 0 350.938 4.388 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2nc3ccccc3n2C)c1 ZINC000091287808 1125063693 /nfs/dbraw/zinc/06/36/93/1125063693.db2.gz NZHUJLYYELLDSG-QGZVFWFLSA-N 2 0 350.510 4.266 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C(C)C)cc1 ZINC000091312904 1125065035 /nfs/dbraw/zinc/06/50/35/1125065035.db2.gz UVIAYBQVUWWAJP-QFIPXVFZSA-N 2 0 356.510 4.123 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)C1CCCC1 ZINC000091343537 1125067045 /nfs/dbraw/zinc/06/70/45/1125067045.db2.gz HWIHFHSBTVYVNV-MBSDFSHPSA-N 2 0 372.553 4.017 20 0 FIADRP c1ccc(C([NH2+]C2CCN(C[C@H]3CCCO3)CC2)c2ccccc2)cc1 ZINC000679342722 1125069529 /nfs/dbraw/zinc/06/95/29/1125069529.db2.gz QMCSQMMTQDDMNH-JOCHJYFZSA-N 2 0 350.506 4.009 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000656678802 1125176326 /nfs/dbraw/zinc/17/63/26/1125176326.db2.gz URVDDMNRDWLCEK-OAHLLOKOSA-N 2 0 370.459 4.247 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2)cc1C[NH+]1CCCCC1 ZINC000182202401 1125287952 /nfs/dbraw/zinc/28/79/52/1125287952.db2.gz ZISFSSTZXPVSPW-AVRDEDQJSA-N 2 0 368.521 4.065 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)N(CC)C2CCCCC2)CC1 ZINC000521431714 568047705 /nfs/dbraw/zinc/04/77/05/568047705.db2.gz MSWXIJIEHAMRBR-LJQANCHMSA-N 2 0 365.606 4.000 20 0 FIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@@H]2CC[NH+]2CCCC2)nc1 ZINC001165049185 721978270 /nfs/dbraw/zinc/97/82/70/721978270.db2.gz ICDNWORHQYDHTF-FGZHOGPDSA-N 2 0 370.585 4.473 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000093688763 1125491755 /nfs/dbraw/zinc/49/17/55/1125491755.db2.gz QTNZYPZQGHWISR-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CCc1cnccc1[C@@H](C)[NH2+]CC(C)C[NH2+][C@H](C)c1ccncc1CC ZINC000543051359 1125566246 /nfs/dbraw/zinc/56/62/46/1125566246.db2.gz AKHQHVRSRVRASY-QZTJIDSGSA-N 2 0 354.542 4.239 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000152750996 1125643516 /nfs/dbraw/zinc/64/35/16/1125643516.db2.gz AJZDSHXRWOFNLB-INIZCTEOSA-N 2 0 360.473 4.016 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000619772563 1125700995 /nfs/dbraw/zinc/70/09/95/1125700995.db2.gz OVMCUPUJBLFYRS-FQEVSTJZSA-N 2 0 374.532 4.361 20 0 FIADRP COc1ccc2ccc(O)c(C[NH+]3CCC([NH+]4CCCCC4)CC3)c2c1 ZINC000063506833 1079600445 /nfs/dbraw/zinc/60/04/45/1079600445.db2.gz AWTKKIGDLLFIDJ-UHFFFAOYSA-N 2 0 354.494 4.004 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643547922 1079681818 /nfs/dbraw/zinc/68/18/18/1079681818.db2.gz KXLYHPQBVFDPFJ-RBBKRZOGSA-N 2 0 350.506 4.243 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123618515 1080366681 /nfs/dbraw/zinc/36/66/81/1080366681.db2.gz SNZWHHDZANUSJM-LJQANCHMSA-N 2 0 373.585 4.499 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Cl)cc1 ZINC000180641397 1080532293 /nfs/dbraw/zinc/53/22/93/1080532293.db2.gz INDRUXXDXQPIQO-SFTDATJTSA-N 2 0 358.913 4.148 20 0 FIADRP C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683347301 1080700145 /nfs/dbraw/zinc/70/01/45/1080700145.db2.gz OBRMVIJNJREULN-DWOCFRCJSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547834866 1080947485 /nfs/dbraw/zinc/94/74/85/1080947485.db2.gz MLWHRUQVPJSBCJ-FXAWDEMLSA-N 2 0 374.475 4.331 20 0 FIADRP CCC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397492851 1081000816 /nfs/dbraw/zinc/00/08/16/1081000816.db2.gz MJDYJKAAQIRFQE-QFIPXVFZSA-N 2 0 352.522 4.145 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000655745314 1081164923 /nfs/dbraw/zinc/16/49/23/1081164923.db2.gz LOVPWDGVOWJESO-WMZHIEFXSA-N 2 0 371.569 4.116 20 0 FIADRP Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CC2 ZINC000655751690 1081169100 /nfs/dbraw/zinc/16/91/00/1081169100.db2.gz QESOJOWMLPHGGX-GOTSBHOMSA-N 2 0 364.533 4.037 20 0 FIADRP Cc1nn(-c2ccc(C)cc2)cc1CN[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000655758096 1081174123 /nfs/dbraw/zinc/17/41/23/1081174123.db2.gz QKGQYRIWJLSBCE-ICSRJNTNSA-N 2 0 366.553 4.232 20 0 FIADRP COc1cccc(-c2csc(C[NH2+]CCCC[NH+]3CCC(C)CC3)n2)c1 ZINC001648813865 1081215587 /nfs/dbraw/zinc/21/55/87/1081215587.db2.gz CPORDOKNRGUTLL-UHFFFAOYSA-N 2 0 373.566 4.420 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)C1 ZINC000655824935 1081233385 /nfs/dbraw/zinc/23/33/85/1081233385.db2.gz QYVMGUSJQLYRSA-YEALQQFWSA-N 2 0 350.506 4.209 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1Br ZINC001648816713 1081237257 /nfs/dbraw/zinc/23/72/57/1081237257.db2.gz FOMULYBCBFPCOJ-HNNXBMFYSA-N 2 0 353.348 4.359 20 0 FIADRP c1nc(C2CC2)c(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000683774701 1081539860 /nfs/dbraw/zinc/53/98/60/1081539860.db2.gz IVKPMDJKVPSACU-SLFFLAALSA-N 2 0 367.562 4.411 20 0 FIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)CC[NH+](C)C3CCCCC3)c2C1 ZINC000548064173 1081617191 /nfs/dbraw/zinc/61/71/91/1081617191.db2.gz OHEFAQOANKNYPW-UHFFFAOYSA-N 2 0 357.542 4.251 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCc2cnccn2)c2ccc(F)cc2)CC1 ZINC000580221529 1081758012 /nfs/dbraw/zinc/75/80/12/1081758012.db2.gz KDQIEOUUVZVPFA-QFIPXVFZSA-N 2 0 370.516 4.001 20 0 FIADRP Cc1cc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)ccc1Oc1cccnc1 ZINC000580483652 1081970509 /nfs/dbraw/zinc/97/05/09/1081970509.db2.gz OPBCYJSMHOUWQX-FPOVZHCZSA-N 2 0 351.494 4.098 20 0 FIADRP COc1ccsc1[C@@H](C)[NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000471613500 1082098117 /nfs/dbraw/zinc/09/81/17/1082098117.db2.gz QRCUAVADPXVSJS-QGZVFWFLSA-N 2 0 374.550 4.125 20 0 FIADRP COc1ccsc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000471613949 1082098440 /nfs/dbraw/zinc/09/84/40/1082098440.db2.gz SRKXUHDMKNVTQW-GOSISDBHSA-N 2 0 373.566 4.010 20 0 FIADRP C[C@@H]([NH2+]CC(C)(C)Oc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155451 1082391153 /nfs/dbraw/zinc/39/11/53/1082391153.db2.gz GJXIFIJBSRRMAA-CTNGQTDRSA-N 2 0 352.522 4.344 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000656466460 1082442566 /nfs/dbraw/zinc/44/25/66/1082442566.db2.gz QQWYZSVXEOBGLQ-XMMPIXPASA-N 2 0 373.500 4.438 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[NH+]1CCCCCC1 ZINC000510389115 1082470516 /nfs/dbraw/zinc/47/05/16/1082470516.db2.gz NUKMAMBTSNPFIZ-RTBURBONSA-N 2 0 357.542 4.122 20 0 FIADRP CCOCc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000581574977 1082672156 /nfs/dbraw/zinc/67/21/56/1082672156.db2.gz WQRRPOGTESFBRC-CVDCTZTESA-N 2 0 352.522 4.223 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc2ccccc21 ZINC000656676829 1082711045 /nfs/dbraw/zinc/71/10/45/1082711045.db2.gz KHOYHCLBRQJJMC-GOSISDBHSA-N 2 0 352.522 4.381 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccccc3OC(F)F)CC2)C1 ZINC000471781749 1082983587 /nfs/dbraw/zinc/98/35/87/1082983587.db2.gz RJKYSDFLFMYQJB-LPHOPBHVSA-N 2 0 366.496 4.463 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000581973061 1083120694 /nfs/dbraw/zinc/12/06/94/1083120694.db2.gz VVVHOVOPPBZOAK-ZFOVBUMHSA-N 2 0 352.469 4.401 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000581973674 1083123778 /nfs/dbraw/zinc/12/37/78/1083123778.db2.gz YTUJUFXGJCTHRK-NMNUPHIUSA-N 2 0 368.521 4.198 20 0 FIADRP C[C@@H](NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cn2ccccc2n1 ZINC000658317929 1083404716 /nfs/dbraw/zinc/40/47/16/1083404716.db2.gz NZKLWAFMQJTBKB-CTNGQTDRSA-N 2 0 374.532 4.287 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)s1 ZINC000658319515 1083407062 /nfs/dbraw/zinc/40/70/62/1083407062.db2.gz DSRAMHYCPDJCHQ-LPHOPBHVSA-N 2 0 355.551 4.404 20 0 FIADRP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658318605 1083407089 /nfs/dbraw/zinc/40/70/89/1083407089.db2.gz QQQXTHFNBGCCGN-HKUYNNGSSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(CO)c1 ZINC000658320350 1083407908 /nfs/dbraw/zinc/40/79/08/1083407908.db2.gz SPAGBBHRCUASOG-CVDCTZTESA-N 2 0 364.533 4.132 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cnn1-c1ccc(F)cc1 ZINC000658357093 1083427353 /nfs/dbraw/zinc/42/73/53/1083427353.db2.gz QUDWLBAJMYCAAX-MRXNPFEDSA-N 2 0 370.516 4.092 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)ccc1OC(F)F ZINC000658358800 1083430143 /nfs/dbraw/zinc/43/01/43/1083430143.db2.gz YTVUZHWMATVSNV-CQSZACIVSA-N 2 0 368.468 4.069 20 0 FIADRP CC(C)(C)OC(=O)C1CCC([NH2+]C2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000092564398 1083438408 /nfs/dbraw/zinc/43/84/08/1083438408.db2.gz KKBMCHHXCHDBCK-UHFFFAOYSA-N 2 0 364.574 4.131 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000581995698 1083444014 /nfs/dbraw/zinc/44/40/14/1083444014.db2.gz WFKGUMYLWPNVGQ-XMMPIXPASA-N 2 0 363.549 4.311 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1cccc(OC(C)(C)C)n1 ZINC000548487953 1083490616 /nfs/dbraw/zinc/49/06/16/1083490616.db2.gz GDCARKXTJHSJJE-NQIIRXRSSA-N 2 0 367.537 4.259 20 0 FIADRP FC(F)(F)Cc1ncc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000892462702 1083521456 /nfs/dbraw/zinc/52/14/56/1083521456.db2.gz WARYYLHBEYDUJL-UHFFFAOYSA-N 2 0 369.456 4.134 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(Cl)c(F)c1 ZINC000535778222 1083651607 /nfs/dbraw/zinc/65/16/07/1083651607.db2.gz QJMXFVWUZLFZGB-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@@H](c1nc2ccccc2o1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000181139739 1083812060 /nfs/dbraw/zinc/81/20/60/1083812060.db2.gz ZKDBSLCCIPEGMP-KURKYZTESA-N 2 0 371.525 4.100 20 0 FIADRP CCc1nn(C)cc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000092373875 1083925738 /nfs/dbraw/zinc/92/57/38/1083925738.db2.gz OUXGSPSBHMCXOT-UHFFFAOYSA-N 2 0 354.542 4.037 20 0 FIADRP CC(C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(F)c1 ZINC000236701472 1083929176 /nfs/dbraw/zinc/92/91/76/1083929176.db2.gz DPGPAOMACFADHZ-UHFFFAOYSA-N 2 0 356.485 4.325 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@H]([NH3+])c3ccccc3)c2C1 ZINC000236721036 1083972784 /nfs/dbraw/zinc/97/27/84/1083972784.db2.gz LAPMCMBFUCWNNV-FQEVSTJZSA-N 2 0 351.494 4.077 20 0 FIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCCC2)cc1 ZINC000132977087 1083983387 /nfs/dbraw/zinc/98/33/87/1083983387.db2.gz OFQNECJYHQBQKT-QPPBQGQZSA-N 2 0 370.581 4.269 20 0 FIADRP FC(F)(F)CCC[N@H+]1CC[C@H]2C[NH+](CC3OC=CC3=S)C[C@H]2CC1 ZINC001279692843 1084092729 /nfs/dbraw/zinc/09/27/29/1084092729.db2.gz NHWNNTLNXFRMLN-OKILXGFUSA-N 2 0 362.461 4.055 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CC[NH+](C)CC1 ZINC000133421438 1084122351 /nfs/dbraw/zinc/12/23/51/1084122351.db2.gz CKTZDVUZAUEOEC-LJQANCHMSA-N 3 0 365.565 4.235 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)cc2c1C ZINC000472080825 1084264225 /nfs/dbraw/zinc/26/42/25/1084264225.db2.gz UDXSWEVHUPKXFP-UHFFFAOYSA-N 2 0 365.521 4.405 20 0 FIADRP CC(C)[NH+]1CCC(N2CC[NH+](CCc3ccc(C(C)(C)C)cc3)CC2)CC1 ZINC000685839492 1084316521 /nfs/dbraw/zinc/31/65/21/1084316521.db2.gz DRNRDUPGZBIBHU-UHFFFAOYSA-N 2 0 371.613 4.017 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)ccc1F ZINC000431328525 1084391088 /nfs/dbraw/zinc/39/10/88/1084391088.db2.gz NLHUUKKZVVIQHQ-JOCHJYFZSA-N 2 0 368.496 4.380 20 0 FIADRP C[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@H](CCO)c1ccccc1 ZINC001167544464 1084548432 /nfs/dbraw/zinc/54/84/32/1084548432.db2.gz NQWXCQPPRGIIRP-HSZRJFAPSA-N 2 0 352.522 4.228 20 0 FIADRP CC1(C)C[C@@H]([NH2+]CCCCC[NH2+][C@@H]2CC(C)(C)OC2(C)C)C(C)(C)O1 ZINC000444631566 1084571596 /nfs/dbraw/zinc/57/15/96/1084571596.db2.gz MEDVFBPKALHPNQ-IAGOWNOFSA-N 2 0 354.579 4.028 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(CN3CCOCC3)c2)cc1 ZINC000173331474 1084614024 /nfs/dbraw/zinc/61/40/24/1084614024.db2.gz VGFPRZFJDLCSLT-QGZVFWFLSA-N 2 0 356.535 4.092 20 0 FIADRP CC[C@@H]([NH2+]C1CCN(Cc2ccc(NC(C)=O)cc2)CC1)[C@H]1CC1(C)C ZINC000414143277 1084686940 /nfs/dbraw/zinc/68/69/40/1084686940.db2.gz IQESQNYGSMERGJ-NHCUHLMSSA-N 2 0 357.542 4.024 20 0 FIADRP Cc1cccc2[nH]c(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)cc21 ZINC000657356184 1084706196 /nfs/dbraw/zinc/70/61/96/1084706196.db2.gz CSXNSFIOLDHHPX-UHFFFAOYSA-N 2 0 363.505 4.241 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000414184545 1084762397 /nfs/dbraw/zinc/76/23/97/1084762397.db2.gz NZDMNHRDGNXDMQ-DYESRHJHSA-N 2 0 357.929 4.340 20 0 FIADRP Fc1cccc(CC[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC001167559093 1084818654 /nfs/dbraw/zinc/81/86/54/1084818654.db2.gz XGAOFVILMYMYET-HSZRJFAPSA-N 2 0 352.497 4.356 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000613491179 1084820712 /nfs/dbraw/zinc/82/07/12/1084820712.db2.gz JGCXLTJAPOMHTM-UHFFFAOYSA-N 2 0 353.348 4.393 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@@H](C[NH+](C)C)C2)c1C ZINC000582313628 1084858769 /nfs/dbraw/zinc/85/87/69/1084858769.db2.gz JXJNYJAVJNWJJT-AWEZNQCLSA-N 2 0 362.315 4.002 20 0 FIADRP CC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cc(F)ccc1F ZINC000414298265 1084991781 /nfs/dbraw/zinc/99/17/81/1084991781.db2.gz GWMUAHPQOVOLSW-NRFANRHFSA-N 2 0 374.475 4.033 20 0 FIADRP C[C@H](CCOCc1ccccc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582438743 1084999513 /nfs/dbraw/zinc/99/95/13/1084999513.db2.gz BBPHOFHFLGNGJW-DPLHUUCSSA-N 2 0 366.549 4.482 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC000657431179 1085010694 /nfs/dbraw/zinc/01/06/94/1085010694.db2.gz YAJJEAYNPUURIE-XMMPIXPASA-N 2 0 364.533 4.201 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(OC)c(OC)c(OC)c1 ZINC000652137274 1085181992 /nfs/dbraw/zinc/18/19/92/1085181992.db2.gz FFZXXEIQMPTXAF-LJQANCHMSA-N 2 0 372.509 4.015 20 0 FIADRP CC1=C[C@@H](C)C[C@@H](C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)C1 ZINC000582577923 1085186327 /nfs/dbraw/zinc/18/63/27/1085186327.db2.gz FKVJNRAJCMCGMQ-DENIHFKCSA-N 2 0 361.618 4.107 20 0 FIADRP Cc1nccn1CCC[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000048750403 1085191949 /nfs/dbraw/zinc/19/19/49/1085191949.db2.gz XGSXCKBUONMVFG-UHFFFAOYSA-N 2 0 352.463 4.241 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCC2(CCCC2)O1 ZINC000582618815 1085259323 /nfs/dbraw/zinc/25/93/23/1085259323.db2.gz AWWUWTNXSMGUKR-OAQYLSRUSA-N 2 0 357.542 4.112 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000684954697 1085299833 /nfs/dbraw/zinc/29/98/33/1085299833.db2.gz CRLMXRLSXFZDRM-XMSQKQJNSA-N 2 0 368.496 4.323 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000684957855 1085313051 /nfs/dbraw/zinc/31/30/51/1085313051.db2.gz YXUFDEPDTZDEQF-QFIPXVFZSA-N 2 0 361.489 4.474 20 0 FIADRP CC(C)CCOc1ccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000657536063 1085450948 /nfs/dbraw/zinc/45/09/48/1085450948.db2.gz FEUYUMMAKNCWKQ-UHFFFAOYSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(F)c(Cl)c2Cl)C[C@@H](C)O1 ZINC000432229681 1085690924 /nfs/dbraw/zinc/69/09/24/1085690924.db2.gz TXCRPMJIDSNDOH-CHWSQXEVSA-N 2 0 363.304 4.112 20 0 FIADRP CC(C)[C@@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000657612913 1085697468 /nfs/dbraw/zinc/69/74/68/1085697468.db2.gz FBYZDVVZDHAQRF-HSZRJFAPSA-N 2 0 351.538 4.323 20 0 FIADRP CCCCOc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657612919 1085697490 /nfs/dbraw/zinc/69/74/90/1085697490.db2.gz FFSBOGCOLNNKPQ-UHFFFAOYSA-N 2 0 367.537 4.262 20 0 FIADRP Cc1cc(N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)nc(C(C)C)n1 ZINC000431491334 1085759695 /nfs/dbraw/zinc/75/96/95/1085759695.db2.gz UHSLYONBYDEGJD-UHFFFAOYSA-N 2 0 364.537 4.401 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000126042209 1085990091 /nfs/dbraw/zinc/99/00/91/1085990091.db2.gz XXGZJIZUDDWOTA-INIZCTEOSA-N 2 0 360.448 4.290 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000511952632 1086047383 /nfs/dbraw/zinc/04/73/83/1086047383.db2.gz AEGIGPRAEGYFEG-CYVLTUHYSA-N 2 0 365.521 4.138 20 0 FIADRP C[N@H+](CCCc1cc(-c2ccccc2)no1)Cc1cccc2c1CC[NH2+]C2 ZINC000662252910 1086377718 /nfs/dbraw/zinc/37/77/18/1086377718.db2.gz DIORYDVCMIFKFF-UHFFFAOYSA-N 2 0 361.489 4.052 20 0 FIADRP Brc1cccc(C2([NH2+]Cc3cccc4c3CC[NH2+]C4)CCC2)c1 ZINC000662258138 1086380012 /nfs/dbraw/zinc/38/00/12/1086380012.db2.gz INLCLDIPJVGFHR-UHFFFAOYSA-N 2 0 371.322 4.264 20 0 FIADRP c1cnn(C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c2ccccc2)c1 ZINC000663301054 1086385505 /nfs/dbraw/zinc/38/55/05/1086385505.db2.gz FNUHOGUNFDNYLM-XMMPIXPASA-N 2 0 374.532 4.400 20 0 FIADRP COc1cccc(OCC[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167659334 1086395374 /nfs/dbraw/zinc/39/53/74/1086395374.db2.gz QCULIGKKECPLLB-LJQANCHMSA-N 2 0 360.542 4.051 20 0 FIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295718 1086399034 /nfs/dbraw/zinc/39/90/34/1086399034.db2.gz HYEVVSGHLTXEBF-YOEHRIQHSA-N 2 0 374.916 4.163 20 0 FIADRP Clc1cccc(-c2cnc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)o2)c1 ZINC000662295143 1086400037 /nfs/dbraw/zinc/40/00/37/1086400037.db2.gz TWTWWPBVFAGCIL-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@@H]1CCOC1 ZINC000165553093 1086537001 /nfs/dbraw/zinc/53/70/01/1086537001.db2.gz ONBUONGQEPPASL-XMSQKQJNSA-N 2 0 361.489 4.113 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]CCCn1ccnc1)CCCS2 ZINC000663435246 1086540202 /nfs/dbraw/zinc/54/02/02/1086540202.db2.gz ANGRPGDKNXCDDR-HNNXBMFYSA-N 2 0 366.328 4.253 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCSc3ccc(Br)cc32)C1 ZINC000663451759 1086553168 /nfs/dbraw/zinc/55/31/68/1086553168.db2.gz UQHXDAKJKDYQOY-IVMMDQJWSA-N 2 0 369.372 4.306 20 0 FIADRP Cc1c([C@@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cnn1-c1ccc(F)cc1 ZINC000663468220 1086571475 /nfs/dbraw/zinc/57/14/75/1086571475.db2.gz KLFFYSBIMDMSAO-APWZRJJASA-N 2 0 370.516 4.092 20 0 FIADRP Cc1c([C@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cnn1-c1ccc(F)cc1 ZINC000663468222 1086572606 /nfs/dbraw/zinc/57/26/06/1086572606.db2.gz KLFFYSBIMDMSAO-QFBILLFUSA-N 2 0 370.516 4.092 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H]2C[C@H](c3nc(C)cs3)O[C@@H]2C1 ZINC001167821770 1086590029 /nfs/dbraw/zinc/59/00/29/1086590029.db2.gz FOMLPVWJTRPBHK-INDMIFKZSA-N 2 0 365.587 4.114 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001167824288 1086606262 /nfs/dbraw/zinc/60/62/62/1086606262.db2.gz GLKXKWYJKCBEOF-FQEVSTJZSA-N 3 0 361.574 4.078 20 0 FIADRP c1ccc(C2([NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)CCOCC2)cc1 ZINC000583367867 1086617204 /nfs/dbraw/zinc/61/72/04/1086617204.db2.gz QLOKMHKTAXBFHW-UHFFFAOYSA-N 2 0 364.533 4.468 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C2 ZINC001167826839 1086618536 /nfs/dbraw/zinc/61/85/36/1086618536.db2.gz RLMSYPYWVLNXCZ-OKYOBFRVSA-N 2 0 367.578 4.017 20 0 FIADRP C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000525641290 1086669250 /nfs/dbraw/zinc/66/92/50/1086669250.db2.gz ICHJBCDEXATZJG-MJGOQNOKSA-N 2 0 372.557 4.055 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@@H]1c1cccc(OC)c1 ZINC001167833648 1086670574 /nfs/dbraw/zinc/67/05/74/1086670574.db2.gz CUQOQHKAGRFKSK-YLJYHZDGSA-N 2 0 350.572 4.296 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(-n3cccn3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000080338786 1086675473 /nfs/dbraw/zinc/67/54/73/1086675473.db2.gz UCPFJBOKVJZOSK-SIKLNZKXSA-N 2 0 360.505 4.015 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(NC(=O)Nc2cccc(C)c2)CC1 ZINC001167836168 1086707322 /nfs/dbraw/zinc/70/73/22/1086707322.db2.gz WSHPBMZSXISCKO-LJQANCHMSA-N 2 0 374.573 4.091 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](Cc1cccc(OC)c1)[C@H](C)COC ZINC001167838066 1086711943 /nfs/dbraw/zinc/71/19/43/1086711943.db2.gz PFQUNHFSYJSECK-RTBURBONSA-N 2 0 350.547 4.043 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cc2n(n1)CCCC2 ZINC000647295043 1086728458 /nfs/dbraw/zinc/72/84/58/1086728458.db2.gz YBVMSYIAOZLNTP-IRFCIJBXSA-N 2 0 366.553 4.171 20 0 FIADRP CCCCc1oc2ccccc2c1C[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000650706313 1086755534 /nfs/dbraw/zinc/75/55/34/1086755534.db2.gz ILUCNOWVVBCBKI-YZZKKUAISA-N 2 0 370.537 4.494 20 0 FIADRP [NH3+]CC1(CC[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000650713494 1086787113 /nfs/dbraw/zinc/78/71/13/1086787113.db2.gz UMTHVIHRPMOYSD-UHFFFAOYSA-N 2 0 356.322 4.336 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000650722533 1086818527 /nfs/dbraw/zinc/81/85/27/1086818527.db2.gz WBTIGQRMYLKIHT-NSISKUIASA-N 2 0 374.525 4.415 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3F)s2)C1 ZINC000650721990 1086826419 /nfs/dbraw/zinc/82/64/19/1086826419.db2.gz HYNFJGFYTZHEQN-XPGWFJOJSA-N 2 0 374.525 4.415 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncc(F)c1 ZINC000657773402 1086833347 /nfs/dbraw/zinc/83/33/47/1086833347.db2.gz RIDPVZYOPUJODQ-FXAWDEMLSA-N 2 0 353.485 4.174 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)CC1 ZINC000728571429 1086869601 /nfs/dbraw/zinc/86/96/01/1086869601.db2.gz DWVXGVSISUUVDS-GOSISDBHSA-N 2 0 373.585 4.363 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc3ccccc3c2)CC1 ZINC000728571852 1086884384 /nfs/dbraw/zinc/88/43/84/1086884384.db2.gz OHDLHKKRFAJRMA-SFHVURJKSA-N 2 0 367.537 4.219 20 0 FIADRP CC(C)C(C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C(C)C ZINC000583644326 1086892973 /nfs/dbraw/zinc/89/29/73/1086892973.db2.gz YUQQGXFCUBCEFA-QFIPXVFZSA-N 2 0 372.597 4.433 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000583663669 1086907335 /nfs/dbraw/zinc/90/73/35/1086907335.db2.gz QEXOWUIFHAMUMQ-IRLDBZIGSA-N 2 0 368.569 4.287 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CC2 ZINC000650754517 1086962079 /nfs/dbraw/zinc/96/20/79/1086962079.db2.gz KWHIDPAUVUPBCD-KRWDZBQOSA-N 2 0 363.274 4.132 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000151313165 1087084917 /nfs/dbraw/zinc/08/49/17/1087084917.db2.gz VMYHMKQXRDEFRX-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)C(C)(C)C(F)F ZINC000657826472 1087159423 /nfs/dbraw/zinc/15/94/23/1087159423.db2.gz GWCVGQSFXGLSDX-BZUAXINKSA-N 2 0 354.485 4.065 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C(F)F ZINC000657826479 1087159722 /nfs/dbraw/zinc/15/97/22/1087159722.db2.gz GWCVGQSFXGLSDX-XHSDSOJGSA-N 2 0 354.485 4.065 20 0 FIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000657834446 1087214124 /nfs/dbraw/zinc/21/41/24/1087214124.db2.gz KBFYWRHNGZDPDH-JSGCOSHPSA-N 2 0 360.851 4.364 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)c(Cl)c1 ZINC000657839871 1087277495 /nfs/dbraw/zinc/27/74/95/1087277495.db2.gz IITACHDVHPVTLK-IACUBPJLSA-N 2 0 357.723 4.380 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@@H]1CCCn2nccc21)C1CCCCC1 ZINC000657841469 1087279778 /nfs/dbraw/zinc/27/97/78/1087279778.db2.gz GUVOASVJEDGJEX-OAQYLSRUSA-N 2 0 352.526 4.272 20 0 FIADRP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657839830 1087282475 /nfs/dbraw/zinc/28/24/75/1087282475.db2.gz HKEKBJAXYOKRPX-QYZOEREBSA-N 2 0 365.359 4.233 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCCc2nc3ccccc3n2C)CC1 ZINC000090050258 1087401482 /nfs/dbraw/zinc/40/14/82/1087401482.db2.gz VRGQPLYWPORKMW-WIYYLYMNSA-N 2 0 368.569 4.139 20 0 FIADRP CC(C)(C)c1nc(CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cs1 ZINC000090948921 1087411192 /nfs/dbraw/zinc/41/11/92/1087411192.db2.gz FZUDGROZVRSXOF-UHFFFAOYSA-N 2 0 371.594 4.280 20 0 FIADRP FCC1(CF)CC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC000657875104 1087521003 /nfs/dbraw/zinc/52/10/03/1087521003.db2.gz AIBCURCJLDZNFQ-UHFFFAOYSA-N 2 0 364.524 4.399 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000708567379 1087587029 /nfs/dbraw/zinc/58/70/29/1087587029.db2.gz AYRDENNWAUIKEL-JTAQYXEDSA-N 2 0 366.549 4.374 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2ccncc2s1 ZINC000657999156 1087696425 /nfs/dbraw/zinc/69/64/25/1087696425.db2.gz SQUJQOXOMFRQFJ-AEFFLSMTSA-N 2 0 351.519 4.469 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]C3CCC([NH+](C)C)CC3)cc2cc1OC ZINC000658037377 1087703002 /nfs/dbraw/zinc/70/30/02/1087703002.db2.gz BTQAQCOTVZHVKY-VMEOHVCESA-N 2 0 356.510 4.380 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1C(F)(F)F ZINC000658068505 1087710439 /nfs/dbraw/zinc/71/04/39/1087710439.db2.gz FMRNZPPGYBUVND-OAHLLOKOSA-N 2 0 370.459 4.247 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(F)c(F)c1 ZINC000658136380 1087725080 /nfs/dbraw/zinc/72/50/80/1087725080.db2.gz GYXYEVUFTKRUHK-DENIHFKCSA-N 2 0 374.475 4.018 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c2ccccc21 ZINC000658136611 1087730810 /nfs/dbraw/zinc/73/08/10/1087730810.db2.gz HNVLBGJQJZODEZ-OYDLWJJNSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H]([NH2+]CCc1ccnc2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000658128150 1087733458 /nfs/dbraw/zinc/73/34/58/1087733458.db2.gz SDDXDOOTJHNAIM-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658138002 1087742285 /nfs/dbraw/zinc/74/22/85/1087742285.db2.gz LNTGYYCPKXADNE-UTKZUKDTSA-N 2 0 370.562 4.216 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc2ccccc2s1 ZINC000658139960 1087743486 /nfs/dbraw/zinc/74/34/86/1087743486.db2.gz RLAYZEHHEBWTTM-JXFKEZNVSA-N 2 0 366.530 4.319 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc(C)c1F ZINC000658164489 1087759920 /nfs/dbraw/zinc/75/99/20/1087759920.db2.gz DTNHLIUVOUIUSP-GOSISDBHSA-N 2 0 355.501 4.400 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166415 1087761491 /nfs/dbraw/zinc/76/14/91/1087761491.db2.gz UZAIBWVBWIWACC-MRXNPFEDSA-N 2 0 373.928 4.306 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166411 1087762314 /nfs/dbraw/zinc/76/23/14/1087762314.db2.gz UZAIBWVBWIWACC-INIZCTEOSA-N 2 0 373.928 4.306 20 0 FIADRP CSc1ccccc1C[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168427 1087763877 /nfs/dbraw/zinc/76/38/77/1087763877.db2.gz XBYGMFXFYIBGOD-GOSISDBHSA-N 2 0 369.578 4.236 20 0 FIADRP Cc1ccccc1C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000658167750 1087765288 /nfs/dbraw/zinc/76/52/88/1087765288.db2.gz UCEVDZVJBBNKFV-DEOSSOPVSA-N 2 0 363.549 4.213 20 0 FIADRP CC(C)n1cncc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000424136703 1087785223 /nfs/dbraw/zinc/78/52/23/1087785223.db2.gz BDEVGKMPZZGWJK-UHFFFAOYSA-N 2 0 368.569 4.289 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000424134869 1087785869 /nfs/dbraw/zinc/78/58/69/1087785869.db2.gz OEDPMICLQUUYQC-OALUTQOASA-N 2 0 354.542 4.232 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000424138733 1087787830 /nfs/dbraw/zinc/78/78/30/1087787830.db2.gz USBMPUSEMBOJDJ-OALUTQOASA-N 2 0 354.542 4.232 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC([C@@H]4OCC[C@H]4[NH3+])CC3)s2)cc1 ZINC000414778138 1087838077 /nfs/dbraw/zinc/83/80/77/1087838077.db2.gz GHVRJZMJWSYTPU-CTNGQTDRSA-N 2 0 356.535 4.052 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)C[C@H]2C1 ZINC000424322241 1087920117 /nfs/dbraw/zinc/92/01/17/1087920117.db2.gz VBAWBJUVKGVYMR-MLMHEIKCSA-N 2 0 368.521 4.205 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)C[C@H]2C1 ZINC000424322246 1087920342 /nfs/dbraw/zinc/92/03/42/1087920342.db2.gz VBAWBJUVKGVYMR-XBLRLVIHSA-N 2 0 368.521 4.205 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]CC[C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424308349 1087932132 /nfs/dbraw/zinc/93/21/32/1087932132.db2.gz ZVDPDQFIMIUHSP-VUOLKEHKSA-N 2 0 356.554 4.080 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000580099822 1087946780 /nfs/dbraw/zinc/94/67/80/1087946780.db2.gz YVHJOHZFCPUXAJ-JCNLHEQBSA-N 2 0 352.869 4.265 20 0 FIADRP Fc1cccc(Cl)c1COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414825272 1088328825 /nfs/dbraw/zinc/32/88/25/1088328825.db2.gz GXIUHSMATOJDFA-SJPCQFCGSA-N 2 0 374.887 4.431 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4F)cc2)C[C@@H](C)O1 ZINC000513859850 1088454963 /nfs/dbraw/zinc/45/49/63/1088454963.db2.gz QMBYOWGDEIOFGA-QZMQVMSPSA-N 2 0 368.496 4.212 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)[C@H]2CCC[C@H]21 ZINC000514095659 1088715203 /nfs/dbraw/zinc/71/52/03/1088715203.db2.gz SFAOXJNFKAJOOO-MSYGRNIXSA-N 3 0 355.570 4.023 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC([NH+](C)Cc2ccccc2)CC1 ZINC000514089434 1088734203 /nfs/dbraw/zinc/73/42/03/1088734203.db2.gz QBMWAXLURZVVSW-RBKXMNCYSA-N 3 0 357.586 4.284 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000415018990 1089044961 /nfs/dbraw/zinc/04/49/61/1089044961.db2.gz VDDLTXWESCTSMQ-OAHLLOKOSA-N 2 0 359.901 4.199 20 0 FIADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)C1 ZINC000415029201 1089058774 /nfs/dbraw/zinc/05/87/74/1089058774.db2.gz DOMJLBCFQQEVLV-CMPLNLGQSA-N 2 0 356.322 4.334 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000415042241 1089078962 /nfs/dbraw/zinc/07/89/62/1089078962.db2.gz QNLXVBRAKRQASM-CHWSQXEVSA-N 2 0 365.340 4.395 20 0 FIADRP COc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415044274 1089082220 /nfs/dbraw/zinc/08/22/20/1089082220.db2.gz BONQTDIOCGJRDG-QGZVFWFLSA-N 2 0 363.299 4.028 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 ZINC000415048935 1089085426 /nfs/dbraw/zinc/08/54/26/1089085426.db2.gz GQYPWEUBJJBPRL-SFHVURJKSA-N 2 0 360.885 4.071 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415045264 1089090131 /nfs/dbraw/zinc/09/01/31/1089090131.db2.gz BHXGZRPZGYRQID-VQIMIIECSA-N 2 0 373.928 4.435 20 0 FIADRP C[C@H](c1ccncc1)[NH+]1CCC(Nc2cc[nH+]c3cc(F)ccc23)CC1 ZINC000425232243 1089104432 /nfs/dbraw/zinc/10/44/32/1089104432.db2.gz FJBJFVSPLWOHQT-OAHLLOKOSA-N 2 0 350.441 4.406 20 0 FIADRP COc1cccc([C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2cc(F)ccc2OC)c1 ZINC000415077555 1089125979 /nfs/dbraw/zinc/12/59/79/1089125979.db2.gz FLJMWGFULAIYSD-IVMBPFOVSA-N 2 0 372.484 4.039 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)[C@H](OC1CCOCC1)c1ccccc1 ZINC000415084431 1089140885 /nfs/dbraw/zinc/14/08/85/1089140885.db2.gz PDZGAPXXLCETDA-SQVLJLFZSA-N 2 0 374.569 4.212 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000415089512 1089148223 /nfs/dbraw/zinc/14/82/23/1089148223.db2.gz NKFSODOWEUQBMY-UHFFFAOYSA-N 2 0 355.482 4.022 20 0 FIADRP FC(F)(F)c1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000415103703 1089163703 /nfs/dbraw/zinc/16/37/03/1089163703.db2.gz JUNVTFOTYOVRMH-FGTMMUONSA-N 2 0 352.444 4.247 20 0 FIADRP C[C@H](C[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000415115155 1089174158 /nfs/dbraw/zinc/17/41/58/1089174158.db2.gz WKQLHDJENJGLPS-MDASCCDHSA-N 2 0 370.459 4.027 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)C1 ZINC000415126539 1089178106 /nfs/dbraw/zinc/17/81/06/1089178106.db2.gz PMOUUAQJSGVSKE-OXQOHEQNSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3F)CC2)C1 ZINC000415122057 1089184907 /nfs/dbraw/zinc/18/49/07/1089184907.db2.gz JIQTXVFHZFMEBC-GGAORHGYSA-N 2 0 368.496 4.211 20 0 FIADRP C[NH+](C)[C@@H]1CCOc2c(N[C@@H]3CCC[N@H+](Cc4ccccc4)C3)cccc21 ZINC000435023451 1089209883 /nfs/dbraw/zinc/20/98/83/1089209883.db2.gz KKONVTUCWYMUMP-DENIHFKCSA-N 2 0 365.521 4.148 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000514602036 1089256573 /nfs/dbraw/zinc/25/65/73/1089256573.db2.gz DJSNIDXZKDSVKJ-SIKLNZKXSA-N 2 0 374.532 4.158 20 0 FIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)Cn1ccc(-c2ccc(F)cc2)n1 ZINC000728708749 1089732039 /nfs/dbraw/zinc/73/20/39/1089732039.db2.gz MTNCYHLJODPEPM-UHFFFAOYSA-N 2 0 366.484 4.230 20 0 FIADRP CO[C@H](C[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000549392956 1090018907 /nfs/dbraw/zinc/01/89/07/1090018907.db2.gz FUBBJGNKRPTJHF-WOIUINJBSA-N 2 0 352.522 4.120 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc([C@]23CC[NH2+][C@@H]2COCC3)cc1 ZINC001167733392 1090256054 /nfs/dbraw/zinc/25/60/54/1090256054.db2.gz SNABOYHSMXNNNV-DHIUTWEWSA-N 2 0 373.585 4.021 20 0 FIADRP COCC[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549421567 1090317847 /nfs/dbraw/zinc/31/78/47/1090317847.db2.gz ROBDRBHKHNGFOY-PXWCZTGZSA-N 2 0 350.934 4.269 20 0 FIADRP c1[nH]nc2cccc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)c12 ZINC000628293068 1090387381 /nfs/dbraw/zinc/38/73/81/1090387381.db2.gz KKDKNVSESCZBNW-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000511565597 1090441142 /nfs/dbraw/zinc/44/11/42/1090441142.db2.gz KJLJRHPULSHRIC-GUDVDZBRSA-N 2 0 352.522 4.069 20 0 FIADRP C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185687510 1090565466 /nfs/dbraw/zinc/56/54/66/1090565466.db2.gz QGFIQQJXLFCAHU-NJSLBKSFSA-N 2 0 371.352 4.269 20 0 FIADRP [NH3+]C[C@@H](C[NH+]1CCC(c2noc3cc(F)ccc32)CC1)c1ccc(F)cc1 ZINC000584774835 1090868775 /nfs/dbraw/zinc/86/87/75/1090868775.db2.gz USQCDMKVZDUWPR-INIZCTEOSA-N 2 0 371.431 4.028 20 0 FIADRP C[C@H](C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500124449 1091052482 /nfs/dbraw/zinc/05/24/82/1091052482.db2.gz NSNYGCLCRVTKBK-NVXWUHKLSA-N 2 0 354.460 4.473 20 0 FIADRP C[N@H+](CCCCC1CCOCC1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000499600164 1091127415 /nfs/dbraw/zinc/12/74/15/1091127415.db2.gz LEZPBYSTHPHYIE-UHFFFAOYSA-N 2 0 359.558 4.217 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc2c(c1)ncn2[C@@H]1CCC[NH2+]CC1 ZINC001167752154 1091160041 /nfs/dbraw/zinc/16/00/41/1091160041.db2.gz QKDVRLZJWULBAV-AZUAARDMSA-N 2 0 369.557 4.027 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000390559316 1091252454 /nfs/dbraw/zinc/25/24/54/1091252454.db2.gz AHFRZXFAWKDHTJ-UKKFODGLSA-N 2 0 362.517 4.468 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc(C[NH+](C)C)cc2)cc1 ZINC000512222641 1091928737 /nfs/dbraw/zinc/92/87/37/1091928737.db2.gz VFRCILFUDGLBFN-GOSISDBHSA-N 2 0 365.521 4.375 20 0 FIADRP COCC[C@H](c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512237458 1091945883 /nfs/dbraw/zinc/94/58/83/1091945883.db2.gz RJZZTCQVMSMWKO-DNQXCXABSA-N 2 0 364.533 4.362 20 0 FIADRP CC(C)(C)OC(=O)CCCC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512258510 1091973803 /nfs/dbraw/zinc/97/38/03/1091973803.db2.gz FUHBFKJNHMMQJM-HSZRJFAPSA-N 2 0 372.553 4.096 20 0 FIADRP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](CCCCC4CCOCC4)C3)C2)cc1 ZINC000512291458 1092013815 /nfs/dbraw/zinc/01/38/15/1092013815.db2.gz JSKOZQCSWLRXFF-QHCPKHFHSA-N 2 0 356.554 4.181 20 0 FIADRP COc1cc(F)c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1OC ZINC000520822218 1092296963 /nfs/dbraw/zinc/29/69/63/1092296963.db2.gz GKMODYYPJMJGPV-UHFFFAOYSA-N 2 0 372.484 4.119 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C1CCN(c2cccc(C)n2)CC1 ZINC000474028194 1092318713 /nfs/dbraw/zinc/31/87/13/1092318713.db2.gz AMMWVVUWAKAVMJ-OAQYLSRUSA-N 2 0 365.521 4.380 20 0 FIADRP C[C@@H]1CC(NCC[N@H+](C)Cc2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012504 1092338657 /nfs/dbraw/zinc/33/86/57/1092338657.db2.gz BCRBKECNTXGBTO-NHCUHLMSSA-N 2 0 365.565 4.150 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000474028964 1092368387 /nfs/dbraw/zinc/36/83/87/1092368387.db2.gz GRXMDPWHNMSFKE-JOCHJYFZSA-N 2 0 365.521 4.319 20 0 FIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc(Cl)c1OC ZINC000520950462 1092376204 /nfs/dbraw/zinc/37/62/04/1092376204.db2.gz WBOOJQUDPPSOJV-INIZCTEOSA-N 2 0 368.949 4.492 20 0 FIADRP C[C@@H]1CC([NH2+]C2CC(C)(C)N(O)C(C)(C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014152 1092684792 /nfs/dbraw/zinc/68/47/92/1092684792.db2.gz KPYDTVPKJVJSLT-QZTJIDSGSA-N 2 0 373.585 4.428 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)C2)cc1 ZINC000442709032 1092734682 /nfs/dbraw/zinc/73/46/82/1092734682.db2.gz MZVAONBPDSRHFM-LESCRADOSA-N 2 0 352.444 4.415 20 0 FIADRP C[N@H+](CCCCOc1cccc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442754042 1092756130 /nfs/dbraw/zinc/75/61/30/1092756130.db2.gz HMNYVHFGSSBUNL-SJPCQFCGSA-N 2 0 356.432 4.079 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)C[C@H](C)C2)cc1)C(C)C ZINC000110172751 1092787503 /nfs/dbraw/zinc/78/75/03/1092787503.db2.gz QKVAPYSWDDQCAU-BGYRXZFFSA-N 2 0 373.585 4.015 20 0 FIADRP FC(F)C1CCC([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000442831332 1092796902 /nfs/dbraw/zinc/79/69/02/1092796902.db2.gz VXWREKNYGQLBDM-UHFFFAOYSA-N 2 0 366.496 4.117 20 0 FIADRP COCCC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000442865497 1092812202 /nfs/dbraw/zinc/81/22/02/1092812202.db2.gz UCMCIGGDJAAAAT-NFBKMPQASA-N 2 0 370.512 4.405 20 0 FIADRP COCCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(F)cc1 ZINC000442871576 1092819191 /nfs/dbraw/zinc/81/91/91/1092819191.db2.gz LYWVWDPOGFOEFT-WIYYLYMNSA-N 2 0 350.522 4.251 20 0 FIADRP Clc1ccccc1CN1CCC([NH2+]CCCCC[NH+]2CCCC2)CC1 ZINC000549868521 1093077459 /nfs/dbraw/zinc/07/74/59/1093077459.db2.gz XUUDJJHKYJJFAQ-UHFFFAOYSA-N 2 0 363.977 4.160 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3[C@H]3CCOC3)CC2)cc1 ZINC000474055853 1093160400 /nfs/dbraw/zinc/16/04/00/1093160400.db2.gz UAULLWJLDFENQF-YTFSRNRJSA-N 2 0 356.554 4.084 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000474057477 1093163309 /nfs/dbraw/zinc/16/33/09/1093163309.db2.gz MWVZESWLOBHPDZ-YPAWHYETSA-N 2 0 374.569 4.092 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3[C@@H]3CCOC3)CC2)c1 ZINC000474069756 1093181209 /nfs/dbraw/zinc/18/12/09/1093181209.db2.gz ZAKFAYLSLVINHW-HLAWJBBLSA-N 2 0 362.583 4.145 20 0 FIADRP COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000474074161 1093188440 /nfs/dbraw/zinc/18/84/40/1093188440.db2.gz PSUPNMORYLGMSW-INIZCTEOSA-N 2 0 368.477 4.233 20 0 FIADRP C[C@@H]1CC(n2nc(CC[NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168019823 1093190924 /nfs/dbraw/zinc/19/09/24/1093190924.db2.gz KFNLJQPSDLHWDM-QZTJIDSGSA-N 2 0 362.521 4.152 20 0 FIADRP Cc1ccc(CCC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cn1 ZINC001168020124 1093198832 /nfs/dbraw/zinc/19/88/32/1093198832.db2.gz KQKCFZOIYVEUAJ-WOJBJXKFSA-N 2 0 351.538 4.354 20 0 FIADRP Cc1ccnc(CCC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168020400 1093211802 /nfs/dbraw/zinc/21/18/02/1093211802.db2.gz MXWBVSYTRNDVBR-WOJBJXKFSA-N 2 0 351.538 4.354 20 0 FIADRP C[C@@H]1C[C@@H](NC2CC[NH+](C3CCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020361 1093213959 /nfs/dbraw/zinc/21/39/59/1093213959.db2.gz MRBJFYRHVJPWEJ-HATOLVCRSA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC3(CO)CC(c4ccccc4)C3)CC2)C1 ZINC000433094076 1093240941 /nfs/dbraw/zinc/24/09/41/1093240941.db2.gz TXUPQOAJYVMKOG-BXDDPRONSA-N 2 0 370.581 4.175 20 0 FIADRP C[C@@H]1CC([NH2+][C@H](CO)CC2CCCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168021542 1093242843 /nfs/dbraw/zinc/24/28/43/1093242843.db2.gz PWZKNZHCIZDPNG-PWHSHALESA-N 2 0 358.570 4.349 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CCc3ccccc3[C@H]2O)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023859 1093368095 /nfs/dbraw/zinc/36/80/95/1093368095.db2.gz YLNJTDWMRZWJHR-MCJPXMOYSA-N 2 0 364.533 4.066 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168026976 1093506824 /nfs/dbraw/zinc/50/68/24/1093506824.db2.gz MVQFNTWMTTYRMM-DRSNIGMVSA-N 2 0 372.940 4.405 20 0 FIADRP CCC(CC)[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168033366 1093713798 /nfs/dbraw/zinc/71/37/98/1093713798.db2.gz KRTQPGLOORYSOS-MXNKGDRCSA-N 2 0 357.586 4.281 20 0 FIADRP COc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)ccc1OCc1ccccc1 ZINC000513063330 1093716494 /nfs/dbraw/zinc/71/64/94/1093716494.db2.gz YBAHTKOOBOMYRD-IBGZPJMESA-N 2 0 368.521 4.096 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)C1 ZINC000067222723 1093719057 /nfs/dbraw/zinc/71/90/57/1093719057.db2.gz LUUAIYIFGGEITG-HXUWFJFHSA-N 2 0 367.537 4.099 20 0 FIADRP C[C@@H]1CC([NH2+]CC(C)(C)C(=O)OC(C)(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168034194 1093744219 /nfs/dbraw/zinc/74/42/19/1093744219.db2.gz OMMNQCSQNOHQOV-QZTJIDSGSA-N 2 0 374.569 4.386 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNCc1cnc2ccccc2n1 ZINC000614387145 1093802221 /nfs/dbraw/zinc/80/22/21/1093802221.db2.gz AUFSGUKDOIPMHG-SFHVURJKSA-N 2 0 360.505 4.294 20 0 FIADRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)[C@@H]1C ZINC000474466930 1093813740 /nfs/dbraw/zinc/81/37/40/1093813740.db2.gz BKXVWPBLHUPFNT-WEMPKCCASA-N 2 0 372.553 4.128 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000474474546 1093819888 /nfs/dbraw/zinc/81/98/88/1093819888.db2.gz HFRCMLJDVXUSSZ-GUDVDZBRSA-N 2 0 362.558 4.298 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)[NH+]2CCCC2)o1 ZINC000513490393 1094158743 /nfs/dbraw/zinc/15/87/43/1094158743.db2.gz DXAXFZRWCQFUBI-NYVOZVTQSA-N 2 0 373.585 4.358 20 0 FIADRP Cc1cccn2c(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cnc12 ZINC000513494992 1094161951 /nfs/dbraw/zinc/16/19/51/1094161951.db2.gz LCXVTFDYKCMLMS-TZIWHRDSSA-N 2 0 362.521 4.033 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)cc1 ZINC000513493896 1094161988 /nfs/dbraw/zinc/16/19/88/1094161988.db2.gz DKVWXKPAZJOVMR-DEOSSOPVSA-N 2 0 374.532 4.392 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2csc(C3CC3)n2)C[N@@H+]1Cc1ccccc1 ZINC000513500795 1094174172 /nfs/dbraw/zinc/17/41/72/1094174172.db2.gz OWWKLFCPPUTEMA-AEFFLSMTSA-N 2 0 355.551 4.411 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000513518780 1094178824 /nfs/dbraw/zinc/17/88/24/1094178824.db2.gz NYOJNHWFMDRHKW-XMMPIXPASA-N 2 0 374.532 4.390 20 0 FIADRP Cc1ccc(C)c(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000513608516 1094243663 /nfs/dbraw/zinc/24/36/63/1094243663.db2.gz IUKYNSAOBBZLJB-WOJBJXKFSA-N 2 0 352.522 4.202 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CCO)C2CCCCC2)CC1 ZINC000513652665 1094255647 /nfs/dbraw/zinc/25/56/47/1094255647.db2.gz AZMJOLMIXBMMOG-XPPIMPSXSA-N 2 0 358.570 4.351 20 0 FIADRP COc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccc1OCc1ccccc1 ZINC000513661339 1094270213 /nfs/dbraw/zinc/27/02/13/1094270213.db2.gz OGBYSBURIBLRIW-UHFFFAOYSA-N 2 0 368.521 4.237 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)CC1 ZINC000236981285 1094329291 /nfs/dbraw/zinc/32/92/91/1094329291.db2.gz YFOOWHPNUOHIBT-QGZVFWFLSA-N 2 0 373.491 4.266 20 0 FIADRP C[C@@H]1C[C@@H](NC2CC[NH+](CC3CCC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168037270 1094361488 /nfs/dbraw/zinc/36/14/88/1094361488.db2.gz XHECMJQMRBQWGF-IRJINJETSA-N 2 0 369.597 4.282 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@H]2CCCc2ccccc2)CC1 ZINC000501024321 1094441518 /nfs/dbraw/zinc/44/15/18/1094441518.db2.gz PEZANWNVCGDRQG-DEOSSOPVSA-N 2 0 371.613 4.280 20 0 FIADRP Cc1c2ccccc2oc1[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)C(C)C ZINC000501049328 1094455933 /nfs/dbraw/zinc/45/59/33/1094455933.db2.gz BPLWJBDSYDGEMA-JOCHJYFZSA-N 2 0 371.569 4.444 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000474627888 1094460058 /nfs/dbraw/zinc/46/00/58/1094460058.db2.gz QUOJYRAKFFNBKO-UHFFFAOYSA-N 2 0 372.553 4.000 20 0 FIADRP CCOC(=O)C[C@@H]1CCC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168039986 1094482152 /nfs/dbraw/zinc/48/21/52/1094482152.db2.gz JJSUWNLTJYZJFD-SBHAEUEKSA-N 2 0 372.553 4.093 20 0 FIADRP CCOC(=O)C[C@H]1CCC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039985 1094482647 /nfs/dbraw/zinc/48/26/47/1094482647.db2.gz JJSUWNLTJYZJFD-NPDDRXJXSA-N 2 0 372.553 4.093 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccc(F)cc1 ZINC000474872250 1094806808 /nfs/dbraw/zinc/80/68/08/1094806808.db2.gz ZXLHTZBVMLDWDO-UHFFFAOYSA-N 2 0 366.484 4.141 20 0 FIADRP CC[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccc(OCc2cccs2)c(OC)c1 ZINC000420299106 1094869363 /nfs/dbraw/zinc/86/93/63/1094869363.db2.gz GHEIWIXHZRURSC-QGZVFWFLSA-N 2 0 374.550 4.157 20 0 FIADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000420300930 1094871519 /nfs/dbraw/zinc/87/15/19/1094871519.db2.gz ICMABOXKBOLKMY-QGZVFWFLSA-N 2 0 366.534 4.032 20 0 FIADRP Cc1nc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)oc1-c1ccc(Cl)cc1 ZINC000420341809 1094885414 /nfs/dbraw/zinc/88/54/14/1094885414.db2.gz WAWOHLXHDILCKY-GOSISDBHSA-N 2 0 359.901 4.267 20 0 FIADRP Cc1cc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000420330805 1094890981 /nfs/dbraw/zinc/89/09/81/1094890981.db2.gz CACUKDIABYKSOK-HXUWFJFHSA-N 2 0 370.928 4.069 20 0 FIADRP Cc1cc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000420330804 1094891402 /nfs/dbraw/zinc/89/14/02/1094891402.db2.gz CACUKDIABYKSOK-FQEVSTJZSA-N 2 0 370.928 4.069 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000420372341 1094903692 /nfs/dbraw/zinc/90/36/92/1094903692.db2.gz FEBKXAOJSVOOGB-IEBWSBKVSA-N 2 0 368.974 4.041 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420373857 1094904844 /nfs/dbraw/zinc/90/48/44/1094904844.db2.gz GWYSQXIJHQUSCL-UUWFMWQGSA-N 2 0 357.325 4.273 20 0 FIADRP NC[C@@H]([NH2+]CCOC(c1ccccc1)c1ccccc1)C1CCCCC1 ZINC000420381721 1094906096 /nfs/dbraw/zinc/90/60/96/1094906096.db2.gz ZHWICZUUOMRNKE-JOCHJYFZSA-N 2 0 352.522 4.290 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2c(F)cccc2F)CC1 ZINC000501787436 1094924389 /nfs/dbraw/zinc/92/43/89/1094924389.db2.gz XHZCRFNWUNBWTR-INIZCTEOSA-N 2 0 354.485 4.096 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000474923471 1094924531 /nfs/dbraw/zinc/92/45/31/1094924531.db2.gz GABBJTKOLCPADY-RMJJICAUSA-N 2 0 374.569 4.438 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2c(F)cccc2F)CC1 ZINC000501787437 1094924668 /nfs/dbraw/zinc/92/46/68/1094924668.db2.gz XHZCRFNWUNBWTR-MRXNPFEDSA-N 2 0 354.485 4.096 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000237107603 1094996835 /nfs/dbraw/zinc/99/68/35/1094996835.db2.gz GCZCNGUVGNFKFA-IAGOWNOFSA-N 2 0 358.448 4.228 20 0 FIADRP C[C@@H]1CC([NH+]2CCC(OC3CCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168046565 1095204125 /nfs/dbraw/zinc/20/41/25/1095204125.db2.gz OBZDRYGYSOZWJD-RTBURBONSA-N 2 0 356.554 4.462 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000502282638 1095304102 /nfs/dbraw/zinc/30/41/02/1095304102.db2.gz OJYBICSKGRBHDW-PKOBYXMFSA-N 2 0 362.558 4.045 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2cc(OC)c(OC)cc2C)c1 ZINC000502285434 1095309591 /nfs/dbraw/zinc/30/95/91/1095309591.db2.gz TZBIXBSUEDQDPF-SFHVURJKSA-N 2 0 370.537 4.185 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCCC34CCOCC4)c2)CC1 ZINC000502288223 1095311206 /nfs/dbraw/zinc/31/12/06/1095311206.db2.gz PPLODPNLQAJHPI-JOCHJYFZSA-N 2 0 356.554 4.357 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H](c3nnc[nH]3)C3CCCCC3)CC2)CC1 ZINC000330253426 1095437371 /nfs/dbraw/zinc/43/73/71/1095437371.db2.gz IVWQQQHMPQKVKI-MHJFOBGBSA-N 2 0 359.562 4.059 20 0 FIADRP C[C@H]1CC([N@H+]2C[C@H]3c4ccccc4C(=O)[C@H]3C2)C[C@H](C)N1Cc1ccccc1 ZINC001168048304 1095446900 /nfs/dbraw/zinc/44/69/00/1095446900.db2.gz VFTJWXUGZKUTJV-MQQADFIWSA-N 2 0 374.528 4.340 20 0 FIADRP Clc1cccc2c1OCCC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000421338854 1095533765 /nfs/dbraw/zinc/53/37/65/1095533765.db2.gz DVMGFICBENOMLI-LJQANCHMSA-N 2 0 357.885 4.207 20 0 FIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cnn1-c1cc(C)ccc1C ZINC000421876464 1095971683 /nfs/dbraw/zinc/97/16/83/1095971683.db2.gz KVSULJOANUAMNJ-KKXNLOMOSA-N 2 0 354.542 4.321 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2cc(F)c(OC)cc21 ZINC000467304488 1096182281 /nfs/dbraw/zinc/18/22/81/1096182281.db2.gz FSKIBAZXOGLLSJ-OAQYLSRUSA-N 2 0 356.485 4.453 20 0 FIADRP C[N@@H+](Cc1cc(-c2ccccc2)on1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000503190399 1096299939 /nfs/dbraw/zinc/29/99/39/1096299939.db2.gz AAVBCHNQWWDFAI-UHFFFAOYSA-N 2 0 362.477 4.085 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000414663883 1096376038 /nfs/dbraw/zinc/37/60/38/1096376038.db2.gz SEDVPKAIYSUEGC-OALUTQOASA-N 2 0 360.505 4.017 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1cnccc1N ZINC000422733561 1096465613 /nfs/dbraw/zinc/46/56/13/1096465613.db2.gz RDXZPDSHKWDGIE-QGZVFWFLSA-N 2 0 352.526 4.109 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422735377 1096468008 /nfs/dbraw/zinc/46/80/08/1096468008.db2.gz UPBVDRAGUMNLTP-DNVCBOLYSA-N 2 0 370.368 4.065 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1c2cc(Br)ccc2SC[C@H]1C ZINC000422740853 1096477539 /nfs/dbraw/zinc/47/75/39/1096477539.db2.gz NNWROMFIVJGDEA-HSMVNMDESA-N 2 0 357.361 4.339 20 0 FIADRP Cc1ccc(C[C@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c2ccccn2)cc1 ZINC000422742739 1096478287 /nfs/dbraw/zinc/47/82/87/1096478287.db2.gz HAFDMQWEJAXGSK-JPYJTQIMSA-N 2 0 360.505 4.187 20 0 FIADRP CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1Cl ZINC000422742652 1096478517 /nfs/dbraw/zinc/47/85/17/1096478517.db2.gz GSFIVHSZTLUIOF-BTYIYWSLSA-N 2 0 374.960 4.236 20 0 FIADRP CC(C)COc1ccccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422745010 1096479207 /nfs/dbraw/zinc/47/92/07/1096479207.db2.gz XAMQHATXHGSVHP-NFBKMPQASA-N 2 0 366.505 4.067 20 0 FIADRP c1ccc(SCCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422754628 1096483834 /nfs/dbraw/zinc/48/38/34/1096483834.db2.gz JPYDMGGJFUDWGO-TZIWHRDSSA-N 2 0 354.519 4.014 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000422766541 1096485455 /nfs/dbraw/zinc/48/54/55/1096485455.db2.gz RTRODTFAEAUVPM-SZVBFZGTSA-N 2 0 371.491 4.195 20 0 FIADRP Fc1ccc(SCCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422772000 1096487482 /nfs/dbraw/zinc/48/74/82/1096487482.db2.gz XSQACCBZEZVVKL-FPOVZHCZSA-N 2 0 372.509 4.153 20 0 FIADRP Fc1ccc(SCCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422772002 1096487903 /nfs/dbraw/zinc/48/79/03/1096487903.db2.gz XSQACCBZEZVVKL-TZIWHRDSSA-N 2 0 372.509 4.153 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784248 1096489792 /nfs/dbraw/zinc/48/97/92/1096489792.db2.gz PKCISXYXRLDGBO-REWPJTCUSA-N 2 0 350.506 4.330 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1OC ZINC000422781448 1096490423 /nfs/dbraw/zinc/49/04/23/1096490423.db2.gz KQBKOIGDLDABOZ-ZWOKBUDYSA-N 2 0 356.510 4.011 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C(C)C)cc1 ZINC000422786470 1096491152 /nfs/dbraw/zinc/49/11/52/1096491152.db2.gz OXPSXOMLTIQWRH-MZYLBHOOSA-N 2 0 366.505 4.238 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000422786571 1096491442 /nfs/dbraw/zinc/49/14/42/1096491442.db2.gz SPJYTJWPGSIQOZ-LBPRGKRZSA-N 2 0 368.308 4.275 20 0 FIADRP COc1cccc(-c2ccc(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)cc2)c1 ZINC000422793834 1096492450 /nfs/dbraw/zinc/49/24/50/1096492450.db2.gz SYINHLWZNGEVCO-INIZCTEOSA-N 2 0 361.489 4.375 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422807137 1096495760 /nfs/dbraw/zinc/49/57/60/1096495760.db2.gz OMACGXJWFKTIBW-DHUIEDIVSA-N 2 0 374.431 4.195 20 0 FIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)CCCC2)cc1 ZINC000422838328 1096502505 /nfs/dbraw/zinc/50/25/05/1096502505.db2.gz OEFCWPBFAPSKKT-PWRODBHTSA-N 2 0 374.594 4.147 20 0 FIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422840934 1096502589 /nfs/dbraw/zinc/50/25/89/1096502589.db2.gz CIOIEOLNEXVBLE-WFXMLNOXSA-N 2 0 370.493 4.208 20 0 FIADRP COc1cc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OCCC(C)C ZINC000422880390 1096510881 /nfs/dbraw/zinc/51/08/81/1096510881.db2.gz LTSHVJUSQUSHTN-MRXNPFEDSA-N 2 0 371.525 4.133 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000422879568 1096511405 /nfs/dbraw/zinc/51/14/05/1096511405.db2.gz MOZCNRSVMCZAIJ-CYFNAFFESA-N 2 0 360.860 4.386 20 0 FIADRP c1ccc(Sc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422891737 1096512240 /nfs/dbraw/zinc/51/22/40/1096512240.db2.gz WHQBWQPZMRKFKQ-NJDAHSKKSA-N 2 0 368.546 4.085 20 0 FIADRP CSc1cc(C)ccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422882269 1096512442 /nfs/dbraw/zinc/51/24/42/1096512442.db2.gz ZVJZEAUITYSYGW-GHTZIAJQSA-N 2 0 354.519 4.062 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422883987 1096512482 /nfs/dbraw/zinc/51/24/82/1096512482.db2.gz WDTYBXVIRFCHSV-QZTJIDSGSA-N 2 0 371.352 4.291 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cn(-c2ccccc2)nc1C(C)C ZINC000422874632 1096517914 /nfs/dbraw/zinc/51/79/14/1096517914.db2.gz NYKUEWLJTDBSHM-INIZCTEOSA-N 2 0 363.509 4.009 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000422900885 1096519083 /nfs/dbraw/zinc/51/90/83/1096519083.db2.gz KGCOVIXZNHIREX-OLZOCXBDSA-N 2 0 367.415 4.202 20 0 FIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911370 1096521135 /nfs/dbraw/zinc/52/11/35/1096521135.db2.gz KPUSVCHKBDTWAC-LPHOPBHVSA-N 2 0 357.567 4.281 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911233 1096522714 /nfs/dbraw/zinc/52/27/14/1096522714.db2.gz KKYSTLWMVXGMBE-CQSZACIVSA-N 2 0 358.555 4.246 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCN(c2nc3ccccc3s2)CC1 ZINC000422929957 1096527086 /nfs/dbraw/zinc/52/70/86/1096527086.db2.gz ANJCEJKLWZYNSZ-AEFFLSMTSA-N 2 0 372.582 4.166 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000422930942 1096527928 /nfs/dbraw/zinc/52/79/28/1096527928.db2.gz AEVYNPUCWOKBJL-FZKQIMNGSA-N 2 0 365.290 4.395 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1cccs1)c1ccc2c(c1)CCCC2 ZINC000422963408 1096533784 /nfs/dbraw/zinc/53/37/84/1096533784.db2.gz IMIFUKQMDMXHIC-PZJWPPBQSA-N 2 0 358.551 4.060 20 0 FIADRP Clc1ccc(CCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422950201 1096537133 /nfs/dbraw/zinc/53/71/33/1096537133.db2.gz XIKNQUFNEVPPAD-CTNGQTDRSA-N 2 0 356.897 4.118 20 0 FIADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(c3ccccc3Cl)CCOCC2)c2ccccc21 ZINC000422954947 1096539047 /nfs/dbraw/zinc/53/90/47/1096539047.db2.gz IPYGXLCKRHQLRB-VQTJNVASSA-N 2 0 356.897 4.123 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954625 1096539248 /nfs/dbraw/zinc/53/92/48/1096539248.db2.gz JKKFPFJPNGILLM-APPDUMDISA-N 2 0 350.293 4.494 20 0 FIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)OC(C)C ZINC000423047329 1096552705 /nfs/dbraw/zinc/55/27/05/1096552705.db2.gz GCYXKLXWKZRVBT-KHHDVDEJSA-N 2 0 360.542 4.062 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000423034229 1096556173 /nfs/dbraw/zinc/55/61/73/1096556173.db2.gz PPDUXJNMSKIYBD-VQIMIIECSA-N 2 0 367.320 4.426 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c2ccccc21 ZINC000423067612 1096563323 /nfs/dbraw/zinc/56/33/23/1096563323.db2.gz ZZLQIFPGBPQJBM-FSPWUOQZSA-N 2 0 361.411 4.019 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2cccc(F)c2o1 ZINC000423074851 1096564367 /nfs/dbraw/zinc/56/43/67/1096564367.db2.gz VSDXUXQRRJLTIQ-VELBRHGASA-N 2 0 366.436 4.478 20 0 FIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000423093231 1096571798 /nfs/dbraw/zinc/57/17/98/1096571798.db2.gz GQNYMIZQFNBVMG-MGBSGCIJSA-N 2 0 355.295 4.084 20 0 FIADRP Fc1cccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423094005 1096573015 /nfs/dbraw/zinc/57/30/15/1096573015.db2.gz IWKVEJDEHJQUDE-QXPQREGVSA-N 2 0 366.480 4.307 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423115406 1096576402 /nfs/dbraw/zinc/57/64/02/1096576402.db2.gz NFYKKZKXGFFJOD-YWMUFLPLSA-N 2 0 354.519 4.315 20 0 FIADRP CCc1nc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)ccc2n1C1CC1 ZINC000423116904 1096578094 /nfs/dbraw/zinc/57/80/94/1096578094.db2.gz RZTQGTVLSKMCAV-VAMGGRTRSA-N 2 0 366.553 4.334 20 0 FIADRP FC1(F)CCCC[C@H](C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423123845 1096580120 /nfs/dbraw/zinc/58/01/20/1096580120.db2.gz FITQCVDDDXFRKU-IEZWGBDMSA-N 2 0 350.453 4.048 20 0 FIADRP Clc1cccc([C@H]2C[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423105274 1096582625 /nfs/dbraw/zinc/58/26/25/1096582625.db2.gz YWELLODYQVRUMF-QWJIHBKKSA-N 2 0 368.908 4.432 20 0 FIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106547 1096582702 /nfs/dbraw/zinc/58/27/02/1096582702.db2.gz ZZOXYBCMXJEUHV-BPVRBSMNSA-N 2 0 366.480 4.307 20 0 FIADRP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423172909 1096603219 /nfs/dbraw/zinc/60/32/19/1096603219.db2.gz VXVHZQRNSJKUDA-WMIGDMCZSA-N 2 0 372.871 4.181 20 0 FIADRP CCOc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000414721076 1096607794 /nfs/dbraw/zinc/60/77/94/1096607794.db2.gz FJEMWPRQWIQLTP-HXUWFJFHSA-N 2 0 356.535 4.291 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@@H]1CCC[NH2+]C1 ZINC000423209410 1096608370 /nfs/dbraw/zinc/60/83/70/1096608370.db2.gz FFQDULLZEDMYJW-LXZKKBNFSA-N 2 0 359.514 4.304 20 0 FIADRP c1csc(CN(Cc2ccc(C3CC3)cc2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000414722441 1096616915 /nfs/dbraw/zinc/61/69/15/1096616915.db2.gz MHKZTWNRYYKUPV-LJQANCHMSA-N 2 0 353.535 4.165 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCC([NH3+])CC2)C(C)C)c(Br)c1 ZINC000423239037 1096618492 /nfs/dbraw/zinc/61/84/92/1096618492.db2.gz VWASVJNMQZZABY-QWQCLYJRSA-N 2 0 355.320 4.014 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423225452 1096622583 /nfs/dbraw/zinc/62/25/83/1096622583.db2.gz MVPRFFXTAKLJSG-QWRGUYRKSA-N 2 0 368.344 4.269 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423244559 1096628007 /nfs/dbraw/zinc/62/80/07/1096628007.db2.gz HSCCHTXCTGUPGC-QWRGUYRKSA-N 2 0 354.338 4.374 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccc(C(F)(F)F)c1 ZINC000423290085 1096636188 /nfs/dbraw/zinc/63/61/88/1096636188.db2.gz CIMPJJZPXHLTTE-ACJLOTCBSA-N 2 0 352.400 4.202 20 0 FIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1OC(F)F ZINC000423373634 1096652153 /nfs/dbraw/zinc/65/21/53/1096652153.db2.gz HWAYIZJHVQZCLU-NSHDSACASA-N 2 0 352.812 4.395 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423368984 1096658516 /nfs/dbraw/zinc/65/85/16/1096658516.db2.gz DQGPXNIFRILGFK-DEOSSOPVSA-N 2 0 358.485 4.372 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cccc(Br)c21 ZINC000423369508 1096658582 /nfs/dbraw/zinc/65/85/82/1096658582.db2.gz DYSFCENHFBQTID-KPZWWZAWSA-N 2 0 357.295 4.390 20 0 FIADRP C[C@@H]1C[C@H](N[C@@H](c2ccccc2)c2ccc(Br)cc2)CC[NH2+]1 ZINC000423387061 1096662825 /nfs/dbraw/zinc/66/28/25/1096662825.db2.gz SIIVUUVNWHAGQX-ZMYBRWDISA-N 2 0 359.311 4.269 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2Cl)CC[NH2+]CC1 ZINC000423396572 1096664994 /nfs/dbraw/zinc/66/49/94/1096664994.db2.gz RTYGZITZVHSVAG-LLVKDONJSA-N 2 0 365.732 4.314 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1Cl)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414739238 1096667991 /nfs/dbraw/zinc/66/79/91/1096667991.db2.gz PXUZRDQLVRJUMJ-KGLIPLIRSA-N 2 0 372.340 4.032 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(Br)cc1C(F)(F)F ZINC000423403259 1096672450 /nfs/dbraw/zinc/67/24/50/1096672450.db2.gz RYOBCOCJAQGUKX-BHDSKKPTSA-N 2 0 365.237 4.117 20 0 FIADRP COCC1(C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)CC[NH2+]CC1 ZINC000423413310 1096674980 /nfs/dbraw/zinc/67/49/80/1096674980.db2.gz YTLZPJLHAWDGJU-LBPRGKRZSA-N 2 0 363.354 4.038 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCSc3ccc(Br)cc32)C1 ZINC000423469720 1096692925 /nfs/dbraw/zinc/69/29/25/1096692925.db2.gz VPJYACFZKMDBGO-UXIGCNINSA-N 2 0 355.345 4.093 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCSc3ccc(Br)cc32)C1 ZINC000423469719 1096693082 /nfs/dbraw/zinc/69/30/82/1096693082.db2.gz VPJYACFZKMDBGO-NJZAAPMLSA-N 2 0 355.345 4.093 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000423480904 1096698260 /nfs/dbraw/zinc/69/82/60/1096698260.db2.gz WGCBTYMCNYDSCM-JJRVBVJISA-N 2 0 359.514 4.434 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000423508626 1096702120 /nfs/dbraw/zinc/70/21/20/1096702120.db2.gz NUKXLGXCINBGPS-ZMYBRWDISA-N 2 0 359.311 4.256 20 0 FIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000423509960 1096703026 /nfs/dbraw/zinc/70/30/26/1096703026.db2.gz RTGFKLOPWBBAKF-HNAYVOBHSA-N 2 0 351.494 4.047 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000423482049 1096703184 /nfs/dbraw/zinc/70/31/84/1096703184.db2.gz XONFIEMTHBGHFO-DOAHWQAKSA-N 2 0 370.512 4.309 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423511697 1096710114 /nfs/dbraw/zinc/71/01/14/1096710114.db2.gz NYFFTAXPPZNEEA-KXTRFFEISA-N 3 0 365.565 4.499 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423536850 1096715696 /nfs/dbraw/zinc/71/56/96/1096715696.db2.gz IHHCVIFELWRMBP-HXUWFJFHSA-N 2 0 358.432 4.277 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)C2)cc1 ZINC000423541747 1096716545 /nfs/dbraw/zinc/71/65/45/1096716545.db2.gz LRWDPOOLWAKQTB-NLPXPOPTSA-N 2 0 352.444 4.319 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423541366 1096716673 /nfs/dbraw/zinc/71/66/73/1096716673.db2.gz KRFHSQUIUBWGHC-LCGIIJARSA-N 2 0 358.473 4.380 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423540320 1096716843 /nfs/dbraw/zinc/71/68/43/1096716843.db2.gz JRGIRQRHDHCCJI-NCXUSEDFSA-N 2 0 367.562 4.474 20 0 FIADRP CC(C)N(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(C)C ZINC000515518348 1098656872 /nfs/dbraw/zinc/65/68/72/1098656872.db2.gz GBVMETATKKGWLA-WOJBJXKFSA-N 2 0 373.585 4.042 20 0 FIADRP CCC1(C[NH2+]Cc2ccc(COC)o2)CC[NH+](Cc2ccccc2)CC1 ZINC000533125367 1098790081 /nfs/dbraw/zinc/79/00/81/1098790081.db2.gz DGUNFMATUPOHEG-UHFFFAOYSA-N 2 0 356.510 4.208 20 0 FIADRP CCC1(C[NH2+]Cc2cn3ccccc3n2)CC[NH+](Cc2ccccc2)CC1 ZINC000533125716 1098807716 /nfs/dbraw/zinc/80/77/16/1098807716.db2.gz ZLINUFSMFOQNDJ-UHFFFAOYSA-N 2 0 362.521 4.116 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc3ccccc32)CC1 ZINC000533243842 1098901145 /nfs/dbraw/zinc/90/11/45/1098901145.db2.gz HNDILNFQHFLRSN-SFHVURJKSA-N 2 0 367.537 4.221 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@H](C)C1 ZINC000436302388 1098915488 /nfs/dbraw/zinc/91/54/88/1098915488.db2.gz UEADMBQOXNCXAC-KRZXBLKESA-N 2 0 364.961 4.313 20 0 FIADRP Cc1csc([C@@H](C)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000248744168 1099409131 /nfs/dbraw/zinc/40/91/31/1099409131.db2.gz ANYYVFYLBKDTOO-QLIIJSOBSA-N 2 0 355.551 4.340 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)CC1 ZINC000516501594 1099549183 /nfs/dbraw/zinc/54/91/83/1099549183.db2.gz ZGFJLLWGXCXYJO-QFIPXVFZSA-N 2 0 356.485 4.245 20 0 FIADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000414898251 1099596334 /nfs/dbraw/zinc/59/63/34/1099596334.db2.gz SNIANOYWUHPLNF-LBPRGKRZSA-N 2 0 366.292 4.073 20 0 FIADRP CC(C)N(C)c1ccccc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437096502 1099598947 /nfs/dbraw/zinc/59/89/47/1099598947.db2.gz MKHZMAQXAJYWDP-LJQANCHMSA-N 2 0 369.553 4.322 20 0 FIADRP C[C@]1([NH3+])CCCC[C@@H]1c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000261891738 1099673918 /nfs/dbraw/zinc/67/39/18/1099673918.db2.gz XNVZSNAXDMJZJD-NQIIRXRSSA-N 2 0 354.498 4.098 20 0 FIADRP C[NH2+]CCC1CC[NH+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000262024074 1099688206 /nfs/dbraw/zinc/68/82/06/1099688206.db2.gz YZEBZKUMJVCJMX-GOSISDBHSA-N 2 0 365.521 4.321 20 0 FIADRP Cc1ccc([C@H]([NH3+])C(=O)Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000262629021 1099725940 /nfs/dbraw/zinc/72/59/40/1099725940.db2.gz GPUSRTCGZZSDQK-UWJYYQICSA-N 2 0 351.494 4.008 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2ccsc2S1 ZINC000162501907 1099811755 /nfs/dbraw/zinc/81/17/55/1099811755.db2.gz FALPOVLVXRDNJJ-KSSFIOAISA-N 2 0 362.564 4.404 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2cccnc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508700782 1099854611 /nfs/dbraw/zinc/85/46/11/1099854611.db2.gz RJNFXKMFCMUMDV-CVDCTZTESA-N 2 0 359.517 4.278 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714329 1099883752 /nfs/dbraw/zinc/88/37/52/1099883752.db2.gz GZLDRXFFPUILJB-HBFSDRIKSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@H]([NH2+][C@H](CCCO)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508713914 1099885836 /nfs/dbraw/zinc/88/58/36/1099885836.db2.gz GOOBVPBIKZZVJD-AJSBUHFISA-N 2 0 352.522 4.000 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709972 1099898440 /nfs/dbraw/zinc/89/84/40/1099898440.db2.gz KNQCSAZHQMXPGQ-QESAQDPVSA-N 2 0 358.570 4.328 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000414905212 1099916511 /nfs/dbraw/zinc/91/65/11/1099916511.db2.gz NRAYQNGPFORLED-UHFFFAOYSA-N 2 0 368.912 4.080 20 0 FIADRP C[C@H]([NH2+]CCCCOc1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721373 1099937045 /nfs/dbraw/zinc/93/70/45/1099937045.db2.gz PGLIQDTZLOHXOY-FPOVZHCZSA-N 2 0 370.512 4.485 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC[C@H]2CCC[NH2+]2)c(-c2ccccc2Cl)n1 ZINC000414906189 1099944332 /nfs/dbraw/zinc/94/43/32/1099944332.db2.gz OZSPDYPXUTVUSH-MRXNPFEDSA-N 2 0 360.933 4.190 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000437489248 1099951848 /nfs/dbraw/zinc/95/18/48/1099951848.db2.gz ZAJMXQZISZICCC-OAQYLSRUSA-N 2 0 373.585 4.012 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000508772195 1100051423 /nfs/dbraw/zinc/05/14/23/1100051423.db2.gz BQFJXVFLIZQWGE-UHFFFAOYSA-N 2 0 359.539 4.380 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+]Cc1cnc(C2CC2)nc1 ZINC000459390933 1100068085 /nfs/dbraw/zinc/06/80/85/1100068085.db2.gz QQBBDSKXSSCCAT-UHFFFAOYSA-N 2 0 350.510 4.020 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccccc1-c1ccnn1C ZINC000509698602 1100070219 /nfs/dbraw/zinc/07/02/19/1100070219.db2.gz PGXDRAVRVOULNI-UHFFFAOYSA-N 2 0 362.521 4.219 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(OCC2CC2)c(F)c1 ZINC000459446329 1100181852 /nfs/dbraw/zinc/18/18/52/1100181852.db2.gz PMHUDDVQUBMLLJ-MRXNPFEDSA-N 2 0 369.484 4.329 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cnccc2C)CC1 ZINC000536775414 1100298108 /nfs/dbraw/zinc/29/81/08/1100298108.db2.gz IJSRHGRYZFTWJE-ROUUACIJSA-N 2 0 370.516 4.083 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2Cl)[C@H](C)C1 ZINC000536875002 1100397167 /nfs/dbraw/zinc/39/71/67/1100397167.db2.gz GPVBCVYDKCMWIM-CRAIPNDOSA-N 2 0 373.368 4.263 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]C/C=C\c3ccccc3)cc2)C[C@H](C)O1 ZINC000517538995 1100460183 /nfs/dbraw/zinc/46/01/83/1100460183.db2.gz VWIZDOLSTSJFHP-HMVHIAHLSA-N 2 0 350.506 4.099 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000517547067 1100488997 /nfs/dbraw/zinc/48/89/97/1100488997.db2.gz FJVKQNOFHHSYPB-HXUWFJFHSA-N 2 0 362.521 4.236 20 0 FIADRP CCCC[NH+]1CCC([NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000517549892 1100492543 /nfs/dbraw/zinc/49/25/43/1100492543.db2.gz AEANTLTZBSAYSZ-UHFFFAOYSA-N 2 0 362.521 4.380 20 0 FIADRP Cc1cccc(C[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000506207591 1100597571 /nfs/dbraw/zinc/59/75/71/1100597571.db2.gz RPTBQIWYRCDXJS-UHFFFAOYSA-N 2 0 351.538 4.157 20 0 FIADRP Cc1cc(C)c(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1C ZINC000517714105 1100625640 /nfs/dbraw/zinc/62/56/40/1100625640.db2.gz YMHNRRWPQYLJGX-UHFFFAOYSA-N 2 0 352.522 4.376 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414946992 1100903936 /nfs/dbraw/zinc/90/39/36/1100903936.db2.gz KFAHSURLPVIFRG-QUCCMNQESA-N 2 0 360.505 4.078 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000414951628 1100911758 /nfs/dbraw/zinc/91/17/58/1100911758.db2.gz HUVQUJOUDSRMQE-BEFAXECRSA-N 2 0 374.912 4.015 20 0 FIADRP Cc1cnn(-c2cc[nH+]cc2N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000518236811 1101035359 /nfs/dbraw/zinc/03/53/59/1101035359.db2.gz ZSYDPMBQPJPBAP-UYAOXDASSA-N 2 0 361.493 4.041 20 0 FIADRP FC(F)(F)c1cc(Br)cc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000414981513 1101163221 /nfs/dbraw/zinc/16/32/21/1101163221.db2.gz XXDWVHDJTQNTCO-CQSZACIVSA-N 2 0 365.237 4.090 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccccc2Br)CCC1 ZINC000426327993 1101281676 /nfs/dbraw/zinc/28/16/76/1101281676.db2.gz WQRFKOFZJQXRDI-VKJFTORMSA-N 2 0 365.359 4.189 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000459724184 1101345649 /nfs/dbraw/zinc/34/56/49/1101345649.db2.gz AIMFSMCNOYNHKS-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP CCc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)C(C)C)cc1 ZINC000537014155 1101396826 /nfs/dbraw/zinc/39/68/26/1101396826.db2.gz DGNCTQYVACPODD-RJGXRXQPSA-N 2 0 358.570 4.304 20 0 FIADRP CCc1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)s1 ZINC000537173611 1101518859 /nfs/dbraw/zinc/51/88/59/1101518859.db2.gz AQGSJPXQPUHEQI-LJQANCHMSA-N 2 0 356.535 4.388 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000518760768 1101532832 /nfs/dbraw/zinc/53/28/32/1101532832.db2.gz XHUKDOBIPBGHGX-JOCHJYFZSA-N 2 0 352.522 4.396 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000178741894 1101533529 /nfs/dbraw/zinc/53/35/29/1101533529.db2.gz DYCZZVBJDXGRJB-XMSQKQJNSA-N 2 0 365.521 4.337 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000178741883 1101533804 /nfs/dbraw/zinc/53/38/04/1101533804.db2.gz DYCZZVBJDXGRJB-PGRDOPGGSA-N 2 0 365.521 4.337 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2cccc(F)c2)CC1 ZINC001168168178 1101818460 /nfs/dbraw/zinc/81/84/60/1101818460.db2.gz PMWWVLORDRMGOK-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP Fc1ccc(C2([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)cc1 ZINC000643467814 1102182835 /nfs/dbraw/zinc/18/28/35/1102182835.db2.gz UANDURNAVOHFBR-FPOVZHCZSA-N 2 0 352.453 4.050 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)CCN1Cc1ccccc1 ZINC000415062074 1102272104 /nfs/dbraw/zinc/27/21/04/1102272104.db2.gz ZNXKLBFGBYEXTJ-UEVCKROQSA-N 2 0 351.538 4.109 20 0 FIADRP C[NH+](C)C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000550796789 1102326337 /nfs/dbraw/zinc/32/63/37/1102326337.db2.gz AWLORWWHQVORBF-BHIFYINESA-N 2 0 371.956 4.368 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(CO)c1 ZINC000121698462 1102439752 /nfs/dbraw/zinc/43/97/52/1102439752.db2.gz KGAMSQXMLXWOJN-LJQANCHMSA-N 2 0 352.522 4.262 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c(C)s1 ZINC000532497829 1102440022 /nfs/dbraw/zinc/44/00/22/1102440022.db2.gz UTWODYXGGTULQY-LAUBAEHRSA-N 2 0 357.567 4.004 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000532524398 1102443241 /nfs/dbraw/zinc/44/32/41/1102443241.db2.gz FSFSHFVWLILMJS-VKJFTORMSA-N 2 0 354.460 4.445 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2nc3cc(C(F)(F)F)ccc3o2)CC1 ZINC000121838388 1102482815 /nfs/dbraw/zinc/48/28/15/1102482815.db2.gz WRQYHABTQVVPMA-UHFFFAOYSA-N 2 0 355.404 4.010 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccsc2C)CC1 ZINC000550121861 1102547669 /nfs/dbraw/zinc/54/76/69/1102547669.db2.gz ADGOQJQYFUQFAQ-OAHLLOKOSA-N 2 0 361.530 4.188 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1F ZINC000122318608 1102566196 /nfs/dbraw/zinc/56/61/96/1102566196.db2.gz BVXIPTJZTUVOES-HNNXBMFYSA-N 2 0 362.514 4.339 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[C@H]1C ZINC000550882055 1102653076 /nfs/dbraw/zinc/65/30/76/1102653076.db2.gz HPYKZMUOLWBWHY-SKWRMQMOSA-N 2 0 370.581 4.330 20 0 FIADRP CN(C)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1cccs1 ZINC000550886562 1102658156 /nfs/dbraw/zinc/65/81/56/1102658156.db2.gz HVBAGCFEZMYCQP-CBNMVNINSA-N 2 0 371.594 4.384 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC001168252613 1102659922 /nfs/dbraw/zinc/65/99/22/1102659922.db2.gz PMPSHFJTZNVPLJ-OAQYLSRUSA-N 2 0 364.961 4.398 20 0 FIADRP C[C@@H](O)CCC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000550897447 1102671980 /nfs/dbraw/zinc/67/19/80/1102671980.db2.gz DNXCSHNLVGSMPV-NQIIRXRSSA-N 2 0 350.522 4.130 20 0 FIADRP Fc1ccccc1-c1n[nH]cc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000537651127 1102711090 /nfs/dbraw/zinc/71/10/90/1102711090.db2.gz XDMBONHDQAJRBM-UHFFFAOYSA-N 2 0 370.516 4.304 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000280782119 1102718060 /nfs/dbraw/zinc/71/80/60/1102718060.db2.gz GWBFJZFPQXERNO-JOCHJYFZSA-N 2 0 353.510 4.043 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953522 1102748008 /nfs/dbraw/zinc/74/80/08/1102748008.db2.gz AQHPLJAIBCBJQY-QFIPXVFZSA-N 2 0 372.516 4.079 20 0 FIADRP CCCC(=O)Nc1ccc(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007036 1102759167 /nfs/dbraw/zinc/75/91/67/1102759167.db2.gz CJCMUSGMYRALRJ-FGZHOGPDSA-N 2 0 365.521 4.350 20 0 FIADRP FC(F)(F)c1ccc(-c2nc(C[NH2+][C@H]3CC34CC[NH2+]CC4)cs2)cc1 ZINC000666954018 1102759949 /nfs/dbraw/zinc/75/99/49/1102759949.db2.gz NTRWQXHNUUTGPT-HNNXBMFYSA-N 2 0 367.440 4.061 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccsc1 ZINC000187911253 1102779881 /nfs/dbraw/zinc/77/98/81/1102779881.db2.gz TWULWQJTIDCKCS-NHCUHLMSSA-N 2 0 358.551 4.336 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCCC23CCCC3)CC1 ZINC000551062935 1102879815 /nfs/dbraw/zinc/87/98/15/1102879815.db2.gz FZHINYINLHJCAF-QFIPXVFZSA-N 2 0 356.554 4.236 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1OCC ZINC000459361126 1102916285 /nfs/dbraw/zinc/91/62/85/1102916285.db2.gz FRMBZGVRMAAGEP-QGZVFWFLSA-N 2 0 369.509 4.199 20 0 FIADRP CCO[C@@H]1C[C@H](NC2CC[NH+](CC(C)C)CC2)[C@H]1Sc1ccccc1 ZINC000459362764 1102919464 /nfs/dbraw/zinc/91/94/64/1102919464.db2.gz HALFGYSBILHQOJ-PWRODBHTSA-N 2 0 362.583 4.035 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000551176113 1102948169 /nfs/dbraw/zinc/94/81/69/1102948169.db2.gz UOJALELOZIIAHO-MKWLTTDUSA-N 2 0 351.538 4.103 20 0 FIADRP C[C@H](C(=O)N(C)c1ccccc1)[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000476985656 1103004927 /nfs/dbraw/zinc/00/49/27/1103004927.db2.gz OJTFPMZTAADFNR-WOJBJXKFSA-N 2 0 371.569 4.014 20 0 FIADRP CC[C@H](Cc1ccc(Br)cc1)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001203214045 1103256007 /nfs/dbraw/zinc/25/60/07/1103256007.db2.gz BBZBVTZYTLUCDO-SJORKVTESA-N 2 0 353.348 4.233 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000551534845 1103336943 /nfs/dbraw/zinc/33/69/43/1103336943.db2.gz RJBBYEMJELHWRP-MRXNPFEDSA-N 2 0 368.949 4.279 20 0 FIADRP Fc1cccc(COc2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)cc2)c1 ZINC000666998553 1103370938 /nfs/dbraw/zinc/37/09/38/1103370938.db2.gz ZYPYMILLTVPRAK-FQEVSTJZSA-N 2 0 354.469 4.169 20 0 FIADRP C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551574821 1103384526 /nfs/dbraw/zinc/38/45/26/1103384526.db2.gz RXMWAXSTFWIOJO-OAHLLOKOSA-N 2 0 358.448 4.370 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507444083 1103391949 /nfs/dbraw/zinc/39/19/49/1103391949.db2.gz OGAYKWRUJOFPSA-QFIPXVFZSA-N 2 0 370.512 4.440 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cnn1-c1cccc(Cl)c1 ZINC000507476550 1103421956 /nfs/dbraw/zinc/42/19/56/1103421956.db2.gz JVPCJZVTDLBAML-HNNXBMFYSA-N 2 0 360.933 4.217 20 0 FIADRP COc1ccc(C2([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)CC2)cc1 ZINC000507519398 1103443535 /nfs/dbraw/zinc/44/35/35/1103443535.db2.gz IEXYWXKDJFBEKV-AJSBUHFISA-N 2 0 362.517 4.185 20 0 FIADRP FC(F)(F)c1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)nc1 ZINC000551702886 1103530289 /nfs/dbraw/zinc/53/02/89/1103530289.db2.gz XZMUPCGXTHSYGX-UHFFFAOYSA-N 2 0 355.448 4.188 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)CCS2 ZINC000427542103 1103637167 /nfs/dbraw/zinc/63/71/67/1103637167.db2.gz VBSVYMCDFFWFOV-WSTZPKSXSA-N 2 0 362.583 4.319 20 0 FIADRP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1)C1CCCCC1 ZINC000519698809 1103786790 /nfs/dbraw/zinc/78/67/90/1103786790.db2.gz VTQWGJHQORXBEJ-BHIFYINESA-N 2 0 369.553 4.216 20 0 FIADRP COc1ccccc1CC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167988576 1103944995 /nfs/dbraw/zinc/94/49/95/1103944995.db2.gz QSZGXUFUXURYCU-AIZNXBIQSA-N 2 0 368.565 4.355 20 0 FIADRP COc1ccc(C)cc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537843732 1103965095 /nfs/dbraw/zinc/96/50/95/1103965095.db2.gz VNFGJEVYPYXASG-UHFFFAOYSA-N 2 0 353.510 4.137 20 0 FIADRP COc1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000537840942 1103965162 /nfs/dbraw/zinc/96/51/62/1103965162.db2.gz HPADUAUFZNXRNQ-UHFFFAOYSA-N 2 0 373.928 4.482 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000520045227 1104050945 /nfs/dbraw/zinc/05/09/45/1104050945.db2.gz LIHGIEDPIRBXKY-MRXNPFEDSA-N 2 0 374.504 4.299 20 0 FIADRP CCC[C@@H](C[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000538305271 1104125229 /nfs/dbraw/zinc/12/52/29/1104125229.db2.gz QZQDDNIQJDKYDF-QFIPXVFZSA-N 2 0 357.586 4.061 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cccc4c3OCO4)cc2)C1 ZINC000520205082 1104170695 /nfs/dbraw/zinc/17/06/95/1104170695.db2.gz SGDOYEYKKLBZGE-QZTJIDSGSA-N 2 0 366.505 4.183 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@@H]2CCCN(C)[C@@H]2c2cccs2)c1 ZINC000164939153 1104225195 /nfs/dbraw/zinc/22/51/95/1104225195.db2.gz ASWNEWYGHYDTCT-XERREHJYSA-N 2 0 371.550 4.440 20 0 FIADRP FC(F)(F)c1ccccc1OCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441413464 1104339500 /nfs/dbraw/zinc/33/95/00/1104339500.db2.gz XOLSBLCUIFUXEX-CRAIPNDOSA-N 2 0 368.443 4.033 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441404534 1104345415 /nfs/dbraw/zinc/34/54/15/1104345415.db2.gz SWRMFXUHNWBXTA-LPHOPBHVSA-N 2 0 368.443 4.076 20 0 FIADRP c1ccc(CO[C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167994250 1104491681 /nfs/dbraw/zinc/49/16/81/1104491681.db2.gz AGJCTDIGVFLTJB-KORDQABASA-N 2 0 354.538 4.073 20 0 FIADRP Cc1ccc(OC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995738 1104557981 /nfs/dbraw/zinc/55/79/81/1104557981.db2.gz PHCULLGRXSSXPT-WCRBZPEASA-N 2 0 354.538 4.244 20 0 FIADRP CC(=O)C1(c2ccccc2)CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167995888 1104579190 /nfs/dbraw/zinc/57/91/90/1104579190.db2.gz UOWXFHCBHQMGTE-AIZNXBIQSA-N 2 0 366.549 4.015 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C[C@H](C)O1 ZINC000579545946 1105075240 /nfs/dbraw/zinc/07/52/40/1105075240.db2.gz KJYMRRHKUYUDRM-NFVALVNTSA-N 2 0 356.554 4.223 20 0 FIADRP CC[C@H]1C[C@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCO1 ZINC000507792830 1105093912 /nfs/dbraw/zinc/09/39/12/1105093912.db2.gz GAXXTPCLVXJCIS-YADHBBJMSA-N 2 0 356.554 4.180 20 0 FIADRP C[C@@H]1CC([N@H+](CCC[NH3+])C2CCCCC2)C[C@@H](C)N1Cc1ccccc1 ZINC001168008004 1105151399 /nfs/dbraw/zinc/15/13/99/1105151399.db2.gz CBOQXHDJVIYEQE-WOJBJXKFSA-N 2 0 357.586 4.412 20 0 FIADRP COc1ccc(OCC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001168009940 1105229266 /nfs/dbraw/zinc/22/92/66/1105229266.db2.gz IPWLDQXXUOPEBQ-RTBURBONSA-N 2 0 368.521 4.105 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427670399 1105238730 /nfs/dbraw/zinc/23/87/30/1105238730.db2.gz DXOWZCVLJYMPSN-YJBOKZPZSA-N 2 0 369.475 4.435 20 0 FIADRP C[N@H+](CCC[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)C1CCCCC1 ZINC000507920888 1105266788 /nfs/dbraw/zinc/26/67/88/1105266788.db2.gz VGSUIHLBCVBTHL-UHFFFAOYSA-N 2 0 352.563 4.131 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000507934434 1105270396 /nfs/dbraw/zinc/27/03/96/1105270396.db2.gz HCWHQACTFNVKCC-UVHRUJRTSA-N 2 0 366.590 4.235 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000325083619 1106789710 /nfs/dbraw/zinc/78/97/10/1106789710.db2.gz JORGGTIYBQWPCH-UXHICEINSA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)Cc1ccccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530210043 1106913624 /nfs/dbraw/zinc/91/36/24/1106913624.db2.gz KSNFGINOIGCUNC-FYYLOGMGSA-N 2 0 350.506 4.231 20 0 FIADRP CC(=O)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000451067700 1106918699 /nfs/dbraw/zinc/91/86/99/1106918699.db2.gz PDRYQPSDMBBORM-UHFFFAOYSA-N 2 0 362.517 4.377 20 0 FIADRP C[C@H]([NH2+][C@H]1c2cc(Br)ccc2SC[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000643454978 1106959948 /nfs/dbraw/zinc/95/99/48/1106959948.db2.gz JRRRKPVTUFLIFD-IPJQOSJUSA-N 2 0 369.372 4.210 20 0 FIADRP CCc1c(C)[nH+]c2ccccc2c1N1CCC(OCC[NH+]2CCCC2)CC1 ZINC000302033527 1107266323 /nfs/dbraw/zinc/26/63/23/1107266323.db2.gz LBQHIMIDNPLFQS-UHFFFAOYSA-N 2 0 367.537 4.187 20 0 FIADRP Cc1cccc2ncc(C[NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)n21 ZINC000530904051 1107389406 /nfs/dbraw/zinc/38/94/06/1107389406.db2.gz YDIOZFGKZJOARM-UHFFFAOYSA-N 2 0 374.488 4.158 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](C[C@@H](C)Cc2ccc(OC)c(F)c2)CC1 ZINC000469898922 1107687891 /nfs/dbraw/zinc/68/78/91/1107687891.db2.gz RMFHRFCLFGXKBN-KRWDZBQOSA-N 2 0 350.522 4.067 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Br)cc1 ZINC000314784928 1107734261 /nfs/dbraw/zinc/73/42/61/1107734261.db2.gz KSAHRNHHDHSPAE-CQSZACIVSA-N 2 0 360.299 4.164 20 0 FIADRP Clc1ccccc1OC[C@H]1CCC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000444610662 1108017954 /nfs/dbraw/zinc/01/79/54/1108017954.db2.gz DLODYRWKPWQBQX-SFHVURJKSA-N 2 0 350.934 4.307 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3c2cccc3Cl)CC1 ZINC000531737521 1108106999 /nfs/dbraw/zinc/10/69/99/1108106999.db2.gz APMLVGSMVWJJAP-QFIPXVFZSA-N 2 0 370.924 4.074 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccsc1 ZINC000453066177 1108119110 /nfs/dbraw/zinc/11/91/10/1108119110.db2.gz QRTJJUKNQXQTIF-NRFANRHFSA-N 2 0 357.567 4.127 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)cs1 ZINC000453071151 1108122789 /nfs/dbraw/zinc/12/27/89/1108122789.db2.gz CVARKYKNBJJPMX-PWRODBHTSA-N 2 0 355.551 4.027 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000453083259 1108153910 /nfs/dbraw/zinc/15/39/10/1108153910.db2.gz HXYLCOWNSXTNRO-GOSISDBHSA-N 2 0 357.567 4.356 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CCO1 ZINC000453138506 1108214311 /nfs/dbraw/zinc/21/43/11/1108214311.db2.gz AFVIVGRUHJIDJM-LILXYRQWSA-N 2 0 356.554 4.223 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H](C)c2ncc(-c3ccccc3)n2C)C1 ZINC000453178832 1108222098 /nfs/dbraw/zinc/22/20/98/1108222098.db2.gz TWKVYAPCONHUGX-OALUTQOASA-N 2 0 354.542 4.106 20 0 FIADRP c1[nH]c2ncccc2c1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453169888 1108244280 /nfs/dbraw/zinc/24/42/80/1108244280.db2.gz KRMCEKXEQBNLFW-XPWALMASSA-N 2 0 374.532 4.138 20 0 FIADRP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000453311747 1108398513 /nfs/dbraw/zinc/39/85/13/1108398513.db2.gz BIZASZCWHMPEGP-CCSDVLNMSA-N 2 0 356.554 4.223 20 0 FIADRP CO[C@@](C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000453319420 1108407484 /nfs/dbraw/zinc/40/74/84/1108407484.db2.gz KUDADVQDLHAFNJ-KIHHCIJBSA-N 2 0 364.533 4.333 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000531936103 1108409758 /nfs/dbraw/zinc/40/97/58/1108409758.db2.gz CMRLWPBPUARYKA-OALUTQOASA-N 2 0 354.542 4.486 20 0 FIADRP CCCCc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000531941716 1108420930 /nfs/dbraw/zinc/42/09/30/1108420930.db2.gz QZBFKWXWAOJFJE-LJQANCHMSA-N 2 0 366.553 4.027 20 0 FIADRP CC(=O)Nc1ccc(CN2CCC([NH2+]C3[C@H](C)CCC[C@H]3C)CC2)cc1 ZINC000453332054 1108421433 /nfs/dbraw/zinc/42/14/33/1108421433.db2.gz UUYXTEFGDLGXMF-IAGOWNOFSA-N 2 0 357.542 4.024 20 0 FIADRP CC(=O)Nc1ccc(CN2CCC([NH2+][C@H]3[C@H](C)CCC[C@@H]3C)CC2)cc1 ZINC000453332060 1108422306 /nfs/dbraw/zinc/42/23/06/1108422306.db2.gz UUYXTEFGDLGXMF-YPGOJHLTSA-N 2 0 357.542 4.024 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531957886 1108447025 /nfs/dbraw/zinc/44/70/25/1108447025.db2.gz JMSKWYJDCNFTFG-GCJKJVERSA-N 2 0 369.578 4.048 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CCC2 ZINC000531960474 1108451053 /nfs/dbraw/zinc/45/10/53/1108451053.db2.gz POYMBLGTAPHQCR-QHCPKHFHSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453375620 1108493890 /nfs/dbraw/zinc/49/38/90/1108493890.db2.gz XYUFOVXBZZLOOD-JSITXCQRSA-N 2 0 357.325 4.364 20 0 FIADRP C[N@H+](CCCC[NH2+]C1CC(c2ccc(Br)cc2)C1)C1CC1 ZINC000453399767 1108501662 /nfs/dbraw/zinc/50/16/62/1108501662.db2.gz LIKSUVNKMBWFFB-UHFFFAOYSA-N 2 0 351.332 4.159 20 0 FIADRP c1snnc1C[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453594029 1108650195 /nfs/dbraw/zinc/65/01/95/1108650195.db2.gz DMCSOYRROJLKTG-OAQYLSRUSA-N 2 0 370.566 4.195 20 0 FIADRP c1nc(C[N@H+]2CCCCC[C@H]2C2CC[NH+](Cc3ccccc3)CC2)co1 ZINC000453593223 1108650362 /nfs/dbraw/zinc/65/03/62/1108650362.db2.gz BNPGVGRMVLELMR-QFIPXVFZSA-N 2 0 353.510 4.331 20 0 FIADRP Cn1cncc1C[N@@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453600685 1108651175 /nfs/dbraw/zinc/65/11/75/1108651175.db2.gz RTFNDASFCZNFOD-HSZRJFAPSA-N 2 0 366.553 4.077 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)nc1 ZINC000532139945 1108684620 /nfs/dbraw/zinc/68/46/20/1108684620.db2.gz VTJGVOSJRZQTIC-UHFFFAOYSA-N 2 0 351.538 4.215 20 0 FIADRP COc1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c(OC(F)F)c1 ZINC000524457898 1109020943 /nfs/dbraw/zinc/02/09/43/1109020943.db2.gz LAYFRJZDLLSBAO-HOTGVXAUSA-N 2 0 370.484 4.144 20 0 FIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC000524968679 1109223662 /nfs/dbraw/zinc/22/36/62/1109223662.db2.gz PUAUIWUPDXMWSO-IAGOWNOFSA-N 2 0 374.500 4.373 20 0 FIADRP C[C@H](C[NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000446886312 1109382518 /nfs/dbraw/zinc/38/25/18/1109382518.db2.gz YMTGDPIPRWQWRF-CQSZACIVSA-N 2 0 351.332 4.017 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000367373269 1109482997 /nfs/dbraw/zinc/48/29/97/1109482997.db2.gz BFYRZWKWNZBQGX-HNNXBMFYSA-N 2 0 360.448 4.289 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccsc1 ZINC000447546302 1109575223 /nfs/dbraw/zinc/57/52/23/1109575223.db2.gz USWDOJDHIOLLCA-KJJMTIBFSA-N 2 0 369.578 4.136 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1Br ZINC000447570673 1109577607 /nfs/dbraw/zinc/57/76/07/1109577607.db2.gz HDPLQRKYKSXFOX-SFHVURJKSA-N 2 0 351.332 4.364 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C[C@H](C)c3ccccc3)CC2)cc1 ZINC000447818247 1109647173 /nfs/dbraw/zinc/64/71/73/1109647173.db2.gz VYUGQPFVDUNIIE-IBGZPJMESA-N 2 0 352.522 4.301 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2cc(F)c(Cl)cc21 ZINC000527856280 1109839784 /nfs/dbraw/zinc/83/97/84/1109839784.db2.gz PXRQIOOGLNXSRI-IBGZPJMESA-N 2 0 362.876 4.197 20 0 FIADRP Cc1cccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C(C)C)c1 ZINC000527889063 1109850880 /nfs/dbraw/zinc/85/08/80/1109850880.db2.gz XYYBNONKNGXQDI-XZOQPEGZSA-N 2 0 352.522 4.049 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)OC)c1 ZINC000527917381 1109861768 /nfs/dbraw/zinc/86/17/68/1109861768.db2.gz CXLSBWYPBOSTQA-YHYVQYDKSA-N 2 0 360.542 4.015 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CCC[C@H]([NH+]3CCCC3)CC2)s1 ZINC000449029029 1109959543 /nfs/dbraw/zinc/95/95/43/1109959543.db2.gz NKBIIPHVTNRJMA-INIZCTEOSA-N 2 0 359.514 4.400 20 0 FIADRP CO[C@@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000449085147 1109970987 /nfs/dbraw/zinc/97/09/87/1109970987.db2.gz KRBKWKMZQMYYMF-CVDCTZTESA-N 2 0 352.522 4.059 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3c(OC)c2)[C@H](C)C1 ZINC000449137135 1109980398 /nfs/dbraw/zinc/98/03/98/1109980398.db2.gz DQZYBVBTHXBGSA-XMSQKQJNSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)[C@H](C)O1 ZINC000449153943 1109986647 /nfs/dbraw/zinc/98/66/47/1109986647.db2.gz GNMOJBLVZCLFOX-BPAWZDJUSA-N 2 0 370.459 4.244 20 0 FIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)CC2)cc1 ZINC000449163440 1109990098 /nfs/dbraw/zinc/99/00/98/1109990098.db2.gz WDUIIGDRHFQHPE-LAUBAEHRSA-N 2 0 374.956 4.366 20 0 FIADRP CCc1cnccc1[C@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449207913 1109996043 /nfs/dbraw/zinc/99/60/43/1109996043.db2.gz RQUBWMITDRJQIU-MOPGFXCFSA-N 2 0 351.538 4.390 20 0 FIADRP CCc1cnccc1[C@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449207914 1109996057 /nfs/dbraw/zinc/99/60/57/1109996057.db2.gz RQUBWMITDRJQIU-OALUTQOASA-N 2 0 351.538 4.390 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449214468 1109997081 /nfs/dbraw/zinc/99/70/81/1109997081.db2.gz WTOVJMALVMAZEM-GGAORHGYSA-N 2 0 371.613 4.040 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCOCC(F)(F)C(F)F)CC1 ZINC000449282189 1110015547 /nfs/dbraw/zinc/01/55/47/1110015547.db2.gz GQQRRFXRAXNBTQ-UHFFFAOYSA-N 2 0 370.475 4.172 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000449322979 1110026241 /nfs/dbraw/zinc/02/62/41/1110026241.db2.gz QVLMTEIKRPAPMZ-HXUWFJFHSA-N 2 0 363.549 4.189 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000449312280 1110030442 /nfs/dbraw/zinc/03/04/42/1110030442.db2.gz MCCJOYBEOMXYSN-VAMGGRTRSA-N 2 0 358.570 4.265 20 0 FIADRP Cc1cccnc1CCC[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449486301 1110089902 /nfs/dbraw/zinc/08/99/02/1110089902.db2.gz RTDXLYGCNVTGMZ-HXUWFJFHSA-N 2 0 351.538 4.008 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1 ZINC000072928429 1110207520 /nfs/dbraw/zinc/20/75/20/1110207520.db2.gz OHGUDZAYYDNMKY-UHFFFAOYSA-N 2 0 358.448 4.085 20 0 FIADRP c1ccc(-c2cccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)c2)cc1 ZINC000538725336 1111275591 /nfs/dbraw/zinc/27/55/91/1111275591.db2.gz OMMITOMRRQBBSY-UHFFFAOYSA-N 2 0 364.533 4.430 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(OC)c3ccccc23)CC1 ZINC000538762205 1111290128 /nfs/dbraw/zinc/29/01/28/1111290128.db2.gz CXYOGRQPUZXEDO-UHFFFAOYSA-N 2 0 370.537 4.171 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539057031 1111403707 /nfs/dbraw/zinc/40/37/07/1111403707.db2.gz KXLUIIKCAMJVKA-NMNUPHIUSA-N 2 0 358.570 4.304 20 0 FIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000539062217 1111407902 /nfs/dbraw/zinc/40/79/02/1111407902.db2.gz UGNXNVWVANXOIX-YTFSRNRJSA-N 2 0 374.569 4.140 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000539073708 1111420021 /nfs/dbraw/zinc/42/00/21/1111420021.db2.gz XISVMAAZUJIQSI-KRWDZBQOSA-N 2 0 365.521 4.262 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000539075837 1111420636 /nfs/dbraw/zinc/42/06/36/1111420636.db2.gz MPEIJHVRAPDZOP-XXBNENTESA-N 2 0 354.538 4.109 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)Oc1ccccc1C(F)(F)F ZINC000539124225 1111443344 /nfs/dbraw/zinc/44/33/44/1111443344.db2.gz LWINTTAVNHKGAJ-KLZNWCGWSA-N 2 0 358.448 4.181 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)Oc1ccccc1C(F)(F)F ZINC000539124224 1111443552 /nfs/dbraw/zinc/44/35/52/1111443552.db2.gz LWINTTAVNHKGAJ-KCYZZUKISA-N 2 0 358.448 4.181 20 0 FIADRP CC(C)[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159456 1111454410 /nfs/dbraw/zinc/45/44/10/1111454410.db2.gz RVAGBTAFSSDQQO-GQIGUUNPSA-N 2 0 359.514 4.188 20 0 FIADRP CC(C)[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159458 1111454577 /nfs/dbraw/zinc/45/45/77/1111454577.db2.gz RVAGBTAFSSDQQO-QINHECLXSA-N 2 0 359.514 4.188 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCN(CC)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000539296725 1111506570 /nfs/dbraw/zinc/50/65/70/1111506570.db2.gz KGSLQOLNNHKDBE-UXHICEINSA-N 2 0 367.940 4.078 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccc(F)cc2)CC1 ZINC000643521890 1111547814 /nfs/dbraw/zinc/54/78/14/1111547814.db2.gz DXNOUGQYAWGACI-YADHBBJMSA-N 3 0 361.549 4.111 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H]1CCc3ccccc31)c1ccccc1O2 ZINC000539396680 1111552774 /nfs/dbraw/zinc/55/27/74/1111552774.db2.gz MLBCNNOPGHAKSZ-UGKGYDQZSA-N 2 0 362.517 4.294 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000552047409 1111557567 /nfs/dbraw/zinc/55/75/67/1111557567.db2.gz LSHLZZNXLVEDNJ-REWPJTCUSA-N 2 0 367.537 4.084 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)[C@@H](C)C1 ZINC000552089864 1111570693 /nfs/dbraw/zinc/57/06/93/1111570693.db2.gz XPEAXGPLEBLKSU-UONOGXRCSA-N 2 0 371.388 4.252 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)[C@H](C)C1 ZINC000552089865 1111570846 /nfs/dbraw/zinc/57/08/46/1111570846.db2.gz XPEAXGPLEBLKSU-ZIAGYGMSSA-N 2 0 371.388 4.252 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1cccc(OCC[NH+](C)C)c1 ZINC000477868253 1111582999 /nfs/dbraw/zinc/58/29/99/1111582999.db2.gz WQSSNYLFULWKJB-NQIIRXRSSA-N 2 0 360.542 4.160 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477915542 1111597530 /nfs/dbraw/zinc/59/75/30/1111597530.db2.gz KVUYHKATHKCBJA-INIZCTEOSA-N 2 0 365.949 4.077 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CCO[C@@H]3c3ccccc3)CC2)C1 ZINC000477927761 1111604477 /nfs/dbraw/zinc/60/44/77/1111604477.db2.gz BIMMNVMREMGHJA-WENLIBGGSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000477918422 1111609341 /nfs/dbraw/zinc/60/93/41/1111609341.db2.gz PPTKAJSQWDWRBQ-GOSISDBHSA-N 2 0 366.505 4.498 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000477945966 1111617114 /nfs/dbraw/zinc/61/71/14/1111617114.db2.gz JTXGRAWPEAMSFD-QTGUNEKASA-N 2 0 368.521 4.055 20 0 FIADRP Cc1ccnc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000552248899 1111627986 /nfs/dbraw/zinc/62/79/86/1111627986.db2.gz WOALKSJPWFJLKK-HXUWFJFHSA-N 2 0 367.537 4.112 20 0 FIADRP Cc1ccnc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000552248898 1111628143 /nfs/dbraw/zinc/62/81/43/1111628143.db2.gz WOALKSJPWFJLKK-FQEVSTJZSA-N 2 0 367.537 4.112 20 0 FIADRP Cc1ccccc1[C@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552249729 1111628701 /nfs/dbraw/zinc/62/87/01/1111628701.db2.gz IPQPXEWDYHXIDO-BBHUYCHWSA-N 2 0 352.522 4.061 20 0 FIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000552272939 1111654227 /nfs/dbraw/zinc/65/42/27/1111654227.db2.gz JONPKRYGRUXIGE-UHFFFAOYSA-N 2 0 350.506 4.183 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccc(Br)cc2)C1 ZINC000479290017 1111986329 /nfs/dbraw/zinc/98/63/29/1111986329.db2.gz XFGXJRFNDLCHCK-RDJZCZTQSA-N 2 0 353.348 4.090 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)c1cc(F)ccc1F ZINC000479356502 1111997301 /nfs/dbraw/zinc/99/73/01/1111997301.db2.gz GJXAMZKCXPERTL-QFIPXVFZSA-N 2 0 374.475 4.284 20 0 FIADRP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc(Br)ccc21 ZINC000479335863 1111998988 /nfs/dbraw/zinc/99/89/88/1111998988.db2.gz MWSWXZBFGCJHSM-VKJFTORMSA-N 2 0 363.343 4.388 20 0 FIADRP COC1CCC(C)(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000479450341 1112027622 /nfs/dbraw/zinc/02/76/22/1112027622.db2.gz FKIWAIXBOXIQBG-BXMRMEMUSA-N 2 0 356.554 4.367 20 0 FIADRP CC(C)Oc1ccc([C@@H](CNC2CC[NH+](C3CCCC3)CC2)[NH+](C)C)cc1 ZINC000554086031 1112197431 /nfs/dbraw/zinc/19/74/31/1112197431.db2.gz SIXDPXUHIUPNGJ-HSZRJFAPSA-N 2 0 373.585 4.073 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)cn1 ZINC000480162462 1112308913 /nfs/dbraw/zinc/30/89/13/1112308913.db2.gz BRJDGEWZYXAQGN-ZACQAIPSSA-N 2 0 373.928 4.195 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)CCCC(F)(F)F)cc2)CC1 ZINC000480236511 1112344408 /nfs/dbraw/zinc/34/44/08/1112344408.db2.gz ZSAHCEFXEDQYSU-QGZVFWFLSA-N 2 0 371.491 4.035 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc2c(c1)OCO2 ZINC000480262515 1112362668 /nfs/dbraw/zinc/36/26/68/1112362668.db2.gz KONVUMRRPYCBCB-SFHVURJKSA-N 2 0 366.505 4.498 20 0 FIADRP Cc1ccc2[nH+]ccc(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)c2c1 ZINC000480554354 1112473793 /nfs/dbraw/zinc/47/37/93/1112473793.db2.gz RPHWTYOAWNGLEQ-UHFFFAOYSA-N 2 0 363.427 4.182 20 0 FIADRP COc1cc([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)ccc1OC(F)F ZINC000480619444 1112511638 /nfs/dbraw/zinc/51/16/38/1112511638.db2.gz ULIRVCBOSZPGIU-INIZCTEOSA-N 2 0 370.484 4.459 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000480619465 1112511648 /nfs/dbraw/zinc/51/16/48/1112511648.db2.gz UNMFETFXYUAGCW-LJQANCHMSA-N 2 0 374.573 4.379 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480632359 1112522313 /nfs/dbraw/zinc/52/23/13/1112522313.db2.gz UTQTWODZQIBRAR-BEFAXECRSA-N 2 0 372.384 4.450 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480636188 1112524407 /nfs/dbraw/zinc/52/44/07/1112524407.db2.gz CZKZLUPZGJAURZ-KSZLIROESA-N 2 0 371.569 4.325 20 0 FIADRP CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000554888714 1112546668 /nfs/dbraw/zinc/54/66/68/1112546668.db2.gz JRJZESAGBUJWRD-OAQYLSRUSA-N 2 0 350.466 4.167 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000480730899 1112574775 /nfs/dbraw/zinc/57/47/75/1112574775.db2.gz QGUUZPLPACVEAX-NRFANRHFSA-N 2 0 368.521 4.411 20 0 FIADRP FC1(F)CCC(Cc2ccncc2)([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168364492 1112591871 /nfs/dbraw/zinc/59/18/71/1112591871.db2.gz DMBCSDDDEVYETH-UHFFFAOYSA-N 2 0 363.496 4.036 20 0 FIADRP CCCCc1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000481244742 1112820418 /nfs/dbraw/zinc/82/04/18/1112820418.db2.gz DKWMKMIDHMZDFM-IBGZPJMESA-N 2 0 366.553 4.027 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)C1 ZINC000481308042 1112881683 /nfs/dbraw/zinc/88/16/83/1112881683.db2.gz AFOPMMRLTRKIRB-XMSQKQJNSA-N 2 0 356.485 4.050 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000065931957 1112987362 /nfs/dbraw/zinc/98/73/62/1112987362.db2.gz FSGAPDSSKCCEET-CALCHBBNSA-N 2 0 372.475 4.475 20 0 FIADRP C[NH+](C)[C@@H](CNc1cc[nH+]c2cc(OC(F)(F)F)ccc12)c1ccco1 ZINC000899875388 1113039214 /nfs/dbraw/zinc/03/92/14/1113039214.db2.gz UKBWISYMKKBOSU-INIZCTEOSA-N 2 0 365.355 4.441 20 0 FIADRP FC(F)(F)Oc1ccc2c(NC3CC[NH+](CC4CC4)CC3)cc[nH+]c2c1 ZINC000899875753 1113039824 /nfs/dbraw/zinc/03/98/24/1113039824.db2.gz XVFXIQWOMAPZPO-UHFFFAOYSA-N 2 0 365.399 4.420 20 0 FIADRP CCC1([NH+](C)C)CCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)CC1 ZINC000899877586 1113041000 /nfs/dbraw/zinc/04/10/00/1113041000.db2.gz HEZREPMUNVAGOW-UHFFFAOYSA-N 2 0 367.415 4.444 20 0 FIADRP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(OC(F)(F)F)ccc43)CC[C@@H]21 ZINC000899878676 1113042141 /nfs/dbraw/zinc/04/21/41/1113042141.db2.gz VULSJPLFMPSWHW-DYVFJYSZSA-N 2 0 365.399 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCCc2cccc3ccccc32)[C@H](C)C1 ZINC000482137661 1113179778 /nfs/dbraw/zinc/17/97/78/1113179778.db2.gz MZJZHNIEVFQSDI-YKSBVNFPSA-N 2 0 368.565 4.499 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000482251076 1113210746 /nfs/dbraw/zinc/21/07/46/1113210746.db2.gz BAEWSNVHVMWSEV-NTKDMRAZSA-N 2 0 374.532 4.028 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000482333082 1113228039 /nfs/dbraw/zinc/22/80/39/1113228039.db2.gz ZCYABYSJPOXUOV-HOTGVXAUSA-N 2 0 358.448 4.399 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000482444771 1113258042 /nfs/dbraw/zinc/25/80/42/1113258042.db2.gz AMKAWVRSPHBYLK-HXUWFJFHSA-N 2 0 356.510 4.413 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482445258 1113259029 /nfs/dbraw/zinc/25/90/29/1113259029.db2.gz ISDJNYYEPXTVJU-GMAHTHKFSA-N 2 0 364.533 4.363 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2c(s1)CCC2 ZINC000482460150 1113267624 /nfs/dbraw/zinc/26/76/24/1113267624.db2.gz PJKRDKOCMIGJLX-MRXNPFEDSA-N 2 0 358.551 4.418 20 0 FIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482554101 1113297867 /nfs/dbraw/zinc/29/78/67/1113297867.db2.gz FEEFROANJWJSTH-HTAPYJJXSA-N 2 0 367.512 4.224 20 0 FIADRP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1F ZINC000482652750 1113323358 /nfs/dbraw/zinc/32/33/58/1113323358.db2.gz ULDRTRJZDOPMLC-UWJYYQICSA-N 2 0 356.485 4.225 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1Cl ZINC000482876200 1113385960 /nfs/dbraw/zinc/38/59/60/1113385960.db2.gz UHZMHUDZEICRLT-YJBOKZPZSA-N 2 0 359.341 4.271 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3c(s2)CCC3)[C@@H](C)C1 ZINC000483140248 1113451772 /nfs/dbraw/zinc/45/17/72/1113451772.db2.gz PSAYFFUNYDGQKV-BQFCYCMXSA-N 2 0 350.572 4.024 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1cccc(Br)c1 ZINC000483220413 1113467989 /nfs/dbraw/zinc/46/79/89/1113467989.db2.gz WUEXXPPPWAGLJF-MPGHIAIKSA-N 2 0 353.348 4.090 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000486080700 1113500691 /nfs/dbraw/zinc/50/06/91/1113500691.db2.gz LEVPPLUHSVUNRA-UHOSZYNNSA-N 2 0 372.475 4.059 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486697504 1113625140 /nfs/dbraw/zinc/62/51/40/1113625140.db2.gz GDGACYWEAMKQSH-UHFFFAOYSA-N 2 0 369.484 4.317 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000668713660 1113680938 /nfs/dbraw/zinc/68/09/38/1113680938.db2.gz XAIXGMZKMHSPEF-DENIHFKCSA-N 2 0 364.533 4.215 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc(Cl)cs1 ZINC000486966790 1113684900 /nfs/dbraw/zinc/68/49/00/1113684900.db2.gz LVHOETXEHGSEGD-UHFFFAOYSA-N 2 0 352.931 4.412 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(-n3nc(C)cc3C)cc2)CC1 ZINC000488357408 1113914493 /nfs/dbraw/zinc/91/44/93/1113914493.db2.gz FPSDZEGFDPPHID-UHFFFAOYSA-N 2 0 354.542 4.043 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2c(C)cccc2C(C)C)CC1 ZINC000488388119 1113919627 /nfs/dbraw/zinc/91/96/27/1113919627.db2.gz FPOQYWTWQZTOIP-LJQANCHMSA-N 2 0 373.585 4.499 20 0 FIADRP CC[NH+](CC)Cc1ccc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)cc1 ZINC000490296473 1114261407 /nfs/dbraw/zinc/26/14/07/1114261407.db2.gz CKLRUCBTMHLTLP-UHFFFAOYSA-N 2 0 364.493 4.307 20 0 FIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@H](N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000490988137 1114359800 /nfs/dbraw/zinc/35/98/00/1114359800.db2.gz OOAFNTGYNCUZIE-KNKQGSTJSA-N 2 0 357.586 4.003 20 0 FIADRP COc1ccccc1/C=C/C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000588177376 1114548818 /nfs/dbraw/zinc/54/88/18/1114548818.db2.gz JVMCYWJNVRFTLA-VQHVLOKHSA-N 2 0 350.506 4.484 20 0 FIADRP C[C@H](C[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1)C[NH+]1CCCC1 ZINC000588177742 1114549033 /nfs/dbraw/zinc/54/90/33/1114549033.db2.gz CWZSHSQSOJNKQR-CYBMUJFWSA-N 2 0 355.309 4.091 20 0 FIADRP CCCCC/C(=C\c1ccccc1)C[NH2+]CC(C)(C)N1CC[NH+](C)CC1 ZINC000588177666 1114549102 /nfs/dbraw/zinc/54/91/02/1114549102.db2.gz UXEIWVWUKMPMJJ-RELWKKBWSA-N 2 0 357.586 4.266 20 0 FIADRP Cc1ncncc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000572855921 1114807380 /nfs/dbraw/zinc/80/73/80/1114807380.db2.gz RURPNGZNADVVHS-QGZVFWFLSA-N 2 0 352.526 4.400 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000589706062 1114829855 /nfs/dbraw/zinc/82/98/55/1114829855.db2.gz REPZKSWRUIVSTA-UHFFFAOYSA-N 2 0 352.522 4.429 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000590786426 1114974227 /nfs/dbraw/zinc/97/42/27/1114974227.db2.gz WSMWTXBVZWGDMZ-UHFFFAOYSA-N 2 0 358.448 4.180 20 0 FIADRP Cc1ccc(-c2noc([C@@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)n2)cc1F ZINC000590786658 1114974258 /nfs/dbraw/zinc/97/42/58/1114974258.db2.gz LHJOAUTYEUPBGD-MRXNPFEDSA-N 2 0 374.504 4.297 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000590786860 1114974384 /nfs/dbraw/zinc/97/43/84/1114974384.db2.gz BHRUMZOTJQYXKL-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP CCC[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1)c1ccccc1 ZINC000590786822 1114974531 /nfs/dbraw/zinc/97/45/31/1114974531.db2.gz NZXAPCYYLLWVOK-DENIHFKCSA-N 2 0 373.585 4.085 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000590786207 1114974568 /nfs/dbraw/zinc/97/45/68/1114974568.db2.gz IJJZEUUOEJEBHQ-UHFFFAOYSA-N 2 0 358.448 4.180 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2cn(C)nc2C(C)(C)C)CC1 ZINC000093947725 1115026541 /nfs/dbraw/zinc/02/65/41/1115026541.db2.gz JLUSQMRHGWPXJQ-UHFFFAOYSA-N 2 0 368.569 4.239 20 0 FIADRP CC(C)Cc1ccccc1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC001168400424 1115047213 /nfs/dbraw/zinc/04/72/13/1115047213.db2.gz AUQGDSPSPRYELH-UHFFFAOYSA-N 2 0 358.570 4.210 20 0 FIADRP CCOc1cc2[nH+]ccc(N(C)C3CC[NH+](C(C)C)CC3)c2cc1OCC ZINC000591652319 1115119326 /nfs/dbraw/zinc/11/93/26/1115119326.db2.gz ACVIXDOIYQJYMY-UHFFFAOYSA-N 2 0 371.525 4.341 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)CC1 ZINC000591709151 1115125491 /nfs/dbraw/zinc/12/54/91/1115125491.db2.gz UHHKOHJTELGEML-UHFFFAOYSA-N 2 0 356.485 4.226 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000591711889 1115126282 /nfs/dbraw/zinc/12/62/82/1115126282.db2.gz BLIFPLCOOLXQBN-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP C[N@@H+]1CC[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C[C@@H]1c1ccccc1 ZINC000574624084 1115429892 /nfs/dbraw/zinc/42/98/92/1115429892.db2.gz HOQPEPGMJRQEHT-FYYLOGMGSA-N 2 0 355.570 4.209 20 0 FIADRP Cn1cncc1CCC[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000574999381 1115529091 /nfs/dbraw/zinc/52/90/91/1115529091.db2.gz BYRZMAVVWXCKHT-NRFANRHFSA-N 2 0 355.432 4.205 20 0 FIADRP [NH3+]C1(Cc2cccc(Cl)c2)CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415527 1115826416 /nfs/dbraw/zinc/82/64/16/1115826416.db2.gz CPDSNUFVXZFEFR-NRFANRHFSA-N 2 0 372.915 4.372 20 0 FIADRP FC(F)(F)c1cccc(OCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000606447763 1115944962 /nfs/dbraw/zinc/94/49/62/1115944962.db2.gz IJOXBKDYXUZOOT-SFHVURJKSA-N 2 0 370.459 4.425 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3cccc(C[NH+](C)C)c3)cc2)C1 ZINC000607384297 1116021423 /nfs/dbraw/zinc/02/14/23/1116021423.db2.gz RVCXKNGNBSHZFO-GOSISDBHSA-N 2 0 365.521 4.232 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000608061239 1116079669 /nfs/dbraw/zinc/07/96/69/1116079669.db2.gz IEUXEKXMUUMRBI-SIKLNZKXSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000608073237 1116080841 /nfs/dbraw/zinc/08/08/41/1116080841.db2.gz FEMTZWHDECLEFC-QGZVFWFLSA-N 2 0 374.475 4.333 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)c(F)c1 ZINC000534331540 1116185514 /nfs/dbraw/zinc/18/55/14/1116185514.db2.gz NSJXESXZGIXDHJ-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP CCC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000534494166 1116207209 /nfs/dbraw/zinc/20/72/09/1116207209.db2.gz AMHYPZRVEASWJZ-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000534794986 1116237600 /nfs/dbraw/zinc/23/76/00/1116237600.db2.gz SRSPEYCNHFYERY-DIFFPNOSSA-N 2 0 369.734 4.164 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000534794985 1116237670 /nfs/dbraw/zinc/23/76/70/1116237670.db2.gz SRSPEYCNHFYERY-APPDUMDISA-N 2 0 369.734 4.164 20 0 FIADRP CCOc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc(Cl)c1OC ZINC000535083072 1116265826 /nfs/dbraw/zinc/26/58/26/1116265826.db2.gz YSBSWCNIMQYTCI-UHFFFAOYSA-N 2 0 368.949 4.300 20 0 FIADRP CC[NH+](CC)CCOC1CCN(c2c(C)c[nH+]c3c(C)cccc32)CC1 ZINC000462511524 1116365300 /nfs/dbraw/zinc/36/53/00/1116365300.db2.gz NIPVRKWFVNLCQW-UHFFFAOYSA-N 2 0 355.526 4.179 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)cc2)c1 ZINC000462684202 1116390367 /nfs/dbraw/zinc/39/03/67/1116390367.db2.gz NHLIYXDHGWTEJK-UHFFFAOYSA-N 2 0 352.522 4.172 20 0 FIADRP c1[nH]nc2c1cccc2C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000539862685 1116392146 /nfs/dbraw/zinc/39/21/46/1116392146.db2.gz NDLQONJICTYGFN-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP COc1ccc2cc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000539895361 1117739251 /nfs/dbraw/zinc/73/92/51/1117739251.db2.gz CSQNUOJRLZVMPQ-NZQKXSOJSA-N 2 0 350.506 4.297 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC000539899547 1117741078 /nfs/dbraw/zinc/74/10/78/1117741078.db2.gz FSVZNYHYQNVTKE-MISYRCLQSA-N 2 0 356.535 4.099 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000462761732 1117752751 /nfs/dbraw/zinc/75/27/51/1117752751.db2.gz KTVQJICFYQTZLB-UHFFFAOYSA-N 2 0 362.521 4.237 20 0 FIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000462804598 1117787251 /nfs/dbraw/zinc/78/72/51/1117787251.db2.gz DTQWPDGFNANMAF-OALUTQOASA-N 2 0 371.569 4.051 20 0 FIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000540135690 1117900394 /nfs/dbraw/zinc/90/03/94/1117900394.db2.gz ACJJJRKYYGJQFF-QFIPXVFZSA-N 2 0 365.521 4.418 20 0 FIADRP CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540175340 1117916070 /nfs/dbraw/zinc/91/60/70/1117916070.db2.gz UFNZYOQEANTBRL-VGSWGCGISA-N 2 0 368.521 4.364 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(OCC(F)F)c1 ZINC000540176636 1117916545 /nfs/dbraw/zinc/91/65/45/1117916545.db2.gz UJBNWNPVRJSSTO-UTKZUKDTSA-N 2 0 374.475 4.331 20 0 FIADRP CC(C)O[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1(C)C ZINC000463023061 1117927631 /nfs/dbraw/zinc/92/76/31/1117927631.db2.gz GKSXCCGLTZTMBH-OALUTQOASA-N 2 0 350.572 4.142 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1nc2ccc(Cl)cc2n1C ZINC000540259519 1117961738 /nfs/dbraw/zinc/96/17/38/1117961738.db2.gz WIRZALDCGGUYHY-HOTGVXAUSA-N 2 0 362.949 4.389 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1nc2ccc(Cl)cc2n1C ZINC000540259520 1117962029 /nfs/dbraw/zinc/96/20/29/1117962029.db2.gz WIRZALDCGGUYHY-HZPDHXFCSA-N 2 0 362.949 4.389 20 0 FIADRP Cc1csc(CCCC[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1 ZINC000463106572 1117967379 /nfs/dbraw/zinc/96/73/79/1117967379.db2.gz AOTININTOOQWIE-ICSRJNTNSA-N 2 0 357.567 4.417 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000463108854 1117968593 /nfs/dbraw/zinc/96/85/93/1117968593.db2.gz UZVIPCYTXGWVQI-NRFANRHFSA-N 2 0 368.569 4.179 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)ccn1 ZINC000540317865 1117981449 /nfs/dbraw/zinc/98/14/49/1117981449.db2.gz IWCOABDAAKGAAT-QFIPXVFZSA-N 2 0 371.500 4.182 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C[C@@H](C)O1 ZINC000540320794 1117982830 /nfs/dbraw/zinc/98/28/30/1117982830.db2.gz NBCVVPQVYKWUJS-QINHECLXSA-N 2 0 350.934 4.270 20 0 FIADRP CC(C)[NH+](CCNC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C(C)C ZINC000463132500 1117983518 /nfs/dbraw/zinc/98/35/18/1117983518.db2.gz PMVTWGWLUPYTGQ-UHFFFAOYSA-N 2 0 351.966 4.013 20 0 FIADRP CC(C)(C)[C@H]1OCCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463133157 1117984236 /nfs/dbraw/zinc/98/42/36/1117984236.db2.gz DJKAYHTUBBJPHQ-IRLDBZIGSA-N 2 0 358.570 4.124 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCCC[NH+](C)C ZINC000540418030 1118044586 /nfs/dbraw/zinc/04/45/86/1118044586.db2.gz YPUPTGMXJUVKHC-WBMJQRKESA-N 2 0 357.361 4.163 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000540419303 1118045351 /nfs/dbraw/zinc/04/53/51/1118045351.db2.gz WFINIWQLHAMGEQ-XNJGSVPQSA-N 2 0 369.372 4.163 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O2 ZINC000540461862 1118067371 /nfs/dbraw/zinc/06/73/71/1118067371.db2.gz CEXUPFVOWLVBAZ-HXUWFJFHSA-N 2 0 372.459 4.085 20 0 FIADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475939 1118077024 /nfs/dbraw/zinc/07/70/24/1118077024.db2.gz WOHNZSQBQKPVMS-APWZRJJASA-N 2 0 356.535 4.257 20 0 FIADRP Cc1ccc(CC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c(C)c1 ZINC000540475535 1118078111 /nfs/dbraw/zinc/07/81/11/1118078111.db2.gz XUAUWYGJOHKGOB-QFIPXVFZSA-N 2 0 364.533 4.424 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000540608776 1118148752 /nfs/dbraw/zinc/14/87/52/1118148752.db2.gz TVYLEBVESWEDQI-KRWDZBQOSA-N 2 0 357.498 4.178 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000540708153 1118196103 /nfs/dbraw/zinc/19/61/03/1118196103.db2.gz MSJJAKRYPUVTDX-IRLDBZIGSA-N 2 0 356.510 4.205 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000540709407 1118196821 /nfs/dbraw/zinc/19/68/21/1118196821.db2.gz BXSRZPWGYDMHRE-YADHBBJMSA-N 2 0 358.570 4.472 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1cccc(Cl)c1Cl ZINC000541388060 1118497959 /nfs/dbraw/zinc/49/79/59/1118497959.db2.gz VBOUSILGMMLWOQ-UHFFFAOYSA-N 2 0 361.276 4.215 20 0 FIADRP COc1ccc(Oc2ccc(C[N@H+](C)C[C@@H]3CCC[NH+](C)C3)cc2)cc1 ZINC000541537892 1118546246 /nfs/dbraw/zinc/54/62/46/1118546246.db2.gz UDQFBVZUDQSBKF-LJQANCHMSA-N 2 0 354.494 4.261 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC(=O)Nc2ccccc21 ZINC000541552109 1118559855 /nfs/dbraw/zinc/55/98/55/1118559855.db2.gz MEFBNLIECDVDJG-FQEVSTJZSA-N 2 0 351.494 4.090 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541600545 1118574518 /nfs/dbraw/zinc/57/45/18/1118574518.db2.gz LDPYXOJBWWSPAO-YLJYHZDGSA-N 2 0 372.553 4.385 20 0 FIADRP CC[N@H+](C)C[C@H]1CC[NH+](CC/C=C\c2ccc(Br)cc2)C1 ZINC000464791424 1118699951 /nfs/dbraw/zinc/69/99/51/1118699951.db2.gz TWRVHSBXBYWBJU-XQDHMALISA-N 2 0 351.332 4.126 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)C(C)(C)c1ccccc1 ZINC000541915168 1118706522 /nfs/dbraw/zinc/70/65/22/1118706522.db2.gz BAVGBTAOJLQHMC-XXBNENTESA-N 2 0 366.549 4.099 20 0 FIADRP C[C@@H](CCCCO)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000670161065 1118749643 /nfs/dbraw/zinc/74/96/43/1118749643.db2.gz GHFAJUQERLZYAH-AZQUWAFASA-N 2 0 364.961 4.395 20 0 FIADRP CC(C)Oc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388244922 1118960410 /nfs/dbraw/zinc/96/04/10/1118960410.db2.gz FSLOUNLZMSFGJW-QFIPXVFZSA-N 2 0 352.522 4.476 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000491579297 1118963827 /nfs/dbraw/zinc/96/38/27/1118963827.db2.gz PITQUBRAPIXAMS-UHFFFAOYSA-N 2 0 366.896 4.484 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)CC2 ZINC000492113860 1119027406 /nfs/dbraw/zinc/02/74/06/1119027406.db2.gz ZXSUQMXOUZMJFQ-KRWDZBQOSA-N 2 0 351.332 4.207 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1OC ZINC000173320226 1119032567 /nfs/dbraw/zinc/03/25/67/1119032567.db2.gz LKMQKKKPHBUOBX-QGZVFWFLSA-N 2 0 356.510 4.395 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(F)c1 ZINC000173903084 1119078565 /nfs/dbraw/zinc/07/85/65/1119078565.db2.gz KFHIMBYBYCLRKO-KSZLIROESA-N 2 0 356.485 4.286 20 0 FIADRP COCC[C@H]1CCCC[NH+]([C@H](C)CC[N@H+]2CCCC[C@@H](CCOC)C2)C1 ZINC000467274285 1119288978 /nfs/dbraw/zinc/28/89/78/1119288978.db2.gz FZFZRSSFVHHXBJ-BHIFYINESA-N 2 0 368.606 4.042 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](C3CCCC3)CC2)cc1)C(C)C ZINC000177409791 1119329088 /nfs/dbraw/zinc/32/90/88/1119329088.db2.gz QRCUWZCKWWQSBC-UHFFFAOYSA-N 2 0 371.569 4.054 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311590938 1119380317 /nfs/dbraw/zinc/38/03/17/1119380317.db2.gz AKZSJXYWOBYVSF-XQBPLPMBSA-N 2 0 352.522 4.214 20 0 FIADRP Fc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000311991667 1119397022 /nfs/dbraw/zinc/39/70/22/1119397022.db2.gz ONTYLSHAPOCPJO-INIZCTEOSA-N 2 0 366.402 4.456 20 0 FIADRP COc1ccc(C[C@@H](C)C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1F ZINC000761528072 1119410093 /nfs/dbraw/zinc/41/00/93/1119410093.db2.gz YJFJDPUYLUZZMM-QHGAOEGBSA-N 2 0 362.533 4.400 20 0 FIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)Cc1ccc(OC)cc1 ZINC000542466871 1119458952 /nfs/dbraw/zinc/45/89/52/1119458952.db2.gz LXPXKIPNJKWBHI-QGZVFWFLSA-N 2 0 364.493 4.037 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]C3CC(OCc4ccccc4)C3)CC2)c1 ZINC000493909373 1119505153 /nfs/dbraw/zinc/50/51/53/1119505153.db2.gz VMNKUDBOLLARSR-UHFFFAOYSA-N 2 0 370.562 4.298 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000493892919 1119506975 /nfs/dbraw/zinc/50/69/75/1119506975.db2.gz AKEXGQLJEOWFGV-GOSISDBHSA-N 2 0 363.343 4.351 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@@H](C)C1 ZINC000542470613 1119511743 /nfs/dbraw/zinc/51/17/43/1119511743.db2.gz KTWJQSGJJOYIBD-MSYCTHLASA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)[C@@H](C)C1 ZINC000542470617 1119512268 /nfs/dbraw/zinc/51/22/68/1119512268.db2.gz KTWJQSGJJOYIBD-SELNLUPBSA-N 2 0 374.569 4.091 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000186097051 1119705738 /nfs/dbraw/zinc/70/57/38/1119705738.db2.gz PRRODFFBHOMAQS-BBWFWOEESA-N 2 0 374.550 4.217 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCCCCc1ccc(F)cc1 ZINC000494267622 1119816137 /nfs/dbraw/zinc/81/61/37/1119816137.db2.gz IEGYQPYQSPILJH-UHFFFAOYSA-N 2 0 352.457 4.217 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000191556884 1119983887 /nfs/dbraw/zinc/98/38/87/1119983887.db2.gz BIIMEPXRATYGIN-HNNXBMFYSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)CC1 ZINC000191571216 1119984814 /nfs/dbraw/zinc/98/48/14/1119984814.db2.gz ABTDOMDKHDNJSH-QHCPKHFHSA-N 2 0 368.569 4.111 20 0 FIADRP CN1CCC[C@@H](C[NH2+]CCCc2ccc3c(c2)CCO3)[C@@H]1c1cccs1 ZINC000193297999 1120125868 /nfs/dbraw/zinc/12/58/68/1120125868.db2.gz MPTCGDYRKNHFTC-SIKLNZKXSA-N 2 0 370.562 4.288 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc(Br)cs1 ZINC000193950110 1120218849 /nfs/dbraw/zinc/21/88/49/1120218849.db2.gz IQRLZCNRWUHPPQ-GFCCVEGCSA-N 2 0 353.329 4.423 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(F)c(F)c1F ZINC000542500489 1120226967 /nfs/dbraw/zinc/22/69/67/1120226967.db2.gz ZGFSJQRGLHBWSF-BEFAXECRSA-N 2 0 362.439 4.147 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494891608 1120359354 /nfs/dbraw/zinc/35/93/54/1120359354.db2.gz QLUSPRISNMCVPB-KNKQGSTJSA-N 2 0 362.533 4.395 20 0 FIADRP CC(C)[NH+](CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1)C(C)C ZINC000495075739 1120458779 /nfs/dbraw/zinc/45/87/79/1120458779.db2.gz USSAZMGRCCJULG-WIYYLYMNSA-N 2 0 350.522 4.392 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495105406 1120477295 /nfs/dbraw/zinc/47/72/95/1120477295.db2.gz BRMCMPBXMWGHLH-LAUBAEHRSA-N 2 0 368.569 4.255 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001168484340 1120639291 /nfs/dbraw/zinc/63/92/91/1120639291.db2.gz FTULFKXKIUTUDM-LJQANCHMSA-N 2 0 367.512 4.140 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)COC2 ZINC000495434209 1120809761 /nfs/dbraw/zinc/80/97/61/1120809761.db2.gz QSBIOIUUFVFPHA-BBTUJRGHSA-N 2 0 350.506 4.278 20 0 FIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cccc(NC(=O)OC(C)(C)C)c2)CC1 ZINC000715230956 1120860744 /nfs/dbraw/zinc/86/07/44/1120860744.db2.gz IXLDYHVLZKMUQP-UHFFFAOYSA-N 2 0 361.530 4.386 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cc1F ZINC000495543887 1120877383 /nfs/dbraw/zinc/87/73/83/1120877383.db2.gz BKEWPDIDDQOFEH-ZACQAIPSSA-N 2 0 374.475 4.425 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1OC ZINC000915228551 1120884261 /nfs/dbraw/zinc/88/42/61/1120884261.db2.gz FOYXHDJAHANNLW-QFIPXVFZSA-N 2 0 368.521 4.411 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CC[C@@H]3SCCS[C@H]23)c1 ZINC000762612122 1120938375 /nfs/dbraw/zinc/93/83/75/1120938375.db2.gz FRMDZLQEVBBUNM-HSALFYBXSA-N 2 0 362.608 4.142 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cc(Br)ncc1F ZINC000762749267 1120958879 /nfs/dbraw/zinc/95/88/79/1120958879.db2.gz RIBDBIRDQPTGRA-CQSZACIVSA-N 2 0 372.326 4.290 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c(C)c1 ZINC000237621753 1120980318 /nfs/dbraw/zinc/98/03/18/1120980318.db2.gz HCKLJQABAZGTPX-PMACEKPBSA-N 2 0 352.522 4.202 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c(-c2ccccc2)cc1OC ZINC000062426967 1121541227 /nfs/dbraw/zinc/54/12/27/1121541227.db2.gz HMCALRVYYGOICY-SFHVURJKSA-N 2 0 368.521 4.191 20 0 FIADRP CC[NH+]1CCC(N[C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000038097949 1121601340 /nfs/dbraw/zinc/60/13/40/1121601340.db2.gz YOSZDKVAQBDZNG-LBPRGKRZSA-N 2 0 351.288 4.330 20 0 FIADRP Cc1cc(-c2noc([C@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)n2)ccc1F ZINC000123627514 1121619176 /nfs/dbraw/zinc/61/91/76/1121619176.db2.gz JLDNTBDYHYWPBE-INIZCTEOSA-N 2 0 374.504 4.299 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC(F)(F)F)cc1 ZINC000123723222 1121626061 /nfs/dbraw/zinc/62/60/61/1121626061.db2.gz SYHVXCIFMVUCKI-AWEZNQCLSA-N 2 0 352.400 4.498 20 0 FIADRP COCC[C@H](C)[NH2+]C[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124571910 1121705376 /nfs/dbraw/zinc/70/53/76/1121705376.db2.gz QHBHFLFMPIURHH-YXJHDRRASA-N 2 0 358.448 4.103 20 0 FIADRP COCC[C@H](C)[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124571414 1121705488 /nfs/dbraw/zinc/70/54/88/1121705488.db2.gz QHBHFLFMPIURHH-QILLFSRXSA-N 2 0 358.448 4.103 20 0 FIADRP COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000124601782 1121707544 /nfs/dbraw/zinc/70/75/44/1121707544.db2.gz AHWSGHCEMWOZDJ-OTWHNJEPSA-N 2 0 368.521 4.155 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc(Cl)c(F)c2)cc1 ZINC000065932093 1121723488 /nfs/dbraw/zinc/72/34/88/1121723488.db2.gz UUZMQXWNIXBGDZ-UHFFFAOYSA-N 2 0 364.892 4.490 20 0 FIADRP COCc1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)o1 ZINC000125399811 1121776117 /nfs/dbraw/zinc/77/61/17/1121776117.db2.gz OUJZDZKYCIPOOV-UHFFFAOYSA-N 2 0 364.489 4.444 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1 ZINC000125567615 1121792711 /nfs/dbraw/zinc/79/27/11/1121792711.db2.gz QGMPWNFSJNRXBP-OALUTQOASA-N 2 0 374.573 4.333 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC000125872747 1121858347 /nfs/dbraw/zinc/85/83/47/1121858347.db2.gz CBIMCBMPNFGQTO-IBGZPJMESA-N 2 0 363.977 4.014 20 0 FIADRP C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000069753253 1121879191 /nfs/dbraw/zinc/87/91/91/1121879191.db2.gz CPNIJHJHOLVFNF-UWJYYQICSA-N 2 0 354.494 4.167 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cnc(-c3ccccc3)s2)CC1 ZINC000072694640 1121902977 /nfs/dbraw/zinc/90/29/77/1121902977.db2.gz XOYZEXAZECJRQU-UHFFFAOYSA-N 2 0 373.566 4.133 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000126546578 1121963980 /nfs/dbraw/zinc/96/39/80/1121963980.db2.gz AUGAXYCFWOCZIF-JOCHJYFZSA-N 2 0 373.585 4.031 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)c(F)c2)cc1 ZINC000917008854 1121994914 /nfs/dbraw/zinc/99/49/14/1121994914.db2.gz SXGUFALSCXEEIA-KSFYIVLOSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2c(F)cccc2F)cc1 ZINC000917008330 1122000127 /nfs/dbraw/zinc/00/01/27/1122000127.db2.gz JQNNPQFWRIUWJD-IERDGZPVSA-N 2 0 374.475 4.162 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)ccc1OCc1cccs1 ZINC000623655122 1122128189 /nfs/dbraw/zinc/12/81/89/1122128189.db2.gz ORRRCKPDBRMXIE-GOSISDBHSA-N 2 0 374.550 4.157 20 0 FIADRP C[C@H](C[NH2+]Cc1c(-c2ccccc2)nc2sccn12)C[NH+]1CCCCC1 ZINC000917436178 1122303449 /nfs/dbraw/zinc/30/34/49/1122303449.db2.gz BHMBMNFYQDDBQK-QGZVFWFLSA-N 2 0 368.550 4.274 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@@H](C)[C@H]3CCC[NH2+]C3)c2C1 ZINC000262653102 1122335711 /nfs/dbraw/zinc/33/57/11/1122335711.db2.gz SCUXUQKVEFZBBW-MSOLQXFVSA-N 2 0 357.542 4.013 20 0 FIADRP CCC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000128555925 1122342197 /nfs/dbraw/zinc/34/21/97/1122342197.db2.gz SRNMYRAMNNAJFH-IBGZPJMESA-N 2 0 371.491 4.164 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000069160438 1122557553 /nfs/dbraw/zinc/55/75/53/1122557553.db2.gz ZKLHAIZGHJFTHS-SFHVURJKSA-N 2 0 374.550 4.157 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)C1 ZINC000556059635 1122628767 /nfs/dbraw/zinc/62/87/67/1122628767.db2.gz UMBYBLSCYIMBPV-PABCKOPISA-N 2 0 357.586 4.170 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2CCOCC2)c2ccc(F)cc2)CC1 ZINC000556237545 1122754424 /nfs/dbraw/zinc/75/44/24/1122754424.db2.gz FISRUEOCOFWVKG-QFIPXVFZSA-N 2 0 362.533 4.395 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000556239190 1122756604 /nfs/dbraw/zinc/75/66/04/1122756604.db2.gz BBJPJCHBRZKPCU-SIKLNZKXSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@@H](Cc1ccccc1F)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556609711 1123002932 /nfs/dbraw/zinc/00/29/32/1123002932.db2.gz RKOXRIKBKCFKAB-KRWDZBQOSA-N 2 0 356.485 4.020 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556890431 1123176403 /nfs/dbraw/zinc/17/64/03/1123176403.db2.gz LKHDNBQLJQVCJZ-ITHJZZCUSA-N 2 0 370.581 4.472 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccoc1 ZINC000556889924 1123177243 /nfs/dbraw/zinc/17/72/43/1123177243.db2.gz KVFYDOCECGMMFE-FGZHOGPDSA-N 2 0 356.510 4.113 20 0 FIADRP COc1cccc(C2([NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000556912147 1123203697 /nfs/dbraw/zinc/20/36/97/1123203697.db2.gz QVZYXTVQDPAKMQ-UYAOXDASSA-N 2 0 350.506 4.185 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)CC[N@@H+]1C ZINC000556914521 1123223277 /nfs/dbraw/zinc/22/32/77/1123223277.db2.gz JILBKYHSFUCFQH-STQMWFEESA-N 2 0 357.361 4.005 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)cc1 ZINC000132501124 1123274146 /nfs/dbraw/zinc/27/41/46/1123274146.db2.gz XCHKSSNQEXYBCN-RXVVDRJESA-N 2 0 363.615 4.110 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499150701 1123293973 /nfs/dbraw/zinc/29/39/73/1123293973.db2.gz JTQLNVCMLPNTGT-NUNAXRQHSA-N 2 0 364.533 4.331 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C(C)(C)c1ccccc1 ZINC000132609023 1123302253 /nfs/dbraw/zinc/30/22/53/1123302253.db2.gz JMEDIRXSKDCIPT-LJQANCHMSA-N 2 0 366.549 4.099 20 0 FIADRP COc1cccc(C[C@@H](C)[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499231281 1123339556 /nfs/dbraw/zinc/33/95/56/1123339556.db2.gz UTCPZCBFWQFIAD-HWHRFOGPSA-N 2 0 364.533 4.411 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1cccc(F)c1 ZINC000499232945 1123341416 /nfs/dbraw/zinc/34/14/16/1123341416.db2.gz ZFUNUWZLYUSKAJ-HLRQEUIKSA-N 2 0 368.496 4.378 20 0 FIADRP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H](N[C@@H]2CC[N@@H+](CC4CCCC4)C2)C3)cc1 ZINC000499256250 1123367263 /nfs/dbraw/zinc/36/72/63/1123367263.db2.gz PAJBZMAPPSKBJU-JLLPCOHGSA-N 2 0 367.581 4.036 20 0 FIADRP Clc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCCC2 ZINC000132980432 1123394311 /nfs/dbraw/zinc/39/43/11/1123394311.db2.gz TWRDHVRXXZWWRN-IIBYNOLFSA-N 2 0 362.945 4.198 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cc(-c3ccccc3)cs2)C[C@H](C)O1 ZINC000237609261 1123644286 /nfs/dbraw/zinc/64/42/86/1123644286.db2.gz DXMUMCUGESPYOS-HDICACEKSA-N 2 0 358.551 4.394 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CCOc4ccccc42)C3)cc1 ZINC000245652509 1124167344 /nfs/dbraw/zinc/16/73/44/1124167344.db2.gz CUUINBMNHBWJSY-YSFYHYPLSA-N 2 0 362.517 4.338 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CCOc4ccccc42)C3)cc1 ZINC000245652505 1124167605 /nfs/dbraw/zinc/16/76/05/1124167605.db2.gz CUUINBMNHBWJSY-KJJMTIBFSA-N 2 0 362.517 4.338 20 0 FIADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245655382 1124169733 /nfs/dbraw/zinc/16/97/33/1124169733.db2.gz DIPBLBRGIQDEHT-FADBTOOJSA-N 2 0 356.554 4.223 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000245655524 1124170351 /nfs/dbraw/zinc/17/03/51/1124170351.db2.gz DLSMZPQSDZSFAM-ACDBMABISA-N 2 0 355.551 4.088 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2c(c1)OCO2 ZINC000245676159 1124187099 /nfs/dbraw/zinc/18/70/99/1124187099.db2.gz ICOQGBIDZGCHQU-LRGNLBRXSA-N 2 0 364.489 4.262 20 0 FIADRP COCCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000245680388 1124192465 /nfs/dbraw/zinc/19/24/65/1124192465.db2.gz IRZHZBPTCOZEOS-KOUNCHBCSA-N 2 0 356.554 4.369 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000474598285 1124217237 /nfs/dbraw/zinc/21/72/37/1124217237.db2.gz KQQQNQVHQDQRTG-VBWXLCSBSA-N 2 0 364.496 4.223 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000245897508 1124275043 /nfs/dbraw/zinc/27/50/43/1124275043.db2.gz NIGWYJGIBFRGRO-BHDDXSALSA-N 2 0 368.521 4.205 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)C1 ZINC000246316862 1124443574 /nfs/dbraw/zinc/44/35/74/1124443574.db2.gz FAEZXDOOQXNMOI-KSSFIOAISA-N 2 0 363.958 4.326 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000246346842 1124460217 /nfs/dbraw/zinc/46/02/17/1124460217.db2.gz HHWHUUWGPOANML-GDIGMMSISA-N 2 0 370.459 4.124 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccccc1F ZINC000246560902 1124533441 /nfs/dbraw/zinc/53/34/41/1124533441.db2.gz KMOANTAJSZZGLZ-KZNAEPCWSA-N 2 0 356.485 4.286 20 0 FIADRP c1nc(-c2ccccc2)sc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246566811 1124533962 /nfs/dbraw/zinc/53/39/62/1124533962.db2.gz LFBFORKDVYWEBR-FXAWDEMLSA-N 2 0 353.535 4.259 20 0 FIADRP CCCCc1noc([C@@H](C)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)n1 ZINC000057924958 1124545969 /nfs/dbraw/zinc/54/59/69/1124545969.db2.gz UQIINXMUEVNJCG-GOSISDBHSA-N 2 0 370.541 4.317 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1)c1cc(F)ccc1F ZINC000246928940 1124574847 /nfs/dbraw/zinc/57/48/47/1124574847.db2.gz HBHRMBOXRNUENF-HZPDHXFCSA-N 2 0 360.448 4.036 20 0 FIADRP CC(C)n1ncc2cc(CN3CCC[C@H](C[N@@H+]4CCCC[C@H]4C)C3)cnc21 ZINC000247115768 1124592192 /nfs/dbraw/zinc/59/21/92/1124592192.db2.gz YNPGLJAHBBXFRH-MOPGFXCFSA-N 2 0 369.557 4.099 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000247177503 1124596325 /nfs/dbraw/zinc/59/63/25/1124596325.db2.gz SWCXFEUAANDTLB-BFWZDYSYSA-N 2 0 364.496 4.082 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000247237003 1124610596 /nfs/dbraw/zinc/61/05/96/1124610596.db2.gz YSEWEITXQISBED-ZWKOTPCHSA-N 2 0 372.557 4.133 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cnc3ccsc3c2)[C@@H](C)C1 ZINC000248066025 1124740502 /nfs/dbraw/zinc/74/05/02/1124740502.db2.gz MGCRAZDFUQKPPQ-JZXOWHBKSA-N 2 0 361.555 4.084 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)C(c1ccccc1)c1ccccc1 ZINC000248175039 1124748541 /nfs/dbraw/zinc/74/85/41/1124748541.db2.gz VLPZKJWCFDXFGQ-OFNKIYASSA-N 2 0 366.549 4.034 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248402540 1124762215 /nfs/dbraw/zinc/76/22/15/1124762215.db2.gz NHPKBHIHABRBKT-UEXGIBASSA-N 2 0 366.553 4.484 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000248409049 1124764842 /nfs/dbraw/zinc/76/48/42/1124764842.db2.gz WGQFNLPYSZFWGF-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000248433302 1124768281 /nfs/dbraw/zinc/76/82/81/1124768281.db2.gz DBWUQAFCDKHJIJ-YLJYHZDGSA-N 2 0 364.489 4.159 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)s1 ZINC000248451999 1124771055 /nfs/dbraw/zinc/77/10/55/1124771055.db2.gz PPSLVMLSBLFKJL-LPHOPBHVSA-N 2 0 358.551 4.118 20 0 FIADRP C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000248710724 1124803519 /nfs/dbraw/zinc/80/35/19/1124803519.db2.gz BGCXCQSUVQFPAJ-AVCGJXAMSA-N 2 0 368.521 4.198 20 0 FIADRP Fc1cccc2c1OCC[C@@H]2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248753991 1124810032 /nfs/dbraw/zinc/81/00/32/1124810032.db2.gz CLBLVHIHZKNWGO-VWNVYAMZSA-N 2 0 366.480 4.435 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000521917910 1124827430 /nfs/dbraw/zinc/82/74/30/1124827430.db2.gz LKBQGEKZKMENIQ-UEUFPXFLSA-N 2 0 369.597 4.455 20 0 FIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215403 1124891206 /nfs/dbraw/zinc/89/12/06/1124891206.db2.gz GELZINCPMLZHCK-OAHLLOKOSA-N 2 0 359.901 4.311 20 0 FIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccs1 ZINC000090523556 1125001209 /nfs/dbraw/zinc/00/12/09/1125001209.db2.gz VXFZUAIGDOGFTA-OTWHNJEPSA-N 2 0 350.572 4.193 20 0 FIADRP Cc1cc2cc([C@@H](C)[NH2+]Cc3ccnc(OCC[NH+](C)C)c3)oc2cc1C ZINC000090937216 1125028117 /nfs/dbraw/zinc/02/81/17/1125028117.db2.gz NXRFMIVXAZURPF-QGZVFWFLSA-N 2 0 367.493 4.236 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2cccs2)C2CCCC2)ccn1 ZINC000090936886 1125028390 /nfs/dbraw/zinc/02/83/90/1125028390.db2.gz DIDDBUZYLLXXRU-FQEVSTJZSA-N 2 0 359.539 4.105 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000091285173 1125061791 /nfs/dbraw/zinc/06/17/91/1125061791.db2.gz GKWLQOKOPVHIAJ-JOCHJYFZSA-N 2 0 361.549 4.064 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285521 1125062455 /nfs/dbraw/zinc/06/24/55/1125062455.db2.gz YUYRXWOCPGVJFM-LIRRHRJNSA-N 2 0 370.368 4.060 20 0 FIADRP COc1ccc(OCCC[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000252176797 1125062911 /nfs/dbraw/zinc/06/29/11/1125062911.db2.gz PDCRYLAKVAUYFM-UXHICEINSA-N 2 0 360.542 4.051 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2nc3ccccc3n2C)c1 ZINC000091310349 1125064023 /nfs/dbraw/zinc/06/40/23/1125064023.db2.gz ZUPWPJJEFASTEQ-QGZVFWFLSA-N 2 0 350.510 4.264 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C(C)C)cc1 ZINC000091312906 1125064148 /nfs/dbraw/zinc/06/41/48/1125064148.db2.gz UVIAYBQVUWWAJP-JOCHJYFZSA-N 2 0 356.510 4.123 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1nc2ccccc2n1C ZINC000091313423 1125065153 /nfs/dbraw/zinc/06/51/53/1125065153.db2.gz SRGYLDCKJZMGQK-INIZCTEOSA-N 2 0 368.550 4.198 20 0 FIADRP CC(C)c1ccc(C2(O)CCC([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000181941337 1125189548 /nfs/dbraw/zinc/18/95/48/1125189548.db2.gz RZSLATLOWVXORO-RHKCVOJBSA-N 2 0 356.554 4.014 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000521435302 568014554 /nfs/dbraw/zinc/01/45/54/568014554.db2.gz ZNYSVGZBOCSQEW-LJQANCHMSA-N 2 0 374.532 4.158 20 0 FIADRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3cn(Cc4ccccc4)c4ccccc34)C2)C1 ZINC000644843138 568186424 /nfs/dbraw/zinc/18/64/24/568186424.db2.gz QOIWTKZWRNNYJY-XMMPIXPASA-N 2 0 359.517 4.217 20 0 FIADRP C[NH+](C)Cc1cccc(NC(=O)Nc2cccc(CC[NH+]3CCCC3)c2)c1 ZINC000093926075 1125542469 /nfs/dbraw/zinc/54/24/69/1125542469.db2.gz OAIUXDBZXKKWAJ-UHFFFAOYSA-N 2 0 366.509 4.031 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(CO)c(F)c2)ccc1OC ZINC000182576734 1125572876 /nfs/dbraw/zinc/57/28/76/1125572876.db2.gz HNDZPPZNVZJJOR-INIZCTEOSA-N 2 0 374.500 4.019 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000619822294 1125709936 /nfs/dbraw/zinc/70/99/36/1125709936.db2.gz KGBMONAHSDRMMU-WOJBJXKFSA-N 2 0 358.526 4.021 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)ccc1OC ZINC000182998501 1125714124 /nfs/dbraw/zinc/71/41/24/1125714124.db2.gz LEFFIMZILKWXRF-HOTGVXAUSA-N 2 0 373.541 4.424 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccsc2)cc1C[NH+]1CCCCC1 ZINC000183004012 1125717271 /nfs/dbraw/zinc/71/72/71/1125717271.db2.gz ILQYNXMJSSALJO-UZLBHIALSA-N 2 0 374.550 4.127 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CSCCS2)ccc1OC ZINC000183093662 1125749517 /nfs/dbraw/zinc/74/95/17/1125749517.db2.gz WXNKWBOJXIGAMH-YJBOKZPZSA-N 2 0 368.612 4.036 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)c1 ZINC000643547457 1079677160 /nfs/dbraw/zinc/67/71/60/1079677160.db2.gz FTJHKADCRQQSPS-NVXWUHKLSA-N 2 0 354.416 4.301 20 0 FIADRP C[C@H]([C@H](Oc1ccccc1)c1ccccc1)[N@H+](C)C[C@H]1CCCN(C)C1 ZINC001208614563 1080018856 /nfs/dbraw/zinc/01/88/56/1080018856.db2.gz FBNJRPIIVGIAGX-QTEQDKRBSA-N 2 0 352.522 4.469 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccn1 ZINC000179465837 1080181239 /nfs/dbraw/zinc/18/12/39/1080181239.db2.gz AUNITNQZLSDJTR-JQVVWYNYSA-N 2 0 367.537 4.322 20 0 FIADRP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c(C)n1 ZINC001648795329 1080792297 /nfs/dbraw/zinc/79/22/97/1080792297.db2.gz NCCIUBWPTJAJAM-GOSISDBHSA-N 2 0 367.537 4.371 20 0 FIADRP CC(C)(C)c1csc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000397485175 1080999112 /nfs/dbraw/zinc/99/91/12/1080999112.db2.gz AUXJFGBWGVAEHG-UHFFFAOYSA-N 2 0 357.567 4.442 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001648811442 1081126476 /nfs/dbraw/zinc/12/64/76/1081126476.db2.gz NXKCKGNBBGCZSW-HZPDHXFCSA-N 2 0 361.480 4.361 20 0 FIADRP COc1ccc(-c2nc(C[NH2+]CCCC[NH+]3CCC(C)CC3)cs2)cc1 ZINC001648811592 1081127541 /nfs/dbraw/zinc/12/75/41/1081127541.db2.gz QVSSIIHXEFIVMZ-UHFFFAOYSA-N 2 0 373.566 4.420 20 0 FIADRP C[N@H+](Cc1ccccc1NC1CC[NH+]([C@@H]2CCOC2)CC1)C1CCCCC1 ZINC000655746809 1081166786 /nfs/dbraw/zinc/16/67/86/1081166786.db2.gz GVFPQMVULDSKJL-JOCHJYFZSA-N 2 0 371.569 4.116 20 0 FIADRP Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CC2 ZINC000655751691 1081168858 /nfs/dbraw/zinc/16/88/58/1081168858.db2.gz QESOJOWMLPHGGX-PKTZIBPZSA-N 2 0 364.533 4.037 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]C[C@H]2CCCC(C)(C)C2)CC1 ZINC001648814395 1081218991 /nfs/dbraw/zinc/21/89/91/1081218991.db2.gz KZOVUGQOCKETBS-FQEVSTJZSA-N 2 0 357.586 4.130 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+][C@H]2CCCN3CCCC[C@@H]23)cc1 ZINC000655848506 1081257066 /nfs/dbraw/zinc/25/70/66/1081257066.db2.gz GFYYRULWEBSGFA-YYWHXJBOSA-N 2 0 372.557 4.228 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)C1 ZINC001648828686 1081265947 /nfs/dbraw/zinc/26/59/47/1081265947.db2.gz PTEQMVHCNYRYRS-NOUOYNBVSA-N 2 0 350.506 4.210 20 0 FIADRP C[N@H+](CCN1CC[NH+](CCC2CCCCCC2)CC1)Cc1ccccc1 ZINC001167337009 1081470116 /nfs/dbraw/zinc/47/01/16/1081470116.db2.gz DLRRVFLBSHHBOU-UHFFFAOYSA-N 2 0 357.586 4.097 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cnc5ccccc5c4)C[C@@H]3C2)cc1 ZINC000312640005 1081500440 /nfs/dbraw/zinc/50/04/40/1081500440.db2.gz IHBTXHZSRPHQLS-PKTZIBPZSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1ccc2cnccc2c1 ZINC000683771612 1081532426 /nfs/dbraw/zinc/53/24/26/1081532426.db2.gz XGLGZNQMGMOABG-HROJSSOGSA-N 2 0 359.517 4.481 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](Cc2nccn2C)c2ccccc2)cc1F ZINC000683772745 1081535581 /nfs/dbraw/zinc/53/55/81/1081535581.db2.gz QFLBLRHXLJPYMJ-LJQANCHMSA-N 2 0 353.441 4.032 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000580249321 1081780422 /nfs/dbraw/zinc/78/04/22/1081780422.db2.gz CICCOUJTKOCEOC-WMZHIEFXSA-N 2 0 350.506 4.053 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CCC(F)(F)CC1 ZINC000656201593 1081910900 /nfs/dbraw/zinc/91/09/00/1081910900.db2.gz SDYIYIOIEGDKAO-POZUXBRTSA-N 2 0 350.453 4.046 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cc4ccccc4[nH]3)cc2)C[C@H](C)O1 ZINC000683927263 1081928899 /nfs/dbraw/zinc/92/88/99/1081928899.db2.gz ICANOOUDXPCYFU-ROUUACIJSA-N 2 0 363.505 4.067 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000580501590 1081985463 /nfs/dbraw/zinc/98/54/63/1081985463.db2.gz LYLXFPRDHJTMJB-SIKLNZKXSA-N 2 0 352.522 4.132 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000471611342 1082093491 /nfs/dbraw/zinc/09/34/91/1082093491.db2.gz PPQLEUZMJRRHCA-BDTNDASRSA-N 2 0 356.554 4.038 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@@H]4C)CC3)CC2)c1 ZINC000581517868 1082633575 /nfs/dbraw/zinc/63/35/75/1082633575.db2.gz BLOJQRXOYSLZPN-AVRDEDQJSA-N 2 0 356.554 4.360 20 0 FIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)c1ccccc1Cl ZINC000581544905 1082653453 /nfs/dbraw/zinc/65/34/53/1082653453.db2.gz KGQGYDMSHKJKPM-QRWLVFNGSA-N 2 0 373.928 4.173 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cncc(Br)c2)c1 ZINC000581618453 1082714962 /nfs/dbraw/zinc/71/49/62/1082714962.db2.gz CMMHIAKPLABCDP-AWEZNQCLSA-N 2 0 362.315 4.147 20 0 FIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000684367036 1082768558 /nfs/dbraw/zinc/76/85/58/1082768558.db2.gz KQOFVJILNXFVFS-FGZHOGPDSA-N 2 0 352.522 4.462 20 0 FIADRP c1ccc(CC[N@H+]2CC[C@H](C[NH2+]CCSCc3ccccc3)C2)cc1 ZINC000430760094 1083154297 /nfs/dbraw/zinc/15/42/97/1083154297.db2.gz QPERIILUCLTANP-JOCHJYFZSA-N 2 0 354.563 4.074 20 0 FIADRP FC(F)(F)c1cc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc(C(F)(F)F)c1 ZINC000430921024 1083236631 /nfs/dbraw/zinc/23/66/31/1083236631.db2.gz RBGWZVZRSNKBIX-UHFFFAOYSA-N 2 0 366.349 4.300 20 0 FIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430933941 1083239824 /nfs/dbraw/zinc/23/98/24/1083239824.db2.gz MYDOUGBXYLWDDH-UHFFFAOYSA-N 2 0 353.491 4.132 20 0 FIADRP C[C@H](c1ccc(F)cc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430930254 1083240435 /nfs/dbraw/zinc/24/04/35/1083240435.db2.gz XUWSIEPSVHLUAB-GOSISDBHSA-N 3 0 361.549 4.015 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000430950883 1083251013 /nfs/dbraw/zinc/25/10/13/1083251013.db2.gz JNOPDTLXXLOCKX-SFHVURJKSA-N 2 0 360.505 4.099 20 0 FIADRP CCC[NH+]1CCC(N(C)Cc2cc(Cl)c(OCC)c(OC)c2)CC1 ZINC000092165393 1083358151 /nfs/dbraw/zinc/35/81/51/1083358151.db2.gz SQFCTNNKNYMYNU-UHFFFAOYSA-N 2 0 354.922 4.054 20 0 FIADRP CCOC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000658318694 1083405790 /nfs/dbraw/zinc/40/57/90/1083405790.db2.gz SDLCTOMDGZPNBT-ITAUSPCMSA-N 2 0 356.554 4.226 20 0 FIADRP COCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658318664 1083405923 /nfs/dbraw/zinc/40/59/23/1083405923.db2.gz RTAAYXDWVARCHR-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1cc([C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)ccc1F ZINC000658356422 1083428445 /nfs/dbraw/zinc/42/84/45/1083428445.db2.gz NXGKBRNICQDSRP-QHCPKHFHSA-N 2 0 367.512 4.330 20 0 FIADRP CCCCCn1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)n1 ZINC000548482328 1083454801 /nfs/dbraw/zinc/45/48/01/1083454801.db2.gz CWKRQROKWKOWOG-UGKGYDQZSA-N 2 0 368.569 4.382 20 0 FIADRP CCC(=O)Nc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000548483508 1083467805 /nfs/dbraw/zinc/46/78/05/1083467805.db2.gz ATFUGWZMQXYKNF-GHTZIAJQSA-N 2 0 365.521 4.035 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2C[NH+](C)C)cc1)C(C)C ZINC000548884446 1083505387 /nfs/dbraw/zinc/50/53/87/1083505387.db2.gz GTIBBFOTQTWCBR-UHFFFAOYSA-N 2 0 353.510 4.231 20 0 FIADRP Cc1cc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)ccc1C[NH+](C)C ZINC000458266852 1083791649 /nfs/dbraw/zinc/79/16/49/1083791649.db2.gz PLFROTMHORQRDS-UHFFFAOYSA-N 2 0 365.521 4.295 20 0 FIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCCC2)cc1 ZINC000132976866 1083983038 /nfs/dbraw/zinc/98/30/38/1083983038.db2.gz OFQNECJYHQBQKT-XUZZJYLKSA-N 2 0 370.581 4.269 20 0 FIADRP COc1cccc(SCC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001167506050 1084205182 /nfs/dbraw/zinc/20/51/82/1084205182.db2.gz XMODYLRFPMIAGV-FQEVSTJZSA-N 2 0 370.562 4.241 20 0 FIADRP Clc1cnc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)s1 ZINC000472071514 1084243382 /nfs/dbraw/zinc/24/33/82/1084243382.db2.gz DOTFXEPMOJKBJH-UHFFFAOYSA-N 2 0 370.349 4.452 20 0 FIADRP CCCn1nccc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000657303365 1084343492 /nfs/dbraw/zinc/34/34/92/1084343492.db2.gz NMBDLBDPZTWRDX-UHFFFAOYSA-N 2 0 362.521 4.312 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)ccc1F ZINC000431328526 1084390636 /nfs/dbraw/zinc/39/06/36/1084390636.db2.gz NLHUUKKZVVIQHQ-QFIPXVFZSA-N 2 0 368.496 4.380 20 0 FIADRP Clc1cccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)C2)c1 ZINC000414068134 1084419915 /nfs/dbraw/zinc/41/99/15/1084419915.db2.gz AWJSQCUFNMDAJQ-BLIXFSHQSA-N 2 0 362.945 4.067 20 0 FIADRP CCCn1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000657314074 1084455260 /nfs/dbraw/zinc/45/52/60/1084455260.db2.gz RANORTNQXIRPEN-RTBURBONSA-N 2 0 354.542 4.061 20 0 FIADRP CC1CC[NH+](Cc2ccc(NCc3ccnn3-c3cc[nH+]cc3)cc2)CC1 ZINC000657321446 1084552287 /nfs/dbraw/zinc/55/22/87/1084552287.db2.gz VMNARPPCLMOZGV-UHFFFAOYSA-N 2 0 361.493 4.111 20 0 FIADRP CC1(C)C[C@@H]([NH2+]CCCCC[NH2+][C@H]2CC(C)(C)OC2(C)C)C(C)(C)O1 ZINC000444631563 1084570713 /nfs/dbraw/zinc/57/07/13/1084570713.db2.gz MEDVFBPKALHPNQ-CALCHBBNSA-N 2 0 354.579 4.028 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1csc(-c2ccccc2)n1 ZINC000414106885 1084580217 /nfs/dbraw/zinc/58/02/17/1084580217.db2.gz YARHSHDONTXDKO-KSZLIROESA-N 2 0 373.566 4.350 20 0 FIADRP Cn1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)c(C2CC2)n1 ZINC000892540837 1084668763 /nfs/dbraw/zinc/66/87/63/1084668763.db2.gz RJBQYOODRKNHHK-UHFFFAOYSA-N 2 0 374.532 4.316 20 0 FIADRP COCc1csc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000657350047 1084683912 /nfs/dbraw/zinc/68/39/12/1084683912.db2.gz YWFFSOMWNZVCBM-UHFFFAOYSA-N 2 0 358.551 4.416 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cccc(Br)c21 ZINC000414145982 1084698605 /nfs/dbraw/zinc/69/86/05/1084698605.db2.gz BNWMMFITUWBTSY-SJKOYZFVSA-N 2 0 356.267 4.435 20 0 FIADRP c1ccc(CCOCCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000613422162 1084712678 /nfs/dbraw/zinc/71/26/78/1084712678.db2.gz VTRSRAGRMNNPTI-UHFFFAOYSA-N 2 0 358.570 4.224 20 0 FIADRP C[NH+]1CCC(C2CC[NH+](Cc3ccc(F)c(OC(F)(F)F)c3)CC2)CC1 ZINC001143444012 1084815780 /nfs/dbraw/zinc/81/57/80/1084815780.db2.gz XCTVRSQLXIYEQB-UHFFFAOYSA-N 2 0 374.422 4.278 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000613491929 1084829313 /nfs/dbraw/zinc/82/93/13/1084829313.db2.gz DWGDROXMLZVNED-UHFFFAOYSA-N 2 0 353.348 4.393 20 0 FIADRP c1ccc(CN2CCC([NH2+]C[C@H]3CC[C@H](c4ccccc4)O3)CC2)cc1 ZINC000582323900 1084867667 /nfs/dbraw/zinc/86/76/67/1084867667.db2.gz VWHYOAMJCMXHPQ-DHIUTWEWSA-N 2 0 350.506 4.161 20 0 FIADRP Oc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CCC2 ZINC000563309601 1084904012 /nfs/dbraw/zinc/90/40/12/1084904012.db2.gz BFBCMOUHQQEOIJ-OAQYLSRUSA-N 2 0 356.535 4.333 20 0 FIADRP C[C@H](CCOCc1ccccc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582438746 1084998877 /nfs/dbraw/zinc/99/88/77/1084998877.db2.gz BBPHOFHFLGNGJW-ZFGGDYGUSA-N 2 0 366.549 4.482 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657429697 1085003453 /nfs/dbraw/zinc/00/34/53/1085003453.db2.gz IRBPUQVJXZQRGM-VQIMIIECSA-N 2 0 351.519 4.297 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H]2CCC[NH+](CC(C)C)C2)cc1)C(C)C ZINC000448430318 1085074741 /nfs/dbraw/zinc/07/47/41/1085074741.db2.gz MPWQRMQGKJBRMK-NRFANRHFSA-N 2 0 373.585 4.015 20 0 FIADRP CC[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CO1 ZINC000657462094 1085123268 /nfs/dbraw/zinc/12/32/68/1085123268.db2.gz CKHFXPKFQKGDLR-UZQFATADSA-N 2 0 362.945 4.411 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCCc5cccnc54)[C@H]3C2)cc1 ZINC000684960966 1085325022 /nfs/dbraw/zinc/32/50/22/1085325022.db2.gz DOCPKJVLMMAVQK-CWBXHPNXSA-N 2 0 361.533 4.349 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]CCCC[NH+]2CCC(C)CC2)c2ccccc21 ZINC000549526046 1085342268 /nfs/dbraw/zinc/34/22/68/1085342268.db2.gz HAJHQXMUHFJJNE-FGZHOGPDSA-N 2 0 372.553 4.270 20 0 FIADRP COc1ncc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000582681516 1085367770 /nfs/dbraw/zinc/36/77/70/1085367770.db2.gz YIWUAVMEGBNDOG-SOLBZPMBSA-N 2 0 373.928 4.305 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651720624 1085412086 /nfs/dbraw/zinc/41/20/86/1085412086.db2.gz GKRSYZYIHYXSFU-VAMGGRTRSA-N 2 0 367.537 4.289 20 0 FIADRP c1sc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1-c1ccccc1 ZINC000657535503 1085447780 /nfs/dbraw/zinc/44/77/80/1085447780.db2.gz NLMNSIWYJVRPGT-UHFFFAOYSA-N 2 0 370.562 4.396 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cccc(OC)c1 ZINC000661468671 1085587081 /nfs/dbraw/zinc/58/70/81/1085587081.db2.gz CTCNOEVBUQFLGG-HSZRJFAPSA-N 2 0 368.521 4.158 20 0 FIADRP CCCOc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)c1 ZINC000657612899 1085697554 /nfs/dbraw/zinc/69/75/54/1085697554.db2.gz DRTDYWPHCQLNHA-UHFFFAOYSA-N 2 0 367.537 4.181 20 0 FIADRP c1ccc(C[C@@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613837 1085699581 /nfs/dbraw/zinc/69/95/81/1085699581.db2.gz SLNIOOQVXKYVAX-ZEQRLZLVSA-N 2 0 363.549 4.295 20 0 FIADRP FCC[C@@H]1CCC[NH+](Cc2cncc(C[N@H+]3CCC[C@@H](CCF)C3)c2)C1 ZINC000661690257 1085731363 /nfs/dbraw/zinc/73/13/63/1085731363.db2.gz OYJSBZIPJNDEGO-OALUTQOASA-N 2 0 365.512 4.225 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccccn2)cc1 ZINC000652202176 1085753154 /nfs/dbraw/zinc/75/31/54/1085753154.db2.gz BYNIYXCRKLWEFK-JOCHJYFZSA-N 2 0 353.510 4.035 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582844801 1085821405 /nfs/dbraw/zinc/82/14/05/1085821405.db2.gz NQBXNGREMGYUAW-IFMALSPDSA-N 3 0 357.586 4.284 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582844804 1085822541 /nfs/dbraw/zinc/82/25/41/1085822541.db2.gz NQBXNGREMGYUAW-UNMCSNQZSA-N 3 0 357.586 4.284 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)c1ccccc1Cl ZINC000582927145 1085929323 /nfs/dbraw/zinc/92/93/23/1085929323.db2.gz STEYOLCBUXAFST-XAMWDVODSA-N 2 0 351.966 4.041 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1 ZINC000236890652 1086310595 /nfs/dbraw/zinc/31/05/95/1086310595.db2.gz HRFSSTQGSUHUOD-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cnc2ccsc2c1 ZINC000162580659 1086311658 /nfs/dbraw/zinc/31/16/58/1086311658.db2.gz ZMOMFAQXWNRINZ-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2C)C1 ZINC000060526663 1086349810 /nfs/dbraw/zinc/34/98/10/1086349810.db2.gz RNDZXKCMQJVWTR-FQEVSTJZSA-N 2 0 374.532 4.279 20 0 FIADRP Fc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662282623 1086393032 /nfs/dbraw/zinc/39/30/32/1086393032.db2.gz PEBHHQGISLTZLK-GOSISDBHSA-N 2 0 352.375 4.255 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297817 1086400975 /nfs/dbraw/zinc/40/09/75/1086400975.db2.gz SGXWCTUGXKNSKY-AZUAARDMSA-N 2 0 371.569 4.157 20 0 FIADRP CC(C)Oc1ccnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167659948 1086409072 /nfs/dbraw/zinc/40/90/72/1086409072.db2.gz XYLXAZGUYHDWEC-LJQANCHMSA-N 2 0 359.558 4.345 20 0 FIADRP c1c(C2CC[NH+]([C@H]3CCCc4ccccc43)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662328720 1086420388 /nfs/dbraw/zinc/42/03/88/1086420388.db2.gz TZTLBFZMBVUMCV-QHCPKHFHSA-N 2 0 364.537 4.134 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Br)s1 ZINC000663346895 1086447765 /nfs/dbraw/zinc/44/77/65/1086447765.db2.gz WTAVIWDJWHUEBS-TZMCWYRMSA-N 2 0 357.361 4.283 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC[N@@H+]1C ZINC000165551177 1086536943 /nfs/dbraw/zinc/53/69/43/1086536943.db2.gz LYBXJEPTPYGUER-CVDCTZTESA-N 2 0 374.532 4.171 20 0 FIADRP Cc1nccn1CC[NH2+][C@H]1CCCSc2ccc(Br)cc21 ZINC000663441083 1086543640 /nfs/dbraw/zinc/54/36/40/1086543640.db2.gz VBHZDLMPQFASDA-HNNXBMFYSA-N 2 0 366.328 4.171 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH2+]C2CCN([C@@H]3CCOC3)CC2)c1 ZINC000657750129 1086552263 /nfs/dbraw/zinc/55/22/63/1086552263.db2.gz ASJVYMALVGBJKX-JOCHJYFZSA-N 2 0 350.506 4.005 20 0 FIADRP Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000663466736 1086569142 /nfs/dbraw/zinc/56/91/42/1086569142.db2.gz XHSBAJAZPWSXRM-KNKQGSTJSA-N 2 0 360.517 4.005 20 0 FIADRP c1csc([C@@H](Cc2ccncc2)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000663467043 1086569593 /nfs/dbraw/zinc/56/95/93/1086569593.db2.gz ZFCATSARAAPNIX-VQTJNVASSA-N 2 0 355.551 4.139 20 0 FIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511989783 1086582421 /nfs/dbraw/zinc/58/24/21/1086582421.db2.gz MEOUPPNUBBRVBC-ZGYCNENWSA-N 2 0 356.460 4.478 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC000511993391 1086599235 /nfs/dbraw/zinc/59/92/35/1086599235.db2.gz XIMQYFAOZPKLHL-QXUSOGCVSA-N 2 0 356.460 4.478 20 0 FIADRP CC[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000319533291 1086601610 /nfs/dbraw/zinc/60/16/10/1086601610.db2.gz BCNZSTOEAZRSTP-KRWDZBQOSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2cccs2)cc1 ZINC000150952613 1086632409 /nfs/dbraw/zinc/63/24/09/1086632409.db2.gz PSTMXFXKHMKHHY-KRWDZBQOSA-N 2 0 357.567 4.092 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CCO)Cc1ccc(Cl)c(Cl)c1 ZINC001167833390 1086664910 /nfs/dbraw/zinc/66/49/10/1086664910.db2.gz ARUKLLYLYLSGJA-OAHLLOKOSA-N 2 0 361.357 4.298 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2CCN(Cc3ccccc3)CC2(C)C)cn1 ZINC000583453748 1086697397 /nfs/dbraw/zinc/69/73/97/1086697397.db2.gz FGJSGKLGTDHGJB-JOCHJYFZSA-N 2 0 351.538 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2ccc(C)cc2OC)CC1 ZINC001167836757 1086708920 /nfs/dbraw/zinc/70/89/20/1086708920.db2.gz GSTNGFGKTRPUNV-LJQANCHMSA-N 2 0 362.558 4.357 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N2CCc3ccccc3C2)CC1 ZINC001167836741 1086709014 /nfs/dbraw/zinc/70/90/14/1086709014.db2.gz GMYFCUXMYXEKTP-HXUWFJFHSA-N 2 0 357.586 4.020 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2ccc(C)cc2OC)CC1 ZINC001167836756 1086709396 /nfs/dbraw/zinc/70/93/96/1086709396.db2.gz GSTNGFGKTRPUNV-IBGZPJMESA-N 2 0 362.558 4.357 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)n1nc(C2CC[NH2+]CC2)c2ccc(F)cc21 ZINC001167838702 1086714249 /nfs/dbraw/zinc/71/42/49/1086714249.db2.gz WFUCTNVINPQFDV-INIZCTEOSA-N 2 0 360.521 4.325 20 0 FIADRP CCOC(=O)[C@H]1CC[N@@H+]([C@H](C)CCC[NH+](CC)CC)C[C@H]1c1ccccc1 ZINC001167838963 1086714438 /nfs/dbraw/zinc/71/44/38/1086714438.db2.gz XGHVPSOOFHPCPE-HJNYFJLDSA-N 2 0 374.569 4.166 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCc2ccc(OC(F)(F)F)cc2C1 ZINC001167840018 1086719587 /nfs/dbraw/zinc/71/95/87/1086719587.db2.gz DHECHADXYFMVRM-HNNXBMFYSA-N 2 0 358.448 4.454 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 ZINC001167841614 1086738330 /nfs/dbraw/zinc/73/83/30/1086738330.db2.gz NDJQVMKAMNNORW-GHTZIAJQSA-N 2 0 369.594 4.218 20 0 FIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432424574 1086748811 /nfs/dbraw/zinc/74/88/11/1086748811.db2.gz PGUFCYTUUKMARB-GHTZIAJQSA-N 2 0 360.542 4.114 20 0 FIADRP Brc1cccc(C2CC([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000432425512 1086752379 /nfs/dbraw/zinc/75/23/79/1086752379.db2.gz MYWRCMXBLDZMEA-UHFFFAOYSA-N 2 0 363.343 4.159 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCC[C@H]1[C@@H](C(=O)OC)c1ccccc1 ZINC001167842530 1086754525 /nfs/dbraw/zinc/75/45/25/1086754525.db2.gz YJMKLDZTSYWLCP-BVSLBCMMSA-N 2 0 374.569 4.308 20 0 FIADRP Clc1ccc2c(ccn2CCN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000583528304 1086770660 /nfs/dbraw/zinc/77/06/60/1086770660.db2.gz NVVLAHKOHABPDL-LAUBAEHRSA-N 2 0 357.929 4.243 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)cn1 ZINC000512113483 1086782979 /nfs/dbraw/zinc/78/29/79/1086782979.db2.gz DGIYRKPLRGRHQK-OALUTQOASA-N 2 0 351.538 4.412 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657773615 1086829063 /nfs/dbraw/zinc/82/90/63/1086829063.db2.gz UDTYLCVBBCTCEZ-OAQYLSRUSA-N 2 0 374.532 4.035 20 0 FIADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(Br)cc1C(F)(F)F ZINC000650747159 1086934570 /nfs/dbraw/zinc/93/45/70/1086934570.db2.gz SZLCSSXKHYYAIH-JTQLQIEISA-N 2 0 365.237 4.248 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(SCC(F)F)cc1 ZINC000650753755 1086957948 /nfs/dbraw/zinc/95/79/48/1086957948.db2.gz VAZSDEGYQWANRG-LBPRGKRZSA-N 2 0 354.441 4.492 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCc2c1ccc(F)c2Br ZINC000650756036 1086964344 /nfs/dbraw/zinc/96/43/44/1086964344.db2.gz SAVGPJYSRLEJLW-KRWDZBQOSA-N 2 0 363.274 4.085 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(Br)ccc1F ZINC000650757979 1086971424 /nfs/dbraw/zinc/97/14/24/1086971424.db2.gz FZOLCDOUECRMMW-GFCCVEGCSA-N 2 0 351.263 4.158 20 0 FIADRP CCc1[nH+]c2ccccc2c(N2CCC(OCC[NH+]3CCCC3)CC2)c1C ZINC000548811806 1086978252 /nfs/dbraw/zinc/97/82/52/1086978252.db2.gz ZCXSZTOUJKGLAA-UHFFFAOYSA-N 2 0 367.537 4.187 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Br)cc2Cl)CC1 ZINC000566728748 1086990211 /nfs/dbraw/zinc/99/02/11/1086990211.db2.gz KYHHCXLCKBEIKG-WBMJQRKESA-N 2 0 371.750 4.064 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)c2ccc(F)cc2)CC1 ZINC000583879550 1087009036 /nfs/dbraw/zinc/00/90/36/1087009036.db2.gz LHFYNMLCGNFYRQ-QHCPKHFHSA-N 3 0 373.560 4.230 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2CCn4ccnc4C2)CCC3)cc1 ZINC000427900204 1087027488 /nfs/dbraw/zinc/02/74/88/1087027488.db2.gz YILMHWXQKDTATR-CVEARBPZSA-N 2 0 368.481 4.128 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CCC4(CCCO4)CC3)cc2)C1 ZINC000583969159 1087069975 /nfs/dbraw/zinc/06/99/75/1087069975.db2.gz NPYPBFSYYFKWGG-YUVSOPLDSA-N 2 0 356.554 4.500 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Cl)cc1 ZINC000132781379 1087103053 /nfs/dbraw/zinc/10/30/53/1087103053.db2.gz ONESYPRKFNAXKY-INIZCTEOSA-N 2 0 358.913 4.148 20 0 FIADRP CCCCOc1cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000584105797 1087175954 /nfs/dbraw/zinc/17/59/54/1087175954.db2.gz QCYXLLOAZICNGT-FQEVSTJZSA-N 2 0 360.542 4.038 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2CCCn3nccc32)cc1 ZINC000657832376 1087199208 /nfs/dbraw/zinc/19/92/08/1087199208.db2.gz JFQVJGUCZLIDNY-JOCHJYFZSA-N 2 0 360.505 4.236 20 0 FIADRP C[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1cccc(-n2ccnc2)c1 ZINC000151676043 1087203886 /nfs/dbraw/zinc/20/38/86/1087203886.db2.gz ZPDGJPSYSQOGJL-FQEVSTJZSA-N 2 0 374.532 4.230 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cncc(Br)c1 ZINC000657838497 1087250285 /nfs/dbraw/zinc/25/02/85/1087250285.db2.gz BRWLJCREZFLJAT-OWCLPIDISA-N 2 0 368.363 4.253 20 0 FIADRP FC(F)(F)c1ccccc1OCC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000089552121 1087395258 /nfs/dbraw/zinc/39/52/58/1087395258.db2.gz MGDZLKKAKFDUTB-UHFFFAOYSA-N 2 0 356.432 4.081 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000090936599 1087411100 /nfs/dbraw/zinc/41/11/00/1087411100.db2.gz AGWQLXYDAYOESO-SFHVURJKSA-N 2 0 374.569 4.269 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC1 ZINC000091285543 1087427262 /nfs/dbraw/zinc/42/72/62/1087427262.db2.gz IRVIQSILHTYCJW-QFBILLFUSA-N 2 0 371.491 4.018 20 0 FIADRP c1cc2n(n1)CCC[C@@H]2[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000657878615 1087521806 /nfs/dbraw/zinc/52/18/06/1087521806.db2.gz YFNMDWCUVPTQAX-QFIPXVFZSA-N 2 0 366.553 4.043 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccc5cnccc5c4)C3)C2)cc1 ZINC000685443046 1087569402 /nfs/dbraw/zinc/56/94/02/1087569402.db2.gz KYLFULFSFIJGJY-XMMPIXPASA-N 2 0 357.501 4.333 20 0 FIADRP Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1ccc(OCC[NH+](C)C)cc1 ZINC000685463626 1087575618 /nfs/dbraw/zinc/57/56/18/1087575618.db2.gz RKLONEQZHPFMCP-NRFANRHFSA-N 2 0 370.541 4.084 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nn(C)c3ccccc23)CC1)CC(C)C ZINC000685462603 1087575778 /nfs/dbraw/zinc/57/57/78/1087575778.db2.gz DEFFYOBEUIPWDV-UHFFFAOYSA-N 2 0 356.558 4.153 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]C3CC[NH+](C(C)C)CC3)cc2cc1OC ZINC000657908089 1087613544 /nfs/dbraw/zinc/61/35/44/1087613544.db2.gz HDMQYGPUQSBYBL-MRXNPFEDSA-N 2 0 356.510 4.380 20 0 FIADRP CCOc1ccccc1CC[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508720458 1087622425 /nfs/dbraw/zinc/62/24/25/1087622425.db2.gz MSZNWCUQRTZMQK-KNQAVFIVSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685661498 1087666206 /nfs/dbraw/zinc/66/62/06/1087666206.db2.gz UOPUZMXIEIOQDU-LSUHJGNXSA-N 2 0 364.533 4.407 20 0 FIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067172 1087710540 /nfs/dbraw/zinc/71/05/40/1087710540.db2.gz LBCLZQGDULUNQE-OAHLLOKOSA-N 2 0 365.587 4.117 20 0 FIADRP CC(C)COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068675 1087710558 /nfs/dbraw/zinc/71/05/58/1087710558.db2.gz HILQTQWRHKYZCF-LJQANCHMSA-N 2 0 374.569 4.263 20 0 FIADRP CCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(OC)cc1 ZINC000658069933 1087710857 /nfs/dbraw/zinc/71/08/57/1087710857.db2.gz RQNFUYJMVOPXPV-QFIPXVFZSA-N 2 0 360.542 4.017 20 0 FIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658069967 1087710905 /nfs/dbraw/zinc/71/09/05/1087710905.db2.gz SHBJJIYOGIKYNW-QGZVFWFLSA-N 2 0 356.510 4.283 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccnc3ccccc23)CC1 ZINC000658128201 1087733590 /nfs/dbraw/zinc/73/35/90/1087733590.db2.gz TYBZJLJGFULGBQ-WZONZLPQSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc2ccccc2c1 ZINC000658147227 1087739233 /nfs/dbraw/zinc/73/92/33/1087739233.db2.gz XJPLDLDNVGOSLW-HOYKHHGWSA-N 2 0 360.501 4.257 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](CC3CCC3)c3ccccc3)cc2)C1 ZINC000658136273 1087742753 /nfs/dbraw/zinc/74/27/53/1087742753.db2.gz GMMGYRRLRAIDNE-BJKOFHAPSA-N 2 0 364.533 4.274 20 0 FIADRP CC1(C)CC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c2ccccc21 ZINC000658138411 1087743321 /nfs/dbraw/zinc/74/33/21/1087743321.db2.gz MXSKEEOFZTZICA-NZQKXSOJSA-N 2 0 364.533 4.156 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(F)ccc1F ZINC000658164845 1087760462 /nfs/dbraw/zinc/76/04/62/1087760462.db2.gz FVDVOGCTKMIHRP-OAQYLSRUSA-N 2 0 359.464 4.313 20 0 FIADRP CCO[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C12CCCCC2 ZINC000658166761 1087761461 /nfs/dbraw/zinc/76/14/61/1087761461.db2.gz ONHFFQABZVIDTF-VXKWHMMOSA-N 2 0 371.569 4.011 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCCO2 ZINC000658167303 1087765181 /nfs/dbraw/zinc/76/51/81/1087765181.db2.gz RLMMUJCYRJXGMJ-QFIPXVFZSA-N 2 0 365.521 4.106 20 0 FIADRP c1ccc2c(c1)SCC[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167228 1087765349 /nfs/dbraw/zinc/76/53/49/1087765349.db2.gz QVDPRPMHBNIWPI-HXUWFJFHSA-N 2 0 353.535 4.120 20 0 FIADRP CC(C)n1cncc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000424138732 1087787067 /nfs/dbraw/zinc/78/70/67/1087787067.db2.gz USBMPUSEMBOJDJ-KDURUIRLSA-N 2 0 354.542 4.232 20 0 FIADRP COCc1csc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000658209635 1087795659 /nfs/dbraw/zinc/79/56/59/1087795659.db2.gz IOGLQZBVELVBLF-OWZKRDHZSA-N 2 0 356.535 4.180 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)CC1 ZINC000472590795 1087874294 /nfs/dbraw/zinc/87/42/94/1087874294.db2.gz OILRTZMNVCJHIO-SFHVURJKSA-N 2 0 363.977 4.282 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424280371 1087909917 /nfs/dbraw/zinc/90/99/17/1087909917.db2.gz HEWBRGRPJNWZME-UXHICEINSA-N 2 0 357.567 4.385 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]C[C@H]3CCCC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424343562 1087953680 /nfs/dbraw/zinc/95/36/80/1087953680.db2.gz FTIAOXXFZRAASJ-VROINQGHSA-N 2 0 356.554 4.082 20 0 FIADRP [NH3+]C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@H]1c1ccccc1 ZINC000647536428 1087964574 /nfs/dbraw/zinc/96/45/74/1087964574.db2.gz QQSGNQQJJDMABB-QUCCMNQESA-N 2 0 355.551 4.365 20 0 FIADRP Cc1ccc(Cn2cc(C[NH2+]C3CC[NH2+]CC3)c(-c3ccc(C)cc3)n2)cc1 ZINC000414790685 1088010401 /nfs/dbraw/zinc/01/04/01/1088010401.db2.gz PQVSVYGFYBPGDN-UHFFFAOYSA-N 2 0 374.532 4.057 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)CCC2)c1 ZINC000647551089 1088065910 /nfs/dbraw/zinc/06/59/10/1088065910.db2.gz XUJFNDAJPVIMEW-RVKKMQEKSA-N 2 0 352.444 4.105 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000414808550 1088182384 /nfs/dbraw/zinc/18/23/84/1088182384.db2.gz KZNBQNIJXIKOQT-AWEZNQCLSA-N 2 0 374.410 4.201 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414809343 1088190462 /nfs/dbraw/zinc/19/04/62/1088190462.db2.gz MFKDYJVGITWYTH-CQSZACIVSA-N 2 0 368.912 4.452 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1)c1ccccc1Cl ZINC000414833539 1088369506 /nfs/dbraw/zinc/36/95/06/1088369506.db2.gz GIEODKZUEZTWFY-INIZCTEOSA-N 2 0 371.912 4.072 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)ccc1OCc1ccc(Cl)cc1 ZINC000414834718 1088391936 /nfs/dbraw/zinc/39/19/36/1088391936.db2.gz QSUOKZDFEGALJU-INIZCTEOSA-N 2 0 374.912 4.017 20 0 FIADRP CCOCOc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000782954112 1088733281 /nfs/dbraw/zinc/73/32/81/1088733281.db2.gz XCCSQWHKUNVCAI-UHFFFAOYSA-N 2 0 368.521 4.061 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(COCc3ccccc3)c2)[C@H]2CCC[C@@H]21 ZINC000514090568 1088735237 /nfs/dbraw/zinc/73/52/37/1088735237.db2.gz VLBBGXOMWHMGAV-SGNDLWITSA-N 2 0 364.533 4.366 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc21 ZINC000549145877 1089015676 /nfs/dbraw/zinc/01/56/76/1089015676.db2.gz IBSUDADSQDHTNY-MOPGFXCFSA-N 2 0 358.526 4.067 20 0 FIADRP COc1cccc(COc2cccc(Cl)c2C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000415015617 1089043823 /nfs/dbraw/zinc/04/38/23/1089043823.db2.gz AYNUOFLKBHJHSW-OAHLLOKOSA-N 2 0 362.901 4.145 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c(-c2ccccc2Cl)n1 ZINC000415029513 1089058689 /nfs/dbraw/zinc/05/86/89/1089058689.db2.gz DPOGLMIKYKAREG-ZBFHGGJFSA-N 2 0 360.933 4.176 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415049267 1089084997 /nfs/dbraw/zinc/08/49/97/1089084997.db2.gz XROLECQLZPREDO-NZQKXSOJSA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000415046866 1089093391 /nfs/dbraw/zinc/09/33/91/1089093391.db2.gz VLDICKKDPIPOLS-RISCZKNCSA-N 2 0 355.429 4.046 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1 ZINC000415060460 1089095623 /nfs/dbraw/zinc/09/56/23/1089095623.db2.gz WVDTZHPNZIKDRB-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(OCc2ccncc2)cc1)c1ccccc1 ZINC000415054870 1089102487 /nfs/dbraw/zinc/10/24/87/1089102487.db2.gz NYARAZMILSBUNA-HSZRJFAPSA-N 2 0 361.489 4.230 20 0 FIADRP [NH3+]CC1CCC([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC1 ZINC000415083493 1089140824 /nfs/dbraw/zinc/14/08/24/1089140824.db2.gz FQTNBOLJPSBLQE-UHFFFAOYSA-N 2 0 371.352 4.149 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cn2)c1 ZINC000415107317 1089168707 /nfs/dbraw/zinc/16/87/07/1089168707.db2.gz NQPGKINCARXWDM-XUVXKRRUSA-N 2 0 355.457 4.023 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000415116689 1089176211 /nfs/dbraw/zinc/17/62/11/1089176211.db2.gz IADUUJLXLKHUBZ-PWRODBHTSA-N 2 0 352.526 4.006 20 0 FIADRP Cc1ccc(-c2cccc(C[NH+]3CCC([C@@H]4C[C@H]([NH3+])CCO4)CC3)c2)cc1 ZINC000415126091 1089179808 /nfs/dbraw/zinc/17/98/08/1089179808.db2.gz PCUFXKGOXFUNGU-RPWUZVMVSA-N 2 0 364.533 4.380 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CC2([NH3+])CCCCCC2)c(Cl)c1 ZINC000414862623 1089196817 /nfs/dbraw/zinc/19/68/17/1089196817.db2.gz VRFCEFDXYCIYGY-HNNXBMFYSA-N 2 0 351.922 4.007 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc3c2OCC[C@H]3[NH+](C)C)C1 ZINC000435041290 1089216795 /nfs/dbraw/zinc/21/67/95/1089216795.db2.gz IPQWDEMQFGRQMK-SFGWALBWSA-N 2 0 365.521 4.319 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccnn1C ZINC000549235820 1089314095 /nfs/dbraw/zinc/31/40/95/1089314095.db2.gz OSSBBAZTZNPMJD-VLCCKYJDSA-N 2 0 372.944 4.338 20 0 FIADRP FC(F)(F)c1cncc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167958477 1089438822 /nfs/dbraw/zinc/43/88/22/1089438822.db2.gz FPRSGVUHEALUFC-YQQQUEKLSA-N 2 0 367.459 4.028 20 0 FIADRP Cc1ccccc1[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccncc1 ZINC001167958519 1089462110 /nfs/dbraw/zinc/46/21/10/1089462110.db2.gz GPSXWTIURXFHAW-PQFKCJEGSA-N 2 0 361.533 4.474 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435369365 1089579956 /nfs/dbraw/zinc/57/99/56/1089579956.db2.gz DVZUXZMESFZNDK-WBVHZDCISA-N 2 0 371.912 4.152 20 0 FIADRP c1cc(C[N@H+](Cc2cnc3ccccc3c2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000435429687 1089647435 /nfs/dbraw/zinc/64/74/35/1089647435.db2.gz YNGSPHCHFLGAJG-OAQYLSRUSA-N 2 0 363.530 4.441 20 0 FIADRP C[C@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311980294 1089735531 /nfs/dbraw/zinc/73/55/31/1089735531.db2.gz MQDDGMXLLGFDIG-MBSDFSHPSA-N 2 0 350.506 4.184 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000314555397 1089966216 /nfs/dbraw/zinc/96/62/16/1089966216.db2.gz SMCALHDNXBEMKY-QGZVFWFLSA-N 2 0 351.332 4.289 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000163937512 1090280124 /nfs/dbraw/zinc/28/01/24/1090280124.db2.gz BICOZYLOIZBTHV-DWXRJYCRSA-N 2 0 370.562 4.261 20 0 FIADRP CC(C)c1ccc(C2(O)CCC([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000181941359 1090318110 /nfs/dbraw/zinc/31/81/10/1090318110.db2.gz RZSLATLOWVXORO-FBHNJWQJSA-N 2 0 356.554 4.014 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnc3ccccc3n2)CC1 ZINC000660007087 1090399688 /nfs/dbraw/zinc/39/96/88/1090399688.db2.gz YWBOXEQKLIDBLU-GOSISDBHSA-N 2 0 352.526 4.106 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CCCO1 ZINC000584759983 1090845082 /nfs/dbraw/zinc/84/50/82/1090845082.db2.gz BOMNJVSWNMSBOW-CVDCTZTESA-N 2 0 370.512 4.200 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccnc(OCc2ccccc2)c1)c1ccccc1 ZINC000925604903 1090890522 /nfs/dbraw/zinc/89/05/22/1090890522.db2.gz BPJMCPAOJIXTNW-JOCHJYFZSA-N 2 0 361.489 4.230 20 0 FIADRP FC(F)(F)c1cccc([C@H]2CCC[C@H]2[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000584830511 1090925796 /nfs/dbraw/zinc/92/57/96/1090925796.db2.gz SCNYSZSGPKYBQG-RTBURBONSA-N 2 0 370.459 4.044 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)cs2)cc1 ZINC000584830840 1090926814 /nfs/dbraw/zinc/92/68/14/1090926814.db2.gz SFPCQWMMTMREDR-HNNXBMFYSA-N 2 0 360.523 4.227 20 0 FIADRP Cc1ccncc1CCC[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000584871325 1090962019 /nfs/dbraw/zinc/96/20/19/1090962019.db2.gz SPDCCLGFZGTDSX-QFIPXVFZSA-N 2 0 351.538 4.215 20 0 FIADRP CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000500086768 1091029243 /nfs/dbraw/zinc/02/92/43/1091029243.db2.gz DQTKVMDTCRIDQP-FPOVZHCZSA-N 2 0 361.574 4.031 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1cc(C[NH+](C)C)ccc1Br ZINC001167753466 1091171100 /nfs/dbraw/zinc/17/11/00/1091171100.db2.gz ITKKFCHHZWUZON-OAHLLOKOSA-N 2 0 368.363 4.187 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000500386144 1091398360 /nfs/dbraw/zinc/39/83/60/1091398360.db2.gz TVRZMVXRANJORP-KRWDZBQOSA-N 2 0 365.512 4.132 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000390685390 1091400193 /nfs/dbraw/zinc/40/01/93/1091400193.db2.gz XPVVBLFSSASETL-GCJKJVERSA-N 2 0 352.522 4.214 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000388542623 1091509885 /nfs/dbraw/zinc/50/98/85/1091509885.db2.gz RSXFTXKBFWWFQN-SIKLNZKXSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ncc(Br)cc1F ZINC000187201232 1091854553 /nfs/dbraw/zinc/85/45/53/1091854553.db2.gz MZBFGVFQZRVOJW-CQSZACIVSA-N 2 0 372.326 4.290 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(F)c3cccnc23)C1 ZINC000512215146 1091915453 /nfs/dbraw/zinc/91/54/53/1091915453.db2.gz VLYURKBVOBYDQF-MSOLQXFVSA-N 2 0 355.501 4.460 20 0 FIADRP CCC1(C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCOCC1 ZINC000512376874 1092188760 /nfs/dbraw/zinc/18/87/60/1092188760.db2.gz CYKSEMOFQLNMNX-UHFFFAOYSA-N 2 0 358.570 4.475 20 0 FIADRP Cc1cc(N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428166785 1092219470 /nfs/dbraw/zinc/21/94/70/1092219470.db2.gz STHQMSRRQKCQLQ-KSSFIOAISA-N 2 0 361.436 4.065 20 0 FIADRP C[C@@H]1C[C@@H](NC(=[NH2+])c2ccc(F)c(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011996 1092314564 /nfs/dbraw/zinc/31/45/64/1092314564.db2.gz UUMDZNQBZNIULO-JLVBRIDZSA-N 2 0 357.448 4.321 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1 ZINC000520965631 1092391118 /nfs/dbraw/zinc/39/11/18/1092391118.db2.gz OPJSSWOHYSCZJO-UHFFFAOYSA-N 2 0 351.288 4.141 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000521043695 1092443071 /nfs/dbraw/zinc/44/30/71/1092443071.db2.gz HSCYQSIVNPZOHM-DENIHFKCSA-N 2 0 374.532 4.076 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)c1ccc(C[NH3+])cc1)C1CCCCC1 ZINC000237167368 1092466240 /nfs/dbraw/zinc/46/62/40/1092466240.db2.gz MOEUSPZQZBFHDB-UHFFFAOYSA-N 2 0 351.494 4.162 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC(C(F)F)CC3)cc2)C[C@H](C)O1 ZINC000442723086 1092747911 /nfs/dbraw/zinc/74/79/11/1092747911.db2.gz WSWCAUXUTXCJSY-MVYVIFSASA-N 2 0 366.496 4.209 20 0 FIADRP CCC[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000442872582 1092819772 /nfs/dbraw/zinc/81/97/72/1092819772.db2.gz JUNMTAMBLFEZNC-SFHVURJKSA-N 2 0 371.491 4.162 20 0 FIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2cccs2)cc1 ZINC000442890525 1092844796 /nfs/dbraw/zinc/84/47/96/1092844796.db2.gz ONFPCDFEXYCOPA-QGZVFWFLSA-N 2 0 357.567 4.092 20 0 FIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000442921945 1092867887 /nfs/dbraw/zinc/86/78/87/1092867887.db2.gz OBERUUIHGYGXPN-INIZCTEOSA-N 2 0 371.912 4.153 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000442991807 1092901133 /nfs/dbraw/zinc/90/11/33/1092901133.db2.gz MPIZVCCYUJEHLR-CQSZACIVSA-N 2 0 374.410 4.488 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+]CC3=Cc4ccccc4OC3)c2)CC1 ZINC000521827550 1092931369 /nfs/dbraw/zinc/93/13/69/1092931369.db2.gz PBFHWAOOYNASTA-UHFFFAOYSA-N 2 0 362.517 4.484 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)C[N@@H+]1Cc1ccccc1 ZINC000474039829 1092951221 /nfs/dbraw/zinc/95/12/21/1092951221.db2.gz TWOLZINXHHLXJL-MENZVKOBSA-N 2 0 370.581 4.472 20 0 FIADRP COCc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000521918126 1092972077 /nfs/dbraw/zinc/97/20/77/1092972077.db2.gz XCKFSAGRMSDWSO-UHFFFAOYSA-N 2 0 352.522 4.366 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(Cn3ccnc3)cc2)cc1 ZINC000152107434 1092994528 /nfs/dbraw/zinc/99/45/28/1092994528.db2.gz AWKCHMICSBSRCX-GOSISDBHSA-N 2 0 371.488 4.276 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H](O)c2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168015829 1093038802 /nfs/dbraw/zinc/03/88/02/1093038802.db2.gz SMWQPCYCNSNXRW-IYRWYFENSA-N 2 0 352.522 4.141 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000512653422 1093079614 /nfs/dbraw/zinc/07/96/14/1093079614.db2.gz FDPWQVLRHVWNDA-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000512659448 1093095276 /nfs/dbraw/zinc/09/52/76/1093095276.db2.gz HATYFYVYOVJUAI-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1cccc(OCC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168018208 1093164754 /nfs/dbraw/zinc/16/47/54/1093164754.db2.gz YWPSSAPWSGNQEX-WOJBJXKFSA-N 2 0 352.522 4.405 20 0 FIADRP C[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)C1CCC(F)(F)CC1 ZINC000474073798 1093188763 /nfs/dbraw/zinc/18/87/63/1093188763.db2.gz PDXVQXKOHHFRJK-KRWDZBQOSA-N 2 0 350.497 4.497 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000469787217 1093295704 /nfs/dbraw/zinc/29/57/04/1093295704.db2.gz NXVTZHCUEIOBTF-WIYYLYMNSA-N 2 0 364.599 4.414 20 0 FIADRP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC000648416173 1093341748 /nfs/dbraw/zinc/34/17/48/1093341748.db2.gz ZAPAOMSNCMALDR-YADHBBJMSA-N 2 0 352.522 4.462 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1)c1ccccc1 ZINC000474149744 1093466053 /nfs/dbraw/zinc/46/60/53/1093466053.db2.gz JREQVDQYHCEHOT-CQOQZXRMSA-N 2 0 371.613 4.307 20 0 FIADRP C[C@H]1CC([NH2+]C[C@@H](O)c2cccc(Cl)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168026977 1093501371 /nfs/dbraw/zinc/50/13/71/1093501371.db2.gz MVQFNTWMTTYRMM-PNLZDCPESA-N 2 0 372.940 4.405 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cn(C)nc3-c3ccccc3)CC2)CC1 ZINC000093109991 1093590723 /nfs/dbraw/zinc/59/07/23/1093590723.db2.gz ZTNDBUIBPDCVHS-UHFFFAOYSA-N 2 0 366.553 4.220 20 0 FIADRP CC(C)C[NH+]1CCC(NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168031239 1093615728 /nfs/dbraw/zinc/61/57/28/1093615728.db2.gz YEFZJPMZTYLZBF-WOJBJXKFSA-N 2 0 357.586 4.138 20 0 FIADRP Cc1ccc(C2(C[NH2+]C3C[C@@H](C)[NH+](Cc4ccccc4)[C@H](C)C3)CC2)nc1 ZINC001168032241 1093652359 /nfs/dbraw/zinc/65/23/59/1093652359.db2.gz GVLNLSZCGAFLHG-WOJBJXKFSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H]2CC[NH+](C3CCCC3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032981 1093681172 /nfs/dbraw/zinc/68/11/72/1093681172.db2.gz JHHOUJFWGZETEP-NPDDRXJXSA-N 2 0 355.570 4.035 20 0 FIADRP c1ccc(CC[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccn2)cc1 ZINC000639363230 1093695731 /nfs/dbraw/zinc/69/57/31/1093695731.db2.gz NNWDYISOUJQRMV-DEOSSOPVSA-N 2 0 372.516 4.409 20 0 FIADRP COCc1ccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001168034495 1093753888 /nfs/dbraw/zinc/75/38/88/1093753888.db2.gz PTLIUIKOECLLFF-RTBURBONSA-N 2 0 352.522 4.364 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1 ZINC000513343165 1094076178 /nfs/dbraw/zinc/07/61/78/1094076178.db2.gz NIHMSUVTOVQTQV-FQEVSTJZSA-N 2 0 360.448 4.072 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)[NH+]2CCCC2)o1 ZINC000513495137 1094162831 /nfs/dbraw/zinc/16/28/31/1094162831.db2.gz ZXCQFUQPMAQSGS-QIJUGHKUSA-N 2 0 373.585 4.358 20 0 FIADRP COCc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513498945 1094172159 /nfs/dbraw/zinc/17/21/59/1094172159.db2.gz CTWRQCDPIKBCIH-AUSIDOKSSA-N 2 0 352.522 4.223 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1OC ZINC000513499811 1094172989 /nfs/dbraw/zinc/17/29/89/1094172989.db2.gz IXZCODLMEVSWNO-WIYYLYMNSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000513499327 1094173232 /nfs/dbraw/zinc/17/32/32/1094173232.db2.gz FQXXNXZCCYTYDZ-DEOSSOPVSA-N 2 0 374.532 4.392 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1 ZINC000513525021 1094197525 /nfs/dbraw/zinc/19/75/25/1094197525.db2.gz JGYREUOLJNPIPO-OAQYLSRUSA-N 2 0 374.475 4.463 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCSc3ccc(Br)cc32)CC1 ZINC000513679061 1094277643 /nfs/dbraw/zinc/27/76/43/1094277643.db2.gz UNFMRLQCXKBCLP-XUJLQICISA-N 2 0 369.372 4.448 20 0 FIADRP Cc1cccc(C2(C[NH2+]C3C[C@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)CC2)n1 ZINC001168036910 1094326760 /nfs/dbraw/zinc/32/67/60/1094326760.db2.gz XVJJFYKFRUHHAR-PMACEKPBSA-N 2 0 363.549 4.453 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000116078970 1094391501 /nfs/dbraw/zinc/39/15/01/1094391501.db2.gz RZDZMHXQGGRHRT-UHFFFAOYSA-N 2 0 363.505 4.131 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000513703686 1094410394 /nfs/dbraw/zinc/41/03/94/1094410394.db2.gz YTAFXKCLPSWFPR-FSSWDIPSSA-N 2 0 350.506 4.195 20 0 FIADRP C[N@@H+](Cc1cccc(OC(F)F)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501027671 1094444590 /nfs/dbraw/zinc/44/45/90/1094444590.db2.gz KVIJLRLEFNLKIV-UHFFFAOYSA-N 2 0 361.436 4.031 20 0 FIADRP C[N@@H+](Cc1ncc(Cl)cc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049409 1094456287 /nfs/dbraw/zinc/45/62/87/1094456287.db2.gz YZSZKQOZRSQTCJ-UHFFFAOYSA-N 2 0 365.308 4.132 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000501137698 1094524917 /nfs/dbraw/zinc/52/49/17/1094524917.db2.gz WJDKYVMIUPTRIT-MRXNPFEDSA-N 2 0 372.384 4.402 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000467295215 1094567714 /nfs/dbraw/zinc/56/77/14/1094567714.db2.gz KNHNSYNGASRXCU-NRFANRHFSA-N 2 0 356.485 4.452 20 0 FIADRP C[NH+](CCC(F)(F)F)Cc1ccccc1C[N@H+](C)CCC(F)(F)F ZINC000098136923 1094570754 /nfs/dbraw/zinc/57/07/54/1094570754.db2.gz CGMRPAJEEIMBSX-UHFFFAOYSA-N 2 0 356.354 4.455 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)CC1 ZINC000474815135 1094659314 /nfs/dbraw/zinc/65/93/14/1094659314.db2.gz WCJMGYUAKSKSEM-UHFFFAOYSA-N 2 0 364.574 4.131 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1OC ZINC000474818616 1094665374 /nfs/dbraw/zinc/66/53/74/1094665374.db2.gz UFSRATKZVORNJL-HZPDHXFCSA-N 2 0 374.500 4.186 20 0 FIADRP c1cc(C[N@@H+](CCCCC2CCOCC2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000420320631 1094881816 /nfs/dbraw/zinc/88/18/16/1094881816.db2.gz YUCJSGMHYCFWPE-FQEVSTJZSA-N 2 0 362.583 4.289 20 0 FIADRP CC[N@H+](Cc1cc(C)nc(-c2ccc(Cl)cc2)n1)[C@@H]1CCC[NH2+]CC1 ZINC000420318071 1094882345 /nfs/dbraw/zinc/88/23/45/1094882345.db2.gz VOIAKVPGLDILRF-LJQANCHMSA-N 2 0 358.917 4.069 20 0 FIADRP Clc1ccccc1-c1csc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)n1 ZINC000420322108 1094883733 /nfs/dbraw/zinc/88/37/33/1094883733.db2.gz WCRNAGIRDRTVDK-OAHLLOKOSA-N 2 0 361.942 4.285 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000420372342 1094903510 /nfs/dbraw/zinc/90/35/10/1094903510.db2.gz FEBKXAOJSVOOGB-MJGOQNOKSA-N 2 0 368.974 4.041 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](CCCSc3ccccc3Cl)CC2)C1 ZINC000420383128 1094907053 /nfs/dbraw/zinc/90/70/53/1094907053.db2.gz FDCUYIIJKXPWCV-SJLPKXTDSA-N 2 0 368.974 4.041 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1)c1ccccc1 ZINC000474935484 1094933718 /nfs/dbraw/zinc/93/37/18/1094933718.db2.gz VEOCRKZRYNZNJU-HSZRJFAPSA-N 2 0 371.613 4.166 20 0 FIADRP C[N@@H+](CC1=Cc2cc(Cl)cc(Cl)c2OC1)CC1CC[NH+](C)CC1 ZINC000513742017 1095367572 /nfs/dbraw/zinc/36/75/72/1095367572.db2.gz SMBCWBGTHSHVBI-UHFFFAOYSA-N 2 0 355.309 4.043 20 0 FIADRP Fc1cc2cccnc2c(C[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000502330575 1095368621 /nfs/dbraw/zinc/36/86/21/1095368621.db2.gz FYYCWEHQIGWKJU-QGZVFWFLSA-N 2 0 364.468 4.286 20 0 FIADRP COc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000502327433 1095384395 /nfs/dbraw/zinc/38/43/95/1095384395.db2.gz RWLLYCRDMZMSOJ-OAHLLOKOSA-N 2 0 359.901 4.261 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCC23CCOCC3)CC1 ZINC000502431869 1095451848 /nfs/dbraw/zinc/45/18/48/1095451848.db2.gz CCFZBYFEKPLNDC-QFIPXVFZSA-N 2 0 356.554 4.357 20 0 FIADRP Clc1cccc2c1OCCC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000421338853 1095533886 /nfs/dbraw/zinc/53/38/86/1095533886.db2.gz DVMGFICBENOMLI-IBGZPJMESA-N 2 0 357.885 4.207 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421381427 1095585011 /nfs/dbraw/zinc/58/50/11/1095585011.db2.gz ZUSUKZLGRXWDCV-UHFFFAOYSA-N 2 0 357.361 4.133 20 0 FIADRP CCCCC[NH+]1CCN(C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168051346 1095806449 /nfs/dbraw/zinc/80/64/49/1095806449.db2.gz HPKXTKQDVCQABF-NHCUHLMSSA-N 2 0 357.586 4.236 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000421821292 1095933616 /nfs/dbraw/zinc/93/36/16/1095933616.db2.gz QOQAWMXWEAGIBR-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000421838992 1095964059 /nfs/dbraw/zinc/96/40/59/1095964059.db2.gz WBXKGZDDZFEOFR-CYBMUJFWSA-N 2 0 350.865 4.400 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000421873754 1095981856 /nfs/dbraw/zinc/98/18/56/1095981856.db2.gz IFCBONMMTUQQFM-SEEARECTSA-N 2 0 357.361 4.424 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000414654327 1096349577 /nfs/dbraw/zinc/34/95/77/1096349577.db2.gz BYKPKUFMXQAMSH-MOPGFXCFSA-N 2 0 360.505 4.017 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000414668067 1096394182 /nfs/dbraw/zinc/39/41/82/1096394182.db2.gz ZCAFTYKPMFKOKK-UHFFFAOYSA-N 2 0 355.507 4.378 20 0 FIADRP FC(F)(F)COc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422730275 1096463952 /nfs/dbraw/zinc/46/39/52/1096463952.db2.gz JMGJMSYAPVHWDC-BRWVUGGUSA-N 2 0 356.432 4.028 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422732375 1096465104 /nfs/dbraw/zinc/46/51/04/1096465104.db2.gz PTEPOLOLCITCRB-RTBURBONSA-N 2 0 370.368 4.207 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OCC ZINC000422760523 1096476032 /nfs/dbraw/zinc/47/60/32/1096476032.db2.gz QFWJWPYTLKBJCI-CABCVRRESA-N 2 0 357.498 4.058 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](c1cccs1)N1CCC(C)CC1 ZINC000422742736 1096478418 /nfs/dbraw/zinc/47/84/18/1096478418.db2.gz HABDFOQNRSAFOW-OXQOHEQNSA-N 2 0 372.582 4.034 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(-c2ccncc2)cc1 ZINC000422754777 1096483879 /nfs/dbraw/zinc/48/38/79/1096483879.db2.gz ATTZZNFQFNTTNW-ISKFKSNPSA-N 2 0 371.484 4.094 20 0 FIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1 ZINC000422778318 1096489231 /nfs/dbraw/zinc/48/92/31/1096489231.db2.gz DJOFLKXTKZBWHY-BAGYTPMASA-N 2 0 354.469 4.368 20 0 FIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000503595114 1096490217 /nfs/dbraw/zinc/49/02/17/1096490217.db2.gz WCXOONWLZMGRPA-INIZCTEOSA-N 2 0 370.459 4.201 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c(OC)c1 ZINC000422797167 1096493435 /nfs/dbraw/zinc/49/34/35/1096493435.db2.gz LFZBGDIFDSIUMC-JLTOFOAXSA-N 2 0 362.901 4.164 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422807138 1096496411 /nfs/dbraw/zinc/49/64/11/1096496411.db2.gz OMACGXJWFKTIBW-FIKMYACPSA-N 2 0 374.431 4.195 20 0 FIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422815002 1096497970 /nfs/dbraw/zinc/49/79/70/1096497970.db2.gz ALRKEUQRCWZNBA-MYZZLAAOSA-N 2 0 368.443 4.201 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cn2)c1 ZINC000422848822 1096504168 /nfs/dbraw/zinc/50/41/68/1096504168.db2.gz UIVHHFZYXRNXSJ-NJDAHSKKSA-N 2 0 369.484 4.413 20 0 FIADRP Cc1cccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422858894 1096507186 /nfs/dbraw/zinc/50/71/86/1096507186.db2.gz JFFXPWUVQSOMEJ-BHDDXSALSA-N 2 0 366.505 4.034 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000422877047 1096510230 /nfs/dbraw/zinc/51/02/30/1096510230.db2.gz HGRWRSIDSYUFAG-QGZVFWFLSA-N 2 0 361.489 4.279 20 0 FIADRP CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422882271 1096512182 /nfs/dbraw/zinc/51/21/82/1096512182.db2.gz ZVJZEAUITYSYGW-NQIIRXRSSA-N 2 0 354.519 4.062 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(C)cc1)c1ccc(F)cc1Cl ZINC000422892429 1096524071 /nfs/dbraw/zinc/52/40/71/1096524071.db2.gz YNPSYAORIQNLCH-YLJYHZDGSA-N 2 0 364.892 4.220 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000422925096 1096525758 /nfs/dbraw/zinc/52/57/58/1096525758.db2.gz VBVHYYSJBCSRJU-IRXDYDNUSA-N 2 0 352.526 4.396 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)nc1-c1ccccc1 ZINC000422925644 1096526330 /nfs/dbraw/zinc/52/63/30/1096526330.db2.gz BWXIMSLTHBKBPX-GUDVDZBRSA-N 2 0 355.551 4.171 20 0 FIADRP c1nc2ccccc2n1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422935654 1096528911 /nfs/dbraw/zinc/52/89/11/1096528911.db2.gz HGIYWEFDOWAZHB-YPAWHYETSA-N 2 0 374.532 4.095 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422990332 1096539708 /nfs/dbraw/zinc/53/97/08/1096539708.db2.gz BQXSUENXLMXBDJ-XZOQPEGZSA-N 2 0 361.489 4.146 20 0 FIADRP CC(C)(C)c1ccc(C(C)(C)C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000423015080 1096550017 /nfs/dbraw/zinc/55/00/17/1096550017.db2.gz QJOCFGHMXFSVLR-QHAWAJNXSA-N 2 0 358.570 4.008 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000423019423 1096550432 /nfs/dbraw/zinc/55/04/32/1096550432.db2.gz VNOOEKVDOPIYOM-CZUORRHYSA-N 2 0 364.839 4.153 20 0 FIADRP Fc1ccc(C2(N[C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)c(F)c1 ZINC000423028194 1096553972 /nfs/dbraw/zinc/55/39/72/1096553972.db2.gz QJUARVSKATVBAF-CTNGQTDRSA-N 2 0 370.443 4.190 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1 ZINC000423023958 1096554177 /nfs/dbraw/zinc/55/41/77/1096554177.db2.gz KXQCIUBCTZUJBQ-DHSIGJKJSA-N 2 0 371.352 4.147 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)s1 ZINC000423060131 1096560417 /nfs/dbraw/zinc/56/04/17/1096560417.db2.gz NSJNHAGBFXFHPB-GXSJLCMTSA-N 2 0 354.317 4.085 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]C1CCC(c2ccc(C(C)(C)C)cc2)CC1 ZINC000423115669 1096577683 /nfs/dbraw/zinc/57/76/83/1096577683.db2.gz YGUUZKOJTFJWEU-MIUUVFJNSA-N 2 0 358.570 4.352 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000423106708 1096583243 /nfs/dbraw/zinc/58/32/43/1096583243.db2.gz OUCBJASLRSCBPW-BDWVSVIHSA-N 3 0 363.977 4.361 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@@H](C[NH3+])C1CCCC1)C1CCCCC1 ZINC000414718275 1096583659 /nfs/dbraw/zinc/58/36/59/1096583659.db2.gz VOUVHWUKEIEOMQ-NRFANRHFSA-N 2 0 372.557 4.090 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000423107020 1096583759 /nfs/dbraw/zinc/58/37/59/1096583759.db2.gz PDHJPNQYIRSOTI-XWIAVFTESA-N 2 0 366.347 4.196 20 0 FIADRP COc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)c(-c2ccccc2)cc1OC ZINC000503936080 1096601713 /nfs/dbraw/zinc/60/17/13/1096601713.db2.gz IBCSVZWINMAAGX-UHFFFAOYSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000503954070 1096611940 /nfs/dbraw/zinc/61/19/40/1096611940.db2.gz TUHVYMXQJXXBCE-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP Brc1cccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2)c1 ZINC000423238739 1096617879 /nfs/dbraw/zinc/61/78/79/1096617879.db2.gz AUNRSWDYFGCLRC-BEFAXECRSA-N 2 0 359.311 4.128 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1OC ZINC000423239578 1096617917 /nfs/dbraw/zinc/61/79/17/1096617917.db2.gz BJKVOEUTDVMGFE-YCRPNKLZSA-N 2 0 374.912 4.036 20 0 FIADRP COc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1OC ZINC000423239576 1096617945 /nfs/dbraw/zinc/61/79/45/1096617945.db2.gz BJKVOEUTDVMGFE-VFNWGFHPSA-N 2 0 374.912 4.036 20 0 FIADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423244558 1096627529 /nfs/dbraw/zinc/62/75/29/1096627529.db2.gz HSCCHTXCTGUPGC-MNOVXSKESA-N 2 0 354.338 4.374 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccc(F)c(F)c2)c1 ZINC000423254779 1096631707 /nfs/dbraw/zinc/63/17/07/1096631707.db2.gz ZJWGRDYDWKSCRZ-VBKZILBWSA-N 2 0 362.489 4.365 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)CCC2 ZINC000423257413 1096631719 /nfs/dbraw/zinc/63/17/19/1096631719.db2.gz JHNQBOGCXZNSSO-RHSMWYFYSA-N 2 0 359.514 4.306 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423258704 1096633097 /nfs/dbraw/zinc/63/30/97/1096633097.db2.gz MMPQJPDWJSMZBN-SBUREZEXSA-N 2 0 363.480 4.443 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000423290426 1096636182 /nfs/dbraw/zinc/63/61/82/1096636182.db2.gz CXGJZLNMUPOLDH-BBATYDOGSA-N 2 0 363.274 4.385 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423316451 1096642558 /nfs/dbraw/zinc/64/25/58/1096642558.db2.gz BOCXMWASDVOOBC-QGZVFWFLSA-N 2 0 351.263 4.006 20 0 FIADRP Fc1cccc(C[C@@H]([NH2+]CC2C[NH2+]C2)c2ccc(Cl)c(Cl)c2)c1 ZINC000423300450 1096645776 /nfs/dbraw/zinc/64/57/76/1096645776.db2.gz DUUHWQPYJGFVHQ-GOSISDBHSA-N 2 0 353.268 4.225 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1ccc(Br)cc1)c1ccccc1F ZINC000423331327 1096648628 /nfs/dbraw/zinc/64/86/28/1096648628.db2.gz PWEMYUHYPBHGMC-QGZVFWFLSA-N 2 0 351.263 4.006 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cc1 ZINC000423341462 1096650678 /nfs/dbraw/zinc/65/06/78/1096650678.db2.gz UMUUJEXIACWEBD-SJORKVTESA-N 2 0 351.494 4.191 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]CC1 ZINC000423343673 1096652177 /nfs/dbraw/zinc/65/21/77/1096652177.db2.gz XANVJPUGKNWOEO-MRXNPFEDSA-N 2 0 359.514 4.306 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000423353865 1096654080 /nfs/dbraw/zinc/65/40/80/1096654080.db2.gz FBGLKHSUJNGHNP-KRWDZBQOSA-N 2 0 351.494 4.335 20 0 FIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1F ZINC000423386026 1096662797 /nfs/dbraw/zinc/66/27/97/1096662797.db2.gz LSRDQJRMTXYYDA-CTNGQTDRSA-N 2 0 354.469 4.254 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)nc1 ZINC000423390041 1096664094 /nfs/dbraw/zinc/66/40/94/1096664094.db2.gz VOVXMVFZKGMVGQ-USCONSEESA-N 2 0 371.956 4.181 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cnn1-c1cccc(Cl)c1 ZINC000423376817 1096668085 /nfs/dbraw/zinc/66/80/85/1096668085.db2.gz JCQTXHZRLBQSHS-AWEZNQCLSA-N 2 0 366.896 4.288 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)CCC2 ZINC000423421974 1096669536 /nfs/dbraw/zinc/66/95/36/1096669536.db2.gz BGBXUJBVEJCGSE-VDZJLULYSA-N 2 0 371.525 4.304 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)CCC3)cc1 ZINC000423424081 1096670067 /nfs/dbraw/zinc/67/00/67/1096670067.db2.gz CKNTYAGYWUOQLI-JENIJYKNSA-N 2 0 353.535 4.165 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423418298 1096676912 /nfs/dbraw/zinc/67/69/12/1096676912.db2.gz HHTWDIAOQXHLBD-SNRMKQJTSA-N 2 0 357.567 4.458 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423457563 1096689395 /nfs/dbraw/zinc/68/93/95/1096689395.db2.gz IKVFJARXUOBZJL-QJPTWQEYSA-N 2 0 364.383 4.058 20 0 FIADRP COCCC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423467628 1096691597 /nfs/dbraw/zinc/69/15/97/1096691597.db2.gz BMFUEOBRDBRVKV-ROUUACIJSA-N 2 0 369.347 4.039 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)C1CCC(F)(F)CC1 ZINC000423471478 1096694387 /nfs/dbraw/zinc/69/43/87/1096694387.db2.gz MESVBQNZCAIBDZ-UCLAIMLFSA-N 2 0 354.460 4.322 20 0 FIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc2cc(Br)ccc2o1 ZINC000423475510 1096695799 /nfs/dbraw/zinc/69/57/99/1096695799.db2.gz ICXIIGPCGDIMQX-WFASDCNBSA-N 2 0 351.288 4.378 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423454004 1096699268 /nfs/dbraw/zinc/69/92/68/1096699268.db2.gz LFYSXRFTMWYMBA-UGSOOPFHSA-N 2 0 365.290 4.395 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(Br)cc1C(F)(F)F ZINC000423504892 1096700920 /nfs/dbraw/zinc/70/09/20/1096700920.db2.gz LIMHGLPOKWKTST-UMNHJUIQSA-N 2 0 365.237 4.246 20 0 FIADRP Cc1c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000423503602 1096701126 /nfs/dbraw/zinc/70/11/26/1096701126.db2.gz MWEAJRYMNDAWLE-OPAMFIHVSA-N 2 0 366.484 4.451 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423506990 1096702075 /nfs/dbraw/zinc/70/20/75/1096702075.db2.gz JFWPHBDSZAOXDD-RDPSFJRHSA-N 3 0 365.565 4.152 20 0 FIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000423508330 1096703327 /nfs/dbraw/zinc/70/33/27/1096703327.db2.gz QOLOIPKABFHVOB-KKSFZXQISA-N 2 0 366.509 4.101 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000423515707 1096711043 /nfs/dbraw/zinc/71/10/43/1096711043.db2.gz SVLXDMBHFUWVIF-TVZGQMOCSA-N 2 0 350.840 4.425 20 0 FIADRP COC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000423518084 1096712332 /nfs/dbraw/zinc/71/23/32/1096712332.db2.gz ZFXKQCBTQSGIQX-RTBURBONSA-N 2 0 366.427 4.463 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1OCc1ccccc1 ZINC000423538717 1096715253 /nfs/dbraw/zinc/71/52/53/1096715253.db2.gz GYZJDXMSOJPNQZ-ZIBCJSCZSA-N 2 0 350.506 4.304 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423538781 1096715798 /nfs/dbraw/zinc/71/57/98/1096715798.db2.gz HDOYKSJLFXIEGK-VKUXKFIQSA-N 2 0 368.496 4.096 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423541365 1096716806 /nfs/dbraw/zinc/71/68/06/1096716806.db2.gz KRFHSQUIUBWGHC-DRPJVOAASA-N 2 0 358.473 4.380 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546832 1096718202 /nfs/dbraw/zinc/71/82/02/1096718202.db2.gz ZOFQAJPJBCFGAZ-PXAZEXFGSA-N 2 0 367.356 4.131 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000423548995 1096718266 /nfs/dbraw/zinc/71/82/66/1096718266.db2.gz RPLQZWWRUCQGFW-FHKFTOANSA-N 2 0 367.306 4.017 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423554481 1096720219 /nfs/dbraw/zinc/72/02/19/1096720219.db2.gz WOUXFVAWUMFGAE-ARLBYUKCSA-N 2 0 359.514 4.296 20 0 FIADRP CC(C)N(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(C)C ZINC000515518344 1098656488 /nfs/dbraw/zinc/65/64/88/1098656488.db2.gz GBVMETATKKGWLA-PMACEKPBSA-N 2 0 373.585 4.042 20 0 FIADRP CCN(C(=O)[C@@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1ccccc1 ZINC000515525045 1098664018 /nfs/dbraw/zinc/66/40/18/1098664018.db2.gz PUPZMPVMRRFFDJ-LJQANCHMSA-N 2 0 367.537 4.060 20 0 FIADRP Cc1cc(C)n(-c2ccc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)cc2)n1 ZINC000533271863 1098922730 /nfs/dbraw/zinc/92/27/30/1098922730.db2.gz GLPDZJUOEUHDDE-UHFFFAOYSA-N 2 0 354.542 4.041 20 0 FIADRP C[C@H](CCc1n[nH]c2ccccc21)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436307816 1098929861 /nfs/dbraw/zinc/92/98/61/1098929861.db2.gz LOZDPJSMPYVGAT-MJGOQNOKSA-N 2 0 354.542 4.271 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)ccc1OC ZINC000841762549 1098959369 /nfs/dbraw/zinc/95/93/69/1098959369.db2.gz XIUDIHMJAVEQBQ-VGOFRKELSA-N 2 0 368.521 4.459 20 0 FIADRP C[C@@H](Cc1ccccc1Br)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000436470767 1099046283 /nfs/dbraw/zinc/04/62/83/1099046283.db2.gz ORPBGZLEIODBDI-HNNXBMFYSA-N 2 0 374.326 4.034 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000533447233 1099071991 /nfs/dbraw/zinc/07/19/91/1099071991.db2.gz PKNCLIJZTXZWHN-KBPBESRZSA-N 2 0 372.340 4.127 20 0 FIADRP C[NH2+]CCC1CC[NH+](CCC(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000261993827 1099684876 /nfs/dbraw/zinc/68/48/76/1099684876.db2.gz NAZXGFUOXPFION-UHFFFAOYSA-N 2 0 365.521 4.004 20 0 FIADRP C[NH2+]CCC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000262002051 1099685872 /nfs/dbraw/zinc/68/58/72/1099685872.db2.gz PZTDHWCHNJBYKY-GOSISDBHSA-N 2 0 365.521 4.002 20 0 FIADRP Cc1ncc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)s1 ZINC000237854679 1099804389 /nfs/dbraw/zinc/80/43/89/1099804389.db2.gz BQBHXNBDZXDEPW-UHFFFAOYSA-N 2 0 357.567 4.276 20 0 FIADRP FC(F)(F)Oc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167961999 1099810756 /nfs/dbraw/zinc/81/07/56/1099810756.db2.gz RVPGTFIRSNYGMC-ALOPSCKCSA-N 2 0 354.416 4.080 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)ccc1SC ZINC000162516997 1099824015 /nfs/dbraw/zinc/82/40/15/1099824015.db2.gz VQFXBDLSUDMTPN-MRXNPFEDSA-N 2 0 374.550 4.208 20 0 FIADRP C[C@H]([NH2+]CCc1nc2ccccc2s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508691803 1099824146 /nfs/dbraw/zinc/82/41/46/1099824146.db2.gz QEPKUATUQSQHRB-HKUYNNGSSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccc(F)cc1 ZINC000508693185 1099824882 /nfs/dbraw/zinc/82/48/82/1099824882.db2.gz AFNKZPUQHSWWJZ-HBFSDRIKSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703604 1099857365 /nfs/dbraw/zinc/85/73/65/1099857365.db2.gz ZACGRANPGKTFFA-HBUYNFGHSA-N 2 0 366.549 4.041 20 0 FIADRP C[C@H](Nc1ccc(CC[NH+](C)C)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715204 1099885941 /nfs/dbraw/zinc/88/59/41/1099885941.db2.gz XGUFJMUWVPPYFR-SIKLNZKXSA-N 2 0 351.538 4.113 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508708803 1099887612 /nfs/dbraw/zinc/88/76/12/1099887612.db2.gz DVUPAKPBNYOWIJ-DENIHFKCSA-N 2 0 351.538 4.379 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508708806 1099888959 /nfs/dbraw/zinc/88/89/59/1099888959.db2.gz DVUPAKPBNYOWIJ-UGKGYDQZSA-N 2 0 351.538 4.379 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709835 1099899922 /nfs/dbraw/zinc/89/99/22/1099899922.db2.gz JWNLOLYUTWNSMH-ZNEWLNCYSA-N 2 0 364.533 4.407 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)COCc1ccccc1 ZINC000508712290 1099904141 /nfs/dbraw/zinc/90/41/41/1099904141.db2.gz QLRNQJPADKUIMM-ZFGGDYGUSA-N 2 0 366.549 4.340 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508723168 1099943131 /nfs/dbraw/zinc/94/31/31/1099943131.db2.gz VHPAPWKLYIFFAW-MDNUFGMLSA-N 2 0 363.549 4.013 20 0 FIADRP CCOc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)ccc1OC(F)F ZINC000536652204 1100105362 /nfs/dbraw/zinc/10/53/62/1100105362.db2.gz NKGXNFSPJZEHLA-UHFFFAOYSA-N 2 0 370.484 4.239 20 0 FIADRP Clc1oc2ccccc2c1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000536667390 1100142737 /nfs/dbraw/zinc/14/27/37/1100142737.db2.gz BHFRXAJBOHSJOJ-UHFFFAOYSA-N 2 0 362.901 4.163 20 0 FIADRP c1ccc(OC[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000459424734 1100155761 /nfs/dbraw/zinc/15/57/61/1100155761.db2.gz JODJTKROLUHVLO-DEOSSOPVSA-N 2 0 373.500 4.460 20 0 FIADRP c1ccc2cc(OCCC[NH2+]C3CCN(c4cc[nH+]cc4)CC3)ccc2c1 ZINC000459444283 1100179364 /nfs/dbraw/zinc/17/93/64/1100179364.db2.gz NOHRLGOWVAPVSN-UHFFFAOYSA-N 2 0 361.489 4.262 20 0 FIADRP Fc1ccc(C2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CC2)c(Cl)c1 ZINC000459457795 1100201386 /nfs/dbraw/zinc/20/13/86/1100201386.db2.gz QCAKHGDXGIHPBF-UHFFFAOYSA-N 2 0 359.876 4.164 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1OC ZINC000379625510 1100222194 /nfs/dbraw/zinc/22/21/94/1100222194.db2.gz FTKGDRYMPCTUHC-ZWKOTPCHSA-N 2 0 356.510 4.265 20 0 FIADRP COCc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000536709570 1100226131 /nfs/dbraw/zinc/22/61/31/1100226131.db2.gz DRUCILIESFOJSD-UHFFFAOYSA-N 2 0 364.533 4.321 20 0 FIADRP C[N@@H+](CCc1ccc(F)c(F)c1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536724397 1100247792 /nfs/dbraw/zinc/24/77/92/1100247792.db2.gz JUAXFDCSFMGWMV-UHFFFAOYSA-N 2 0 359.464 4.141 20 0 FIADRP c1ccc(C[NH+]2CCC([C@H]3CCCCC[N@H+]3C[C@H]3CCOC3)CC2)cc1 ZINC000459517862 1100256434 /nfs/dbraw/zinc/25/64/34/1100256434.db2.gz GDGSFNVTLKZODY-FYYLOGMGSA-N 2 0 356.554 4.180 20 0 FIADRP C[N@H+](CCCCCOc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000437988262 1100338464 /nfs/dbraw/zinc/33/84/64/1100338464.db2.gz RDPGSJGGRJNFKT-UHFFFAOYSA-N 2 0 367.537 4.479 20 0 FIADRP C[N@@H+](Cc1cc2c(cccc2F)[nH]1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000437985659 1100351320 /nfs/dbraw/zinc/35/13/20/1100351320.db2.gz KOIYOLBKELYIPH-UHFFFAOYSA-N 2 0 352.457 4.050 20 0 FIADRP Cc1ccn(-c2ccccc2C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000536847763 1100359389 /nfs/dbraw/zinc/35/93/89/1100359389.db2.gz WSZGXAUKEDUZDY-CVDCTZTESA-N 2 0 374.532 4.181 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCOC3(CCSCC3)C2)CC1 ZINC000536851241 1100365709 /nfs/dbraw/zinc/36/57/09/1100365709.db2.gz KJSZXNWYDSNYLX-HOJAQTOUSA-N 2 0 366.615 4.064 20 0 FIADRP Cc1cccc(NC(=O)C[C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000536857370 1100373890 /nfs/dbraw/zinc/37/38/90/1100373890.db2.gz KRHDUQSVVQIWON-IBGZPJMESA-N 2 0 367.537 4.342 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000536876136 1100397696 /nfs/dbraw/zinc/39/76/96/1100397696.db2.gz LGUGFNDEQPRUMF-CVDCTZTESA-N 2 0 352.522 4.128 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000425944614 1100402745 /nfs/dbraw/zinc/40/27/45/1100402745.db2.gz YEAVJDFEWCJOPC-INIZCTEOSA-N 2 0 356.485 4.494 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C[C@@H]3C[C@@H]3c3ccccc3)cc2)CC1 ZINC000517543610 1100465328 /nfs/dbraw/zinc/46/53/28/1100465328.db2.gz LBBZNLDMZUTJNY-NZQKXSOJSA-N 2 0 350.506 4.053 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+]CCCCOc3ccccc3)CC2)cc1 ZINC000438215519 1100515015 /nfs/dbraw/zinc/51/50/15/1100515015.db2.gz QOIQFFGGWNUECU-UHFFFAOYSA-N 2 0 352.522 4.347 20 0 FIADRP Cc1nccn1C[C@@H](C)C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426025590 1100685347 /nfs/dbraw/zinc/68/53/47/1100685347.db2.gz XIHHRLGZCXAWTB-HRAATJIYSA-N 2 0 368.912 4.450 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2CC[NH+](C)C)cc1)C1CC1 ZINC000438563673 1100751399 /nfs/dbraw/zinc/75/13/99/1100751399.db2.gz WOPXPQNWRIGUOA-UHFFFAOYSA-N 2 0 365.521 4.027 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[NH+](C2CCCCC2)CC1 ZINC000506378410 1100942797 /nfs/dbraw/zinc/94/27/97/1100942797.db2.gz DJMHJWGLPJMECR-UHFFFAOYSA-N 2 0 357.586 4.095 20 0 FIADRP c1csc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000414965342 1100999475 /nfs/dbraw/zinc/99/94/75/1100999475.db2.gz FOMUKUAFXBDNAR-GOSISDBHSA-N 2 0 366.534 4.223 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[C@@H]2CCC[NH2+]2)o1 ZINC000414967083 1101017459 /nfs/dbraw/zinc/01/74/59/1101017459.db2.gz GUXOYJSTYSKAKS-LJQANCHMSA-N 2 0 364.493 4.063 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCN(c3ccccc3F)C2)CC1 ZINC000426296591 1101221026 /nfs/dbraw/zinc/22/10/26/1101221026.db2.gz STLSMRQRZXVAFB-SLYNCCJLSA-N 2 0 359.533 4.037 20 0 FIADRP C[NH+](C)CC1(NC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CCC1 ZINC000439317551 1101329311 /nfs/dbraw/zinc/32/93/11/1101329311.db2.gz ALLNQJTUNZTPIH-UHFFFAOYSA-N 2 0 372.557 4.057 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001168149100 1101343472 /nfs/dbraw/zinc/34/34/72/1101343472.db2.gz KCPHLAAJBMZSQF-HNNXBMFYSA-N 2 0 366.958 4.449 20 0 FIADRP C[C@@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001167964322 1101347877 /nfs/dbraw/zinc/34/78/77/1101347877.db2.gz OXLPUZDLYCQICJ-DWMSJXBZSA-N 2 0 367.581 4.035 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1O ZINC000426360958 1101364903 /nfs/dbraw/zinc/36/49/03/1101364903.db2.gz LHVBOQRODXLREG-PELRDEGISA-N 2 0 374.569 4.355 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000459798847 1101389798 /nfs/dbraw/zinc/38/97/98/1101389798.db2.gz YCJMGZQJVDDEFX-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP CC(C)[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000537011859 1101391217 /nfs/dbraw/zinc/39/12/17/1101391217.db2.gz SHOASEFDLTWXPP-IBGZPJMESA-N 2 0 372.384 4.306 20 0 FIADRP CCc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)C(C)C)cc1 ZINC000537014156 1101396357 /nfs/dbraw/zinc/39/63/57/1101396357.db2.gz DGNCTQYVACPODD-XPWALMASSA-N 2 0 358.570 4.304 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Cl)nc1 ZINC000760161472 1101478292 /nfs/dbraw/zinc/47/82/92/1101478292.db2.gz WWMIXLXEJGCCHC-INIZCTEOSA-N 2 0 359.901 4.060 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc(Br)cs2)C1 ZINC000518763527 1101518477 /nfs/dbraw/zinc/51/84/77/1101518477.db2.gz SQPAKFVCTBMAHY-KBPBESRZSA-N 2 0 359.377 4.358 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1O ZINC000426418775 1101538247 /nfs/dbraw/zinc/53/82/47/1101538247.db2.gz YDDFLRUJNQKNFL-QRVBRYPASA-N 2 0 362.558 4.070 20 0 FIADRP CCCCc1oc2ccccc2c1C[NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1 ZINC000518777542 1101539264 /nfs/dbraw/zinc/53/92/64/1101539264.db2.gz JDLXZGQIPSVMJP-LJQANCHMSA-N 2 0 371.569 4.139 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000423525187 1101555774 /nfs/dbraw/zinc/55/57/74/1101555774.db2.gz KCPGPCLOIPKQNX-FXAWDEMLSA-N 2 0 369.578 4.270 20 0 FIADRP CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537303993 1101627468 /nfs/dbraw/zinc/62/74/68/1101627468.db2.gz LVKNXDGZEBQMIU-YVHKJVDXSA-N 2 0 374.500 4.193 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[N@@H+]1C ZINC000537310128 1101639900 /nfs/dbraw/zinc/63/99/00/1101639900.db2.gz CYCANGWTQJOFAC-WMZOPIPTSA-N 2 0 366.534 4.173 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@@H]3CCCc4ccccc4C3)CC2)oc1C ZINC000648445356 1101680680 /nfs/dbraw/zinc/68/06/80/1101680680.db2.gz JRGHJMQFYPDMCL-JOCHJYFZSA-N 2 0 367.537 4.041 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000537355722 1101690851 /nfs/dbraw/zinc/69/08/51/1101690851.db2.gz AXWRGEDXWCASDF-ZJOUEHCJSA-N 2 0 352.522 4.130 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000537445367 1101788374 /nfs/dbraw/zinc/78/83/74/1101788374.db2.gz BHJPHDRQPZAONS-SFHVURJKSA-N 2 0 355.526 4.170 20 0 FIADRP COc1cc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)ccc1O ZINC000648455630 1101838892 /nfs/dbraw/zinc/83/88/92/1101838892.db2.gz FVMFOLCJVBBDOD-UHFFFAOYSA-N 2 0 362.558 4.212 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001168183357 1102083223 /nfs/dbraw/zinc/08/32/23/1102083223.db2.gz PRBVIPKZWMSDIA-VQIMIIECSA-N 2 0 364.961 4.283 20 0 FIADRP Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)c1 ZINC001168284808 1102159217 /nfs/dbraw/zinc/15/92/17/1102159217.db2.gz NUGWBBOJSAKTFP-WWPVKYPJSA-N 2 0 352.522 4.140 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cnn(C(C)C)c3)CC2)cc1 ZINC000120687312 1102253642 /nfs/dbraw/zinc/25/36/42/1102253642.db2.gz RBXHPGXAPKHMIU-SFHVURJKSA-N 2 0 370.541 4.035 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cnn(C(C)C)c3)CC2)cc1 ZINC000120687162 1102254007 /nfs/dbraw/zinc/25/40/07/1102254007.db2.gz RBXHPGXAPKHMIU-GOSISDBHSA-N 2 0 370.541 4.035 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Br)c2)[C@H](C)C1 ZINC000537635826 1102383203 /nfs/dbraw/zinc/38/32/03/1102383203.db2.gz ZDQLHQXDHLTUPY-RKVPGOIHSA-N 2 0 353.348 4.215 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@H]2c3cc(Br)ccc3SC[C@H]2C)CCN1C ZINC000532483212 1102424672 /nfs/dbraw/zinc/42/46/72/1102424672.db2.gz ZALBTJIERXERET-CTWCOEIASA-N 2 0 369.372 4.304 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000121686149 1102434638 /nfs/dbraw/zinc/43/46/38/1102434638.db2.gz VWYSEPHRUXQKKH-AWEZNQCLSA-N 2 0 356.457 4.069 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000121791820 1102437707 /nfs/dbraw/zinc/43/77/07/1102437707.db2.gz XVXOWEHJHRUBSR-QFIPXVFZSA-N 2 0 350.506 4.240 20 0 FIADRP COC(=O)c1ccc(C[N@H+](C2CCC(C)CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168205731 1102469409 /nfs/dbraw/zinc/46/94/09/1102469409.db2.gz KUIYBAMWXNBMJP-BXQDZUEOSA-N 2 0 358.526 4.124 20 0 FIADRP Cc1cc(C)c(NC(=O)C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000122020948 1102512498 /nfs/dbraw/zinc/51/24/98/1102512498.db2.gz XKZBCYGBBNUFIW-UHFFFAOYSA-N 2 0 371.569 4.138 20 0 FIADRP Cc1cccc(C)c1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000122143470 1102531410 /nfs/dbraw/zinc/53/14/10/1102531410.db2.gz DBMKIMQQZNBATP-HXUWFJFHSA-N 2 0 371.569 4.218 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2CC([NH2+]CC2=Cc4ccccc4OC2)C3)cc1 ZINC000111391478 1102534569 /nfs/dbraw/zinc/53/45/69/1102534569.db2.gz SOHCCDRLOFYWAV-NOTZXAQLSA-N 2 0 360.501 4.248 20 0 FIADRP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC(NC1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001167974397 1102546800 /nfs/dbraw/zinc/54/68/00/1102546800.db2.gz ZEJBCMUKUROUKF-NOTZXAQLSA-N 2 0 359.602 4.026 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1 ZINC000550881687 1102651400 /nfs/dbraw/zinc/65/14/00/1102651400.db2.gz BDYZAMNLLFVBIF-REWPJTCUSA-N 2 0 364.533 4.266 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1cccs1 ZINC000550887727 1102658356 /nfs/dbraw/zinc/65/83/56/1102658356.db2.gz ZFQBEMGUCRXEAO-AZUAARDMSA-N 2 0 370.562 4.328 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2conc2Cc2ccccc2)CC1 ZINC000550174604 1102658389 /nfs/dbraw/zinc/65/83/89/1102658389.db2.gz KZYZEGWCJOTHIJ-UHFFFAOYSA-N 2 0 355.526 4.113 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)ccn1 ZINC000550886012 1102658824 /nfs/dbraw/zinc/65/88/24/1102658824.db2.gz AWFJFXYFTZUTET-ZWKOTPCHSA-N 2 0 353.510 4.315 20 0 FIADRP CCCC(=O)Nc1ccc(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551007039 1102758770 /nfs/dbraw/zinc/75/87/70/1102758770.db2.gz CJCMUSGMYRALRJ-YADHBBJMSA-N 2 0 365.521 4.350 20 0 FIADRP CC[N@@H+](Cc1cccc(-n2cccn2)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660921 1102786635 /nfs/dbraw/zinc/78/66/35/1102786635.db2.gz KATVLOPCKVHCEJ-HSZRJFAPSA-N 2 0 374.532 4.216 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)[C@]1(C)CCCO1 ZINC000551030141 1102808101 /nfs/dbraw/zinc/80/81/01/1102808101.db2.gz XYCVWGVCRQWSGD-UZLBHIALSA-N 2 0 350.934 4.099 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)[C@]1(C)CCCO1 ZINC000551030138 1102808181 /nfs/dbraw/zinc/80/81/81/1102808181.db2.gz XYCVWGVCRQWSGD-JXFKEZNVSA-N 2 0 350.934 4.099 20 0 FIADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550269991 1102894534 /nfs/dbraw/zinc/89/45/34/1102894534.db2.gz DSIXPJMPYNOAPN-PUHATCMVSA-N 2 0 370.581 4.331 20 0 FIADRP CO[C@H](C[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1cccc(Cl)c1 ZINC000551087732 1102905584 /nfs/dbraw/zinc/90/55/84/1102905584.db2.gz ZIVADIBLRLFMAF-PCCBWWKXSA-N 2 0 358.913 4.453 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@@H]1CN1CCC(C[NH+](C)Cc2ccccc2)CC1 ZINC000551092533 1102911371 /nfs/dbraw/zinc/91/13/71/1102911371.db2.gz IEXXUYGNSWDLIT-HSZRJFAPSA-N 2 0 357.586 4.093 20 0 FIADRP c1ccc(OCc2cccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)c2)cc1 ZINC000459366678 1102936143 /nfs/dbraw/zinc/93/61/43/1102936143.db2.gz CYKCTUYRPCKPJV-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000506934226 1102970415 /nfs/dbraw/zinc/97/04/15/1102970415.db2.gz YOJRNNDLWNOJKS-UHFFFAOYSA-N 2 0 355.501 4.442 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000551268133 1103026996 /nfs/dbraw/zinc/02/69/96/1103026996.db2.gz OLXFUUFPULFRDR-OAQYLSRUSA-N 2 0 368.521 4.280 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C\c3ccc(F)cc3F)cc2)CC1 ZINC000551272537 1103033869 /nfs/dbraw/zinc/03/38/69/1103033869.db2.gz YIFXHLVVKSZNRL-IHWYPQMZSA-N 2 0 372.459 4.241 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)ccc1O ZINC000459378915 1103037338 /nfs/dbraw/zinc/03/73/38/1103037338.db2.gz RTVURDLTDYZWBW-SFHVURJKSA-N 2 0 368.521 4.455 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000551573296 1103380538 /nfs/dbraw/zinc/38/05/38/1103380538.db2.gz ZKMPKIIVWIHOMV-DEOSSOPVSA-N 2 0 364.533 4.271 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507444081 1103391996 /nfs/dbraw/zinc/39/19/96/1103391996.db2.gz OGAYKWRUJOFPSA-JOCHJYFZSA-N 2 0 370.512 4.440 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000507459367 1103404298 /nfs/dbraw/zinc/40/42/98/1103404298.db2.gz FUGPYZVKESFTKZ-BGWNEDDSSA-N 2 0 359.517 4.211 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)CCO1 ZINC000507484041 1103431454 /nfs/dbraw/zinc/43/14/54/1103431454.db2.gz IRXKAQYCTOCPCH-FWKCKQQBSA-N 2 0 356.554 4.080 20 0 FIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)CCS2 ZINC000427542101 1103636414 /nfs/dbraw/zinc/63/64/14/1103636414.db2.gz VBSVYMCDFFWFOV-NSHGMRRFSA-N 2 0 362.583 4.319 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCCc4cc(F)ccc43)cc2)CC1 ZINC000551811195 1103694213 /nfs/dbraw/zinc/69/42/13/1103694213.db2.gz AAQHKUOEWFDALY-HSZRJFAPSA-N 2 0 368.496 4.466 20 0 FIADRP Cc1nccnc1[C@@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000187991395 1103731839 /nfs/dbraw/zinc/73/18/39/1103731839.db2.gz OUQXDMADUJMCME-LJQANCHMSA-N 2 0 366.553 4.171 20 0 FIADRP CCN1CCC([NH+]2CCC(C(=O)Nc3c(C)cccc3C(C)C)CC2)CC1 ZINC000519639372 1103760052 /nfs/dbraw/zinc/76/00/52/1103760052.db2.gz CHZAWQFFDHTKEO-UHFFFAOYSA-N 2 0 371.569 4.253 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000537767468 1103925983 /nfs/dbraw/zinc/92/59/83/1103925983.db2.gz LLGKFQUJRQDHST-SFHVURJKSA-N 2 0 351.332 4.291 20 0 FIADRP C[C@@H](Cc1ccccc1F)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538262005 1104067618 /nfs/dbraw/zinc/06/76/18/1104067618.db2.gz DONXBMFKEWCTQI-LAUBAEHRSA-N 2 0 368.496 4.335 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538262006 1104067977 /nfs/dbraw/zinc/06/79/77/1104067977.db2.gz DONXBMFKEWCTQI-UTKZUKDTSA-N 2 0 368.496 4.335 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc2ccccc2s1 ZINC000188244089 1104091646 /nfs/dbraw/zinc/09/16/46/1104091646.db2.gz PBGLPAFLCDRNNL-SNRMKQJTSA-N 2 0 358.551 4.320 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCCSc1ccccc1Cl ZINC000441201921 1104195575 /nfs/dbraw/zinc/19/55/75/1104195575.db2.gz FRZMIDHCFUCRDJ-KBAYOESNSA-N 2 0 368.974 4.006 20 0 FIADRP FC(F)(F)c1ccccc1OCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441413467 1104339893 /nfs/dbraw/zinc/33/98/93/1104339893.db2.gz XOLSBLCUIFUXEX-YJBOKZPZSA-N 2 0 368.443 4.033 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000112524946 1104374902 /nfs/dbraw/zinc/37/49/02/1104374902.db2.gz GGTKMPVJGFPPMH-ZACQAIPSSA-N 2 0 374.475 4.425 20 0 FIADRP Fc1ccccc1CC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167994420 1104491087 /nfs/dbraw/zinc/49/10/87/1104491087.db2.gz CXJGVCSVBBMHPL-CBQGHPETSA-N 2 0 356.529 4.486 20 0 FIADRP Fc1ccc(OC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995594 1104525612 /nfs/dbraw/zinc/52/56/12/1104525612.db2.gz KIIGHXXNIMUIIF-YOFSQIOKSA-N 2 0 358.501 4.074 20 0 FIADRP c1ccc2cc(OCC[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441425128 1104563241 /nfs/dbraw/zinc/56/32/41/1104563241.db2.gz WOHDMGVPPHCSHQ-REWPJTCUSA-N 2 0 350.506 4.167 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cccc(CO)c1 ZINC000536308610 1104660590 /nfs/dbraw/zinc/66/05/90/1104660590.db2.gz OGMAVMJMVSIKEC-RBUKOAKNSA-N 2 0 352.522 4.404 20 0 FIADRP COc1cccc(C[C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001168003025 1104994009 /nfs/dbraw/zinc/99/40/09/1104994009.db2.gz ILCQRFFVRASRBX-SSWODZADSA-N 2 0 368.565 4.355 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(OCc2ccccc2)c1 ZINC000152366407 1105035698 /nfs/dbraw/zinc/03/56/98/1105035698.db2.gz ATLUSEQOOUXYDE-ICSRJNTNSA-N 2 0 350.506 4.401 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000388829655 1105044745 /nfs/dbraw/zinc/04/47/45/1105044745.db2.gz WZJIUXFKGGPFMS-ABSDTBQOSA-N 2 0 356.485 4.396 20 0 FIADRP C[C@H]1CC([NH2+]CCc2ccc(N(C)C)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008142 1105168068 /nfs/dbraw/zinc/16/80/68/1105168068.db2.gz CVOUUWYVUFHJQD-PMACEKPBSA-N 2 0 365.565 4.326 20 0 FIADRP CC(C)[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168008170 1105171098 /nfs/dbraw/zinc/17/10/98/1105171098.db2.gz CYAGCHROUWFXSQ-JHDGKUDLSA-N 3 0 357.586 4.138 20 0 FIADRP COc1ccccc1OCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168009072 1105207701 /nfs/dbraw/zinc/20/77/01/1105207701.db2.gz GOSXZIYDQGZSJC-RTBURBONSA-N 2 0 368.521 4.105 20 0 FIADRP Clc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000665234007 1105227367 /nfs/dbraw/zinc/22/73/67/1105227367.db2.gz VNRZJFRYTGJECL-HNBVOPMISA-N 2 0 361.961 4.067 20 0 FIADRP C[C@H]1CC([NH2+]CCOCc2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168010061 1105231059 /nfs/dbraw/zinc/23/10/59/1105231059.db2.gz IZZJFTKMKVWJGB-PMACEKPBSA-N 2 0 352.522 4.234 20 0 FIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1F ZINC000665240453 1105258122 /nfs/dbraw/zinc/25/81/22/1105258122.db2.gz LKCVGTJEFLSVPN-HJNYFJLDSA-N 2 0 354.469 4.368 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000325083621 1106789580 /nfs/dbraw/zinc/78/95/80/1106789580.db2.gz JORGGTIYBQWPCH-VQTJNVASSA-N 2 0 351.966 4.043 20 0 FIADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000192930187 1106906020 /nfs/dbraw/zinc/90/60/20/1106906020.db2.gz LCXODXVLVCGPFR-QFIPXVFZSA-N 2 0 368.521 4.318 20 0 FIADRP CCc1ccc([C@H](CC(C)C)[NH+]2CCC(n3ncc4c3C[NH2+]C4)CC2)cc1 ZINC000530226859 1106916638 /nfs/dbraw/zinc/91/66/38/1106916638.db2.gz UIWMVCSLUHJSRI-QFIPXVFZSA-N 2 0 366.553 4.473 20 0 FIADRP Brc1cccc2c(N3CCC(C[NH+]4CCCC4)CC3)ccnc12 ZINC000301346933 1106999318 /nfs/dbraw/zinc/99/93/18/1106999318.db2.gz HONPNFRKONEOIH-UHFFFAOYSA-N 2 0 374.326 4.310 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475543934 1107715560 /nfs/dbraw/zinc/71/55/60/1107715560.db2.gz BCLSEKIPPVQSPY-MDMXATFFSA-N 2 0 357.542 4.134 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(Cl)nc1 ZINC000179100516 1107791558 /nfs/dbraw/zinc/79/15/58/1107791558.db2.gz NULCRIUVBQRAEB-ZACQAIPSSA-N 2 0 373.928 4.195 20 0 FIADRP c1csc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)cc2)c1 ZINC000444640542 1108058961 /nfs/dbraw/zinc/05/89/61/1108058961.db2.gz NSWYOSSRTKDVSU-UHFFFAOYSA-N 2 0 370.562 4.492 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc(C)c1F ZINC000531709793 1108088872 /nfs/dbraw/zinc/08/88/72/1108088872.db2.gz YMNCDMOFXRGEPQ-SIKLNZKXSA-N 2 0 369.528 4.082 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc(C)c1F ZINC000531709792 1108089335 /nfs/dbraw/zinc/08/93/35/1108089335.db2.gz YMNCDMOFXRGEPQ-KNQAVFIVSA-N 2 0 369.528 4.082 20 0 FIADRP FC(F)(F)C[C@H]1CC[N@H+](C/C=C\C[NH+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000444689653 1108092597 /nfs/dbraw/zinc/09/25/97/1108092597.db2.gz GPEXYPOOJRBXIA-YZRRVPADSA-N 2 0 358.370 4.091 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)CC(=O)Nc1ccccc1C ZINC000531726011 1108096478 /nfs/dbraw/zinc/09/64/78/1108096478.db2.gz ZBSJOVDVZKFZLQ-ZJOUEHCJSA-N 2 0 359.558 4.202 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000531692674 1108097230 /nfs/dbraw/zinc/09/72/30/1108097230.db2.gz UYQISVUJHXRHEM-CEMLEFRQSA-N 2 0 373.585 4.439 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2csc(C)c2)CC1 ZINC000453055369 1108130640 /nfs/dbraw/zinc/13/06/40/1108130640.db2.gz AUMCIHUAZBHRFL-SFHVURJKSA-N 2 0 357.567 4.045 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3csc(C)c3)cc2)CC1 ZINC000453060254 1108137509 /nfs/dbraw/zinc/13/75/09/1108137509.db2.gz JPSNATYXRQSTSV-SFHVURJKSA-N 2 0 357.567 4.045 20 0 FIADRP CCn1ccnc1[C@@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000453109311 1108176088 /nfs/dbraw/zinc/17/60/88/1108176088.db2.gz MEZABQSQRGHPQN-HXUWFJFHSA-N 2 0 368.569 4.289 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1 ZINC000453163989 1108234426 /nfs/dbraw/zinc/23/44/26/1108234426.db2.gz FBTIXGOJYUNDBX-VSKRKVRLSA-N 2 0 356.554 4.226 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1 ZINC000453163985 1108234888 /nfs/dbraw/zinc/23/48/88/1108234888.db2.gz FBTIXGOJYUNDBX-BDTNDASRSA-N 2 0 356.554 4.226 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1 ZINC000453211784 1108282763 /nfs/dbraw/zinc/28/27/63/1108282763.db2.gz OCNRMGNRMQWWOB-RCCFBDPRSA-N 2 0 352.444 4.362 20 0 FIADRP CCC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000453213570 1108282919 /nfs/dbraw/zinc/28/29/19/1108282919.db2.gz APFMPANFOGJRHN-GOTSBHOMSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453265838 1108340291 /nfs/dbraw/zinc/34/02/91/1108340291.db2.gz DBAOKAPCQAEVTB-CBGDNZLLSA-N 2 0 354.494 4.190 20 0 FIADRP Cc1ncsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453310466 1108397193 /nfs/dbraw/zinc/39/71/93/1108397193.db2.gz QTUGEHDIVYSSFK-VAMGGRTRSA-N 2 0 355.551 4.027 20 0 FIADRP FCC1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000453316457 1108406304 /nfs/dbraw/zinc/40/63/04/1108406304.db2.gz WVOFXCWRWJQXOW-FDFHNCONSA-N 2 0 374.544 4.033 20 0 FIADRP CO[C@@](C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000453319426 1108408184 /nfs/dbraw/zinc/40/81/84/1108408184.db2.gz KUDADVQDLHAFNJ-XQUALCHDSA-N 2 0 364.533 4.333 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000531936104 1108409566 /nfs/dbraw/zinc/40/95/66/1108409566.db2.gz CMRLWPBPUARYKA-RBUKOAKNSA-N 2 0 354.542 4.486 20 0 FIADRP CC(=O)Nc1ccc(CN2CCC([NH2+][C@@H](C)c3ccc(C)cc3)CC2)cc1 ZINC000453327342 1108419953 /nfs/dbraw/zinc/41/99/53/1108419953.db2.gz OSUORCBUPXVPSP-SFHVURJKSA-N 2 0 365.521 4.269 20 0 FIADRP CC(=O)Nc1ccc(CN2CCC([NH2+][C@H](C)c3ccc(C)cc3)CC2)cc1 ZINC000453327340 1108420685 /nfs/dbraw/zinc/42/06/85/1108420685.db2.gz OSUORCBUPXVPSP-GOSISDBHSA-N 2 0 365.521 4.269 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC2(CO)CC2)c2ccc(F)cc2)CC1 ZINC000453334796 1108428093 /nfs/dbraw/zinc/42/80/93/1108428093.db2.gz IHQMWKXLOPWLRE-NRFANRHFSA-N 2 0 362.533 4.131 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453349131 1108449348 /nfs/dbraw/zinc/44/93/48/1108449348.db2.gz GMLAFCDPMLICKX-XMSQKQJNSA-N 2 0 367.537 4.249 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000531969859 1108476022 /nfs/dbraw/zinc/47/60/22/1108476022.db2.gz LUVOPMMAOJRKDJ-LGVFNWMJSA-N 3 0 371.613 4.040 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000453419595 1108543546 /nfs/dbraw/zinc/54/35/46/1108543546.db2.gz JOWKULUXIDTLDI-YVWKXTFCSA-N 2 0 374.550 4.259 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)CCCC2)cc1C ZINC000532249245 1108727888 /nfs/dbraw/zinc/72/78/88/1108727888.db2.gz ROTPBWMSZQUJSY-SFHLNBCPSA-N 2 0 371.569 4.121 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532234425 1108730287 /nfs/dbraw/zinc/73/02/87/1108730287.db2.gz FXTRGQYMSJRDIZ-VDGAXYAQSA-N 2 0 357.542 4.123 20 0 FIADRP c1ncn(Cc2ccccc2)c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000445812979 1108996971 /nfs/dbraw/zinc/99/69/71/1108996971.db2.gz AZFUNBXLWWJFNB-UHFFFAOYSA-N 2 0 366.553 4.019 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c2ccccc2n1 ZINC000524753184 1109138167 /nfs/dbraw/zinc/13/81/67/1109138167.db2.gz ZQQGRKUAHJOGBV-OAQYLSRUSA-N 2 0 359.517 4.497 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1cccc(F)c1 ZINC000446743358 1109326539 /nfs/dbraw/zinc/32/65/39/1109326539.db2.gz FFGMDYGHYNITDU-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887716 1109383707 /nfs/dbraw/zinc/38/37/07/1109383707.db2.gz XQAYALQIHVRLRT-HNNXBMFYSA-N 2 0 352.469 4.073 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)c3cccc(C[NH+](C)C)c3)cc2)CC1 ZINC000525490641 1109401463 /nfs/dbraw/zinc/40/14/63/1109401463.db2.gz IVJUUNUIUQISBM-UHFFFAOYSA-N 2 0 365.521 4.232 20 0 FIADRP COc1cc(C[NH+]2CCC(Oc3ccncc3C)CC2)ccc1SC ZINC000429714493 1109446666 /nfs/dbraw/zinc/44/66/66/1109446666.db2.gz GROKOMPBLSAWFV-UHFFFAOYSA-N 2 0 358.507 4.164 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cc(C)oc3C)CC2)cc1 ZINC000447526097 1109562310 /nfs/dbraw/zinc/56/23/10/1109562310.db2.gz ANLTVDSAFAIQLN-QGZVFWFLSA-N 2 0 356.510 4.468 20 0 FIADRP Cc1cc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccnc2)ccc1F ZINC000447556973 1109580021 /nfs/dbraw/zinc/58/00/21/1109580021.db2.gz ILEXMWXDWGTVJG-QFIPXVFZSA-N 2 0 353.485 4.083 20 0 FIADRP Fc1ccc2c(c1)[C@@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000447596564 1109590801 /nfs/dbraw/zinc/59/08/01/1109590801.db2.gz CSEOOJHMAMUUJE-JTJHWIPRSA-N 2 0 352.453 4.044 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccnn3-c3ccccc3)CC2)CC1 ZINC000447894473 1109670567 /nfs/dbraw/zinc/67/05/67/1109670567.db2.gz DFSISLYDOIGUHR-UHFFFAOYSA-N 2 0 352.526 4.005 20 0 FIADRP c1ccc([C@@H]2CCC[C@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)CC2)cc1 ZINC000527662126 1109797229 /nfs/dbraw/zinc/79/72/29/1109797229.db2.gz MVXXFNZMVJASSO-NNWRFLSQSA-N 2 0 356.554 4.193 20 0 FIADRP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000527844930 1109832666 /nfs/dbraw/zinc/83/26/66/1109832666.db2.gz BGYKXBCHHSQKPN-RTBURBONSA-N 2 0 366.553 4.198 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)ccc1F ZINC000527867041 1109844445 /nfs/dbraw/zinc/84/44/45/1109844445.db2.gz QQAVZAQXCZSLEA-LJQANCHMSA-N 2 0 350.840 4.457 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)OC)c1 ZINC000527921013 1109856159 /nfs/dbraw/zinc/85/61/59/1109856159.db2.gz PPARYOWNHPMQPH-ZNLUXHQJSA-N 2 0 360.542 4.015 20 0 FIADRP Fc1ccccc1-c1ncc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)s1 ZINC000449011350 1109957851 /nfs/dbraw/zinc/95/78/51/1109957851.db2.gz PRCNCVHVUHNQCB-UHFFFAOYSA-N 2 0 359.514 4.257 20 0 FIADRP c1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)n(C2CCCC2)n1 ZINC000449069274 1109972009 /nfs/dbraw/zinc/97/20/09/1109972009.db2.gz WORGFJDZWSDZGB-UHFFFAOYSA-N 2 0 352.526 4.274 20 0 FIADRP Fc1cc2c(c(F)c1F)[C@@H]([NH2+]Cc1ccc(Cn3ccnc3)cc1)CC2 ZINC000449078412 1109974044 /nfs/dbraw/zinc/97/40/44/1109974044.db2.gz UZILXCRLTWBRPV-KRWDZBQOSA-N 2 0 357.379 4.126 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449111021 1109979269 /nfs/dbraw/zinc/97/92/69/1109979269.db2.gz IETCTUVEPVCABX-HXUWFJFHSA-N 2 0 362.945 4.366 20 0 FIADRP COCC1CCC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000449123580 1109980971 /nfs/dbraw/zinc/98/09/71/1109980971.db2.gz CWZTUNZOLDUOIH-UHFFFAOYSA-N 2 0 364.961 4.347 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2csc(C)c2)CC1 ZINC000449131260 1109981856 /nfs/dbraw/zinc/98/18/56/1109981856.db2.gz LFTNHOASUSFHSH-MRXNPFEDSA-N 2 0 361.530 4.188 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449112723 1109983536 /nfs/dbraw/zinc/98/35/36/1109983536.db2.gz SEHUMUPMDPXEIK-YLJYHZDGSA-N 2 0 350.934 4.067 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449148530 1109985352 /nfs/dbraw/zinc/98/53/52/1109985352.db2.gz KJCVAKFGOKYGBP-SFTDATJTSA-N 2 0 362.945 4.102 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CCc2cccn2C)CC1 ZINC000449149292 1109985871 /nfs/dbraw/zinc/98/58/71/1109985871.db2.gz NDFLDJMEGRPWJF-VQTJNVASSA-N 2 0 353.554 4.031 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@H]2CCCC[C@H]2O)CC1 ZINC000449190536 1109991353 /nfs/dbraw/zinc/99/13/53/1109991353.db2.gz JELLHIIMBQBIFM-KJXAQDMKSA-N 2 0 358.570 4.003 20 0 FIADRP Cc1cnc([C@H](C)C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)s1 ZINC000449240599 1110009839 /nfs/dbraw/zinc/00/98/39/1110009839.db2.gz ZSPBSYHQSKVKMU-SJORKVTESA-N 2 0 357.567 4.240 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC23CCOCC3)CC1 ZINC000449308253 1110022902 /nfs/dbraw/zinc/02/29/02/1110022902.db2.gz VSYOKUFCYZIZHF-UGKGYDQZSA-N 2 0 356.554 4.021 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3CCCC34CCC4)C3(C2)CCOCC3)cc1 ZINC000449343627 1110034953 /nfs/dbraw/zinc/03/49/53/1110034953.db2.gz LXEBUXIIVXIMIV-YADHBBJMSA-N 2 0 368.565 4.228 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000449343238 1110035052 /nfs/dbraw/zinc/03/50/52/1110035052.db2.gz IXGLJMWFHLZNFB-PKTZIBPZSA-N 2 0 370.581 4.474 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCCC2(F)F)CC1 ZINC000449373740 1110045640 /nfs/dbraw/zinc/04/56/40/1110045640.db2.gz CMWDPBONJXGDRH-HKUYNNGSSA-N 2 0 350.497 4.497 20 0 FIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449490109 1110091446 /nfs/dbraw/zinc/09/14/46/1110091446.db2.gz BNPAOOJFBOTPNI-LSWJPFSZSA-N 2 0 358.570 4.123 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@@H]2CCO[C@H](C)C2)CC3)cc1 ZINC001168112361 1110156049 /nfs/dbraw/zinc/15/60/49/1110156049.db2.gz DJURAVQYYRKIOA-IFMALSPDSA-N 2 0 356.554 4.241 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H](Nc2cccc(C[NH+]3CCCCC3)c2)[C@H](C)C1 ZINC000538498323 1111160168 /nfs/dbraw/zinc/16/01/68/1111160168.db2.gz WKUNCNNHBHQQJH-NFBKMPQASA-N 2 0 373.585 4.221 20 0 FIADRP C[C@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1cc2c(s1)CCC2 ZINC000538589235 1111210974 /nfs/dbraw/zinc/21/09/74/1111210974.db2.gz GRDSPDTZHKUJEO-HNNXBMFYSA-N 2 0 370.566 4.335 20 0 FIADRP COCc1cccc(OCC2(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)CC2)c1 ZINC000538782650 1111293482 /nfs/dbraw/zinc/29/34/82/1111293482.db2.gz XAQTZYCZCSENPE-UHFFFAOYSA-N 2 0 374.569 4.044 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000539041299 1111395240 /nfs/dbraw/zinc/39/52/40/1111395240.db2.gz IUGRGKUDOIYXML-KRWDZBQOSA-N 2 0 371.525 4.050 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)ccn1 ZINC000539047292 1111411414 /nfs/dbraw/zinc/41/14/14/1111411414.db2.gz MZZJQYOSLHKFCQ-HXUWFJFHSA-N 2 0 373.928 4.233 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)Oc1ccccc1C(F)(F)F ZINC000539124223 1111443521 /nfs/dbraw/zinc/44/35/21/1111443521.db2.gz LWINTTAVNHKGAJ-JYYAWHABSA-N 2 0 358.448 4.181 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1-c1ccnn1C ZINC000552042710 1111554884 /nfs/dbraw/zinc/55/48/84/1111554884.db2.gz XTLILRZQAFXOKR-UHFFFAOYSA-N 2 0 362.521 4.171 20 0 FIADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000552056187 1111560089 /nfs/dbraw/zinc/56/00/89/1111560089.db2.gz VWGDNNFWMGWYJE-OEMFJLHTSA-N 2 0 363.549 4.213 20 0 FIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000552061393 1111562426 /nfs/dbraw/zinc/56/24/26/1111562426.db2.gz IXQGWRKFYKPTFC-GOSISDBHSA-N 2 0 355.526 4.071 20 0 FIADRP C[NH+]1CCN(C[C@H]([NH2+][C@H]2CCCCC23CCCC3)c2ccccc2)CC1 ZINC000552072245 1111573475 /nfs/dbraw/zinc/57/34/75/1111573475.db2.gz PFJVCWKTSGVFPG-VXKWHMMOSA-N 2 0 355.570 4.068 20 0 FIADRP C[C@@H](O)[C@@](C)(C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)Cc1ccccc1 ZINC000477854496 1111578673 /nfs/dbraw/zinc/57/86/73/1111578673.db2.gz BKXPEKXQYMKZRY-MYSJAJEPSA-N 2 0 372.597 4.249 20 0 FIADRP C[C@H](O)[C@](C)(C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)Cc1ccccc1 ZINC000477854499 1111578764 /nfs/dbraw/zinc/57/87/64/1111578764.db2.gz BKXPEKXQYMKZRY-SHBJFUFKSA-N 2 0 372.597 4.249 20 0 FIADRP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C[C@H]4CCC5(CCCC5)O4)C3)C2)cc1 ZINC000552156934 1111596016 /nfs/dbraw/zinc/59/60/16/1111596016.db2.gz CJWDRZLQARPWLJ-YADHBBJMSA-N 2 0 354.538 4.076 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477942195 1111615935 /nfs/dbraw/zinc/61/59/35/1111615935.db2.gz SVYPXQCXAADUEJ-SFHVURJKSA-N 2 0 359.558 4.239 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477942193 1111616133 /nfs/dbraw/zinc/61/61/33/1111616133.db2.gz SVYPXQCXAADUEJ-GOSISDBHSA-N 2 0 359.558 4.239 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CC[NH+](C3CCCC3)CC2)CC1 ZINC000552248323 1111628634 /nfs/dbraw/zinc/62/86/34/1111628634.db2.gz CQXVGGPMCALBHC-UHFFFAOYSA-N 3 0 369.597 4.426 20 0 FIADRP COC[C@H](Cc1ccccc1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552252150 1111629863 /nfs/dbraw/zinc/62/98/63/1111629863.db2.gz DDENSGLASDGVAM-WLXPTCNVSA-N 2 0 366.549 4.277 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC(=O)Nc2ccccc2)CC1 ZINC000552270912 1111644362 /nfs/dbraw/zinc/64/43/62/1111644362.db2.gz JSQFREIMHFOXRH-UHFFFAOYSA-N 2 0 365.521 4.048 20 0 FIADRP Oc1cc(F)cc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000552273158 1111654356 /nfs/dbraw/zinc/65/43/56/1111654356.db2.gz VEUBWQLLNDWOQD-UHFFFAOYSA-N 2 0 354.469 4.019 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000552281685 1111658541 /nfs/dbraw/zinc/65/85/41/1111658541.db2.gz GLMOTNNRPVZVEJ-QXCFHYIPSA-N 2 0 354.460 4.465 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)[C@H]1COc2ccccc21 ZINC000552575966 1111748298 /nfs/dbraw/zinc/74/82/98/1111748298.db2.gz LZTKUVGBBRCYFT-GWOFKNCZSA-N 2 0 350.506 4.194 20 0 FIADRP Brc1ccccc1[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643535277 1111768867 /nfs/dbraw/zinc/76/88/67/1111768867.db2.gz LFXQEWWMLXJDMH-OALUTQOASA-N 2 0 371.322 4.270 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479364416 1112007329 /nfs/dbraw/zinc/00/73/29/1112007329.db2.gz RVYYQXGAYCQUJK-WIYYLYMNSA-N 2 0 354.542 4.350 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479451135 1112027582 /nfs/dbraw/zinc/02/75/82/1112027582.db2.gz HJPXSBJIOHUQDU-KRWDZBQOSA-N 2 0 369.322 4.361 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)[C@@H](C)C1 ZINC000479525682 1112052697 /nfs/dbraw/zinc/05/26/97/1112052697.db2.gz IFIZLZVYNVTENJ-YSSFQJQWSA-N 2 0 350.934 4.054 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000479739092 1112126470 /nfs/dbraw/zinc/12/64/70/1112126470.db2.gz FXSDFXVEPCGBNN-SJORKVTESA-N 2 0 360.521 4.481 20 0 FIADRP COc1cc(F)c([C@H](C)NCCC[N@H+](C)Cc2ccccc2)cc1OC ZINC000480167651 1112305515 /nfs/dbraw/zinc/30/55/15/1112305515.db2.gz JPKJGBPYGQPLAU-INIZCTEOSA-N 2 0 360.473 4.016 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480159926 1112308689 /nfs/dbraw/zinc/30/86/89/1112308689.db2.gz FKYVCWDOFGQWOK-IBGZPJMESA-N 2 0 360.505 4.319 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480162781 1112310505 /nfs/dbraw/zinc/31/05/05/1112310505.db2.gz LMDPIMNAQIMNDZ-GOSISDBHSA-N 2 0 371.550 4.272 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000480212270 1112333535 /nfs/dbraw/zinc/33/35/35/1112333535.db2.gz FZZPHGWCKHZKED-WMZHIEFXSA-N 2 0 374.532 4.028 20 0 FIADRP C[C@H](CCCC(F)(F)F)[NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000480252435 1112350407 /nfs/dbraw/zinc/35/04/07/1112350407.db2.gz UWUIBEWPSDQYEC-IEBWSBKVSA-N 2 0 371.491 4.076 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(-n2cccn2)cc1 ZINC000480266062 1112352404 /nfs/dbraw/zinc/35/24/04/1112352404.db2.gz OEUPCJOVMBSJHE-IBGZPJMESA-N 2 0 360.505 4.319 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(-n2cccn2)cc1 ZINC000480601519 1112491457 /nfs/dbraw/zinc/49/14/57/1112491457.db2.gz ASUGGLMZDSGXPU-HSALFYBXSA-N 2 0 354.542 4.281 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(-n2cccn2)cc1 ZINC000480601520 1112491664 /nfs/dbraw/zinc/49/16/64/1112491664.db2.gz ASUGGLMZDSGXPU-VAMGGRTRSA-N 2 0 354.542 4.281 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000480617506 1112511127 /nfs/dbraw/zinc/51/11/27/1112511127.db2.gz RJILBOWXMQLJBG-RTBURBONSA-N 2 0 374.573 4.379 20 0 FIADRP CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000554888713 1112546615 /nfs/dbraw/zinc/54/66/15/1112546615.db2.gz JRJZESAGBUJWRD-NRFANRHFSA-N 2 0 350.466 4.167 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480710634 1112565461 /nfs/dbraw/zinc/56/54/61/1112565461.db2.gz PHRUIMJWQCUJBI-SKWRMQMOSA-N 3 0 369.597 4.140 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(Cl)cc1 ZINC000480738156 1112570926 /nfs/dbraw/zinc/57/09/26/1112570926.db2.gz QPCVLSGTBRHTTH-FQEVSTJZSA-N 2 0 372.944 4.118 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cc(C)sc2C)CC1 ZINC000480738186 1112571821 /nfs/dbraw/zinc/57/18/21/1112571821.db2.gz QRKXIJWFDRQDAO-GOSISDBHSA-N 2 0 371.594 4.353 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480755253 1112588444 /nfs/dbraw/zinc/58/84/44/1112588444.db2.gz GNGLXXYPOSAXAS-IHRRRGAJSA-N 2 0 357.325 4.223 20 0 FIADRP CCOCc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000480810376 1112615635 /nfs/dbraw/zinc/61/56/35/1112615635.db2.gz DYVQUYMOWXFHPL-AUSIDOKSSA-N 2 0 352.522 4.223 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc(C)c1F ZINC000480876872 1112651304 /nfs/dbraw/zinc/65/13/04/1112651304.db2.gz IBARZDCGCRHUBT-LJQANCHMSA-N 2 0 369.528 4.041 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000480879156 1112651953 /nfs/dbraw/zinc/65/19/53/1112651953.db2.gz GTSJJGZYQLYZKE-YLJYHZDGSA-N 2 0 366.977 4.344 20 0 FIADRP CSC1(C[NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC[NH+](C)CC1 ZINC000555104153 1112669728 /nfs/dbraw/zinc/66/97/28/1112669728.db2.gz FCPOZUCJZZYWQH-CQSZACIVSA-N 2 0 360.489 4.226 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000481310001 1112884329 /nfs/dbraw/zinc/88/43/29/1112884329.db2.gz STBPYJMMWUQHBP-ZHRRBRCNSA-N 2 0 356.485 4.179 20 0 FIADRP Cc1nocc1C[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000555538055 1112916530 /nfs/dbraw/zinc/91/65/30/1112916530.db2.gz PPHSOBYWOYKOFO-UHFFFAOYSA-N 2 0 358.445 4.185 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)[C@H](C)C1 ZINC000481421638 1112937830 /nfs/dbraw/zinc/93/78/30/1112937830.db2.gz IYXVJBXQOZCBCD-IERDGZPVSA-N 2 0 357.542 4.011 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)COC2 ZINC000481552646 1112975214 /nfs/dbraw/zinc/97/52/14/1112975214.db2.gz OLOYGWKKWXDWRM-GOSISDBHSA-N 2 0 350.506 4.280 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000481720337 1113060319 /nfs/dbraw/zinc/06/03/19/1113060319.db2.gz FJJYABIYXBYBFN-JLHGSKIFSA-N 2 0 350.506 4.107 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CC[C@H](c2ccccc2F)C1 ZINC000481816799 1113087027 /nfs/dbraw/zinc/08/70/27/1113087027.db2.gz QWVFXAQQDGNUES-WMZOPIPTSA-N 2 0 350.441 4.141 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000481943300 1113136009 /nfs/dbraw/zinc/13/60/09/1113136009.db2.gz IPKKYNLVLTZNDR-HXUWFJFHSA-N 2 0 350.934 4.198 20 0 FIADRP CC1(C)CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc21 ZINC000481996051 1113151402 /nfs/dbraw/zinc/15/14/02/1113151402.db2.gz ZOLANJMSVSNUCR-REWPJTCUSA-N 2 0 364.533 4.156 20 0 FIADRP CCCc1cccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000482023158 1113152095 /nfs/dbraw/zinc/15/20/95/1113152095.db2.gz YMANFBXWKLXQAR-UHFFFAOYSA-N 2 0 371.613 4.267 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000482117625 1113174449 /nfs/dbraw/zinc/17/44/49/1113174449.db2.gz AIJLJPXTNFNWGG-UGKGYDQZSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000482114007 1113177961 /nfs/dbraw/zinc/17/79/61/1113177961.db2.gz KITSBNQTEOSRLW-INIZCTEOSA-N 2 0 369.484 4.141 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCCc1c(Cl)cccc1Cl ZINC000482172178 1113192316 /nfs/dbraw/zinc/19/23/16/1113192316.db2.gz RSCZTRSEVPAJRF-MDASCCDHSA-N 2 0 371.352 4.110 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)[C@@H](C)C1 ZINC000482236556 1113206384 /nfs/dbraw/zinc/20/63/84/1113206384.db2.gz AGVCTHUZYULKNS-PXNSSMCTSA-N 2 0 364.961 4.098 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCCO2 ZINC000162908125 1113219074 /nfs/dbraw/zinc/21/90/74/1113219074.db2.gz UEPCMCOHSVHYRU-OAQYLSRUSA-N 2 0 354.469 4.425 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000482333085 1113227929 /nfs/dbraw/zinc/22/79/29/1113227929.db2.gz ZCYABYSJPOXUOV-JKSUJKDBSA-N 2 0 358.448 4.399 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000482339593 1113229374 /nfs/dbraw/zinc/22/93/74/1113229374.db2.gz VRUXCEIQJXEZJM-YKSBVNFPSA-N 3 0 365.565 4.139 20 0 FIADRP Cc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)c21 ZINC000482441949 1113257786 /nfs/dbraw/zinc/25/77/86/1113257786.db2.gz VHNJDXZTUCFLAJ-SFHVURJKSA-N 2 0 365.521 4.310 20 0 FIADRP Cc1cccc2[nH]cc(CC[NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)c21 ZINC000482441948 1113258112 /nfs/dbraw/zinc/25/81/12/1113258112.db2.gz VHNJDXZTUCFLAJ-GOSISDBHSA-N 2 0 365.521 4.310 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482445205 1113258530 /nfs/dbraw/zinc/25/85/30/1113258530.db2.gz AQDWNMJARJFAAJ-FPOVZHCZSA-N 2 0 352.522 4.301 20 0 FIADRP C[C@H](C[NH2+][C@H](C)c1ccc(C2CCCCC2)cc1)CN1CC[NH+](C)CC1 ZINC000482447722 1113259642 /nfs/dbraw/zinc/25/96/42/1113259642.db2.gz MKRNHAHOKNXQOM-WOJBJXKFSA-N 2 0 357.586 4.268 20 0 FIADRP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482532787 1113285946 /nfs/dbraw/zinc/28/59/46/1113285946.db2.gz KGUVJHKEAFFKGL-BTYIYWSLSA-N 2 0 371.475 4.055 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccccc1 ZINC000482560438 1113296052 /nfs/dbraw/zinc/29/60/52/1113296052.db2.gz AHZXJLLYXVJDMP-LAUBAEHRSA-N 2 0 355.501 4.379 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1F ZINC000482652748 1113323198 /nfs/dbraw/zinc/32/31/98/1113323198.db2.gz ULDRTRJZDOPMLC-LAUBAEHRSA-N 2 0 356.485 4.225 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc4[nH]ccc43)CC2)cc1 ZINC000237521353 1113338628 /nfs/dbraw/zinc/33/86/28/1113338628.db2.gz CNPFZIXJOJHPGY-UHFFFAOYSA-N 2 0 363.505 4.178 20 0 FIADRP COc1cc(Cl)ccc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482810380 1113367791 /nfs/dbraw/zinc/36/77/91/1113367791.db2.gz IAFGEZKARMTKKF-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)nnn1-c1ccc(F)cc1 ZINC000482949556 1113403433 /nfs/dbraw/zinc/40/34/33/1113403433.db2.gz PEVVYGRKXHAVJP-QGZVFWFLSA-N 2 0 373.520 4.022 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3c(s2)CCCC3)[C@H](C)C1 ZINC000483137037 1113446358 /nfs/dbraw/zinc/44/63/58/1113446358.db2.gz SZXDMYGEAAPVQU-LMMKCTJWSA-N 2 0 364.599 4.415 20 0 FIADRP Fc1cccc(-c2ccc(C[N@@H+]3CC[C@H](Oc4ccncc4)C3)o2)c1F ZINC000483269180 1113477104 /nfs/dbraw/zinc/47/71/04/1113477104.db2.gz QSVVBPRVPULAIU-INIZCTEOSA-N 2 0 356.372 4.273 20 0 FIADRP Cc1nn(-c2ccccc2)cc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486376493 1113556718 /nfs/dbraw/zinc/55/67/18/1113556718.db2.gz OYSGEFHMBCYIHN-UGKGYDQZSA-N 2 0 374.532 4.181 20 0 FIADRP Cc1cc(N2CC[N@H+](C3CCOCC3)C[C@H]2C)c2cc(Cl)cc(C)c2[nH+]1 ZINC000486462190 1113572717 /nfs/dbraw/zinc/57/27/17/1113572717.db2.gz AWIHFJBEMMAXAC-MRXNPFEDSA-N 2 0 373.928 4.195 20 0 FIADRP c1ccc2c(c1)cccc2OCCC[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488271423 1113895591 /nfs/dbraw/zinc/89/55/91/1113895591.db2.gz WSMHOMDNOCBIAR-UHFFFAOYSA-N 2 0 352.522 4.417 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](CCOc2ccccc2C(F)(F)F)CC1 ZINC000488434281 1113929542 /nfs/dbraw/zinc/92/95/42/1113929542.db2.gz LJPNQLNDGVXOTG-UHFFFAOYSA-N 2 0 358.448 4.138 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000570508507 1114133526 /nfs/dbraw/zinc/13/35/26/1114133526.db2.gz AIVLJWKQINOLNF-UHFFFAOYSA-N 2 0 366.553 4.402 20 0 FIADRP COc1ccc([C@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccc(F)cc2)cc1 ZINC000491003556 1114359186 /nfs/dbraw/zinc/35/91/86/1114359186.db2.gz FWYSYIZASYVYKU-JOCHJYFZSA-N 2 0 356.485 4.245 20 0 FIADRP CN(Cc1ccccc1OC1CC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000571806199 1114539815 /nfs/dbraw/zinc/53/98/15/1114539815.db2.gz AFHRTIARXSWSBX-HXUWFJFHSA-N 2 0 350.506 4.182 20 0 FIADRP CC(C)[N@H+](C)CC1CCN(Cc2csc(CCc3ccccc3)n2)CC1 ZINC000571965246 1114561842 /nfs/dbraw/zinc/56/18/42/1114561842.db2.gz PHSNWKNUNLXOBL-UHFFFAOYSA-N 2 0 371.594 4.481 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000588708660 1114601460 /nfs/dbraw/zinc/60/14/60/1114601460.db2.gz BLTINWDAFLDWIS-HZPDHXFCSA-N 2 0 370.459 4.027 20 0 FIADRP CSc1ccc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000572895396 1114805355 /nfs/dbraw/zinc/80/53/55/1114805355.db2.gz WLOITPPZQXYGJA-HZPDHXFCSA-N 2 0 368.612 4.181 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641841 1114820248 /nfs/dbraw/zinc/82/02/48/1114820248.db2.gz QKRNCHBBTYRXJQ-HDICACEKSA-N 2 0 362.521 4.331 20 0 FIADRP COc1cc(C[NH2+]CCC[NH+]2CCCCC2)c(-c2ccccc2)cc1OC ZINC000589833041 1114846501 /nfs/dbraw/zinc/84/65/01/1114846501.db2.gz KEOCYSQCQMDFIG-UHFFFAOYSA-N 2 0 368.521 4.336 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(F)c(Br)c2)C1 ZINC000589836085 1114846899 /nfs/dbraw/zinc/84/68/99/1114846899.db2.gz GJFRILFOCNBEFR-AWEZNQCLSA-N 2 0 357.311 4.190 20 0 FIADRP Cc1cc(-c2noc([C@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)n2)ccc1F ZINC000590786165 1114973968 /nfs/dbraw/zinc/97/39/68/1114973968.db2.gz DSFZRUAFWKAAHE-INIZCTEOSA-N 2 0 374.504 4.297 20 0 FIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000573410017 1115105893 /nfs/dbraw/zinc/10/58/93/1115105893.db2.gz ZPRPDNFSSWPWNE-UHFFFAOYSA-N 2 0 370.562 4.279 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4ccsc4)cc3)C2)CC1 ZINC000573527671 1115135291 /nfs/dbraw/zinc/13/52/91/1115135291.db2.gz GVBHGBBPCHIGLO-QFIPXVFZSA-N 2 0 369.578 4.015 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000573609582 1115146586 /nfs/dbraw/zinc/14/65/86/1115146586.db2.gz BRYBNLGBFNXSNI-UKRRQHHQSA-N 2 0 374.941 4.275 20 0 FIADRP CC(C)[NH+]1CCC(N[C@H]2C[C@@H](C(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000593689354 1115342339 /nfs/dbraw/zinc/34/23/39/1115342339.db2.gz HVKNVIYGIWOJJL-UXHICEINSA-N 2 0 358.526 4.019 20 0 FIADRP COC(=O)c1oc(CNCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cc1C ZINC000597052043 1115638036 /nfs/dbraw/zinc/63/80/36/1115638036.db2.gz ZCICYXXWDNHJFU-KRWDZBQOSA-N 2 0 370.493 4.039 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001168412254 1115691624 /nfs/dbraw/zinc/69/16/24/1115691624.db2.gz MBNUCMNKLJMXPA-NEWJYFPISA-N 2 0 364.508 4.468 20 0 FIADRP C#CCOc1ccccc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000060950750 1115736954 /nfs/dbraw/zinc/73/69/54/1115736954.db2.gz CLNCIRFHFHZJEC-UHFFFAOYSA-N 2 0 362.517 4.364 20 0 FIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1F ZINC000669683864 1115779672 /nfs/dbraw/zinc/77/96/72/1115779672.db2.gz YTDFSULSLHMRBH-PKOBYXMFSA-N 2 0 356.485 4.225 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2cc(Br)ccc2C)CC[NH+](C)CC1 ZINC000599047375 1115780218 /nfs/dbraw/zinc/78/02/18/1115780218.db2.gz UIAWOYHQWMZODY-AWEZNQCLSA-N 2 0 371.388 4.236 20 0 FIADRP [NH3+]C1(c2ccc(Cl)cc2)CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168417746 1115865514 /nfs/dbraw/zinc/86/55/14/1115865514.db2.gz SROVRASRDRYVAM-HXUWFJFHSA-N 2 0 358.888 4.286 20 0 FIADRP CC(C)(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605323458 1115885665 /nfs/dbraw/zinc/88/56/65/1115885665.db2.gz XIEWRRWVYYSGAU-RBBKRZOGSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Cl)c(F)c1 ZINC000534328842 1116185270 /nfs/dbraw/zinc/18/52/70/1116185270.db2.gz MAHCNNLWUKMTOY-MRXNPFEDSA-N 2 0 367.940 4.080 20 0 FIADRP COc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1F ZINC000534964785 1116258388 /nfs/dbraw/zinc/25/83/88/1116258388.db2.gz BXVRWPSERXQEAI-UHFFFAOYSA-N 2 0 368.496 4.322 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509163 1116313845 /nfs/dbraw/zinc/31/38/45/1116313845.db2.gz YPCXXDFXVZXQCU-BZNIZROVSA-N 2 0 357.723 4.021 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000462787899 1117771110 /nfs/dbraw/zinc/77/11/10/1117771110.db2.gz MBDJSEWLWGOGID-UHFFFAOYSA-N 2 0 354.542 4.294 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000462802753 1117785898 /nfs/dbraw/zinc/78/58/98/1117785898.db2.gz ADSQYGJYRYGIMR-UWIFEVILSA-N 2 0 351.332 4.015 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC2CC(O)C2)c2ccc(F)cc2)CC1 ZINC000462805538 1117787652 /nfs/dbraw/zinc/78/76/52/1117787652.db2.gz FHPJSDXVTPKRNM-UDJZJCJKSA-N 2 0 362.533 4.130 20 0 FIADRP CO[C@H](C)CC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462806282 1117788374 /nfs/dbraw/zinc/78/83/74/1117788374.db2.gz JIZYHLFIGXHOKS-NQIIRXRSSA-N 2 0 350.522 4.394 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)CC1 ZINC000462817047 1117793327 /nfs/dbraw/zinc/79/33/27/1117793327.db2.gz HZMFGDQKZMYGHZ-RZDIXWSQSA-N 2 0 351.332 4.158 20 0 FIADRP Cc1cc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462845946 1117817032 /nfs/dbraw/zinc/81/70/32/1117817032.db2.gz RWQIDACNXIRXTG-QGZVFWFLSA-N 2 0 373.928 4.054 20 0 FIADRP CCC[N@H+](C)C[C@H]1CCN(c2cc(C)[nH+]c3ccc(OC(F)F)cc32)C1 ZINC000462942323 1117871490 /nfs/dbraw/zinc/87/14/90/1117871490.db2.gz LAUWMCJQWUVIJM-OAHLLOKOSA-N 2 0 363.452 4.313 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(-c2ccccc2)cc1 ZINC000540158400 1117903254 /nfs/dbraw/zinc/90/32/54/1117903254.db2.gz QUHVESKPOGMCKR-GKVQRAMASA-N 2 0 364.533 4.382 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2c(s1)CCCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000540167232 1117910834 /nfs/dbraw/zinc/91/08/34/1117910834.db2.gz SNPAORIOIKJHJU-MRXNPFEDSA-N 2 0 358.551 4.418 20 0 FIADRP Cc1csc(CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1 ZINC000463106569 1117967265 /nfs/dbraw/zinc/96/72/65/1117967265.db2.gz AOTININTOOQWIE-AZUAARDMSA-N 2 0 357.567 4.417 20 0 FIADRP Cc1cc([C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CC2)ccc1F ZINC000540299886 1117975224 /nfs/dbraw/zinc/97/52/24/1117975224.db2.gz UNPKEIOAMOEXAE-JOCHJYFZSA-N 2 0 356.485 4.315 20 0 FIADRP CC(C)(C)[C@@H]1OCCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463133158 1117984297 /nfs/dbraw/zinc/98/42/97/1117984297.db2.gz DJKAYHTUBBJPHQ-RBBKRZOGSA-N 2 0 358.570 4.124 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(Cc2ccccc2Cl)CC1 ZINC000463138933 1117986592 /nfs/dbraw/zinc/98/65/92/1117986592.db2.gz FOHSSHHHXRJPBD-SFHVURJKSA-N 2 0 363.977 4.159 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@H]3CCCc4cc(F)ccc43)c2)CCO1 ZINC000540408559 1118038575 /nfs/dbraw/zinc/03/85/75/1118038575.db2.gz MCWHGMVKJYZPLL-HXOBKFHXSA-N 2 0 368.496 4.214 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCCC[NH+](C)C ZINC000540418024 1118044487 /nfs/dbraw/zinc/04/44/87/1118044487.db2.gz YPUPTGMXJUVKHC-LRDDRELGSA-N 2 0 357.361 4.163 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3CCO[C@@H]3c3ccccc3)CC2)cc1 ZINC000463274047 1118073751 /nfs/dbraw/zinc/07/37/51/1118073751.db2.gz CCMFPJSYFQJMLK-ISKFKSNPSA-N 2 0 364.533 4.061 20 0 FIADRP C[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Oc1ccccc1 ZINC000540493481 1118091255 /nfs/dbraw/zinc/09/12/55/1118091255.db2.gz BAMTVGHIAHMYNP-RXVVDRJESA-N 2 0 366.505 4.032 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)C[C@H]1C ZINC000540548440 1118120364 /nfs/dbraw/zinc/12/03/64/1118120364.db2.gz UXEDXITUXVNQAH-TZIWHRDSSA-N 2 0 374.569 4.187 20 0 FIADRP C[C@@H](C[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000540595034 1118138979 /nfs/dbraw/zinc/13/89/79/1118138979.db2.gz SLFRICRCRKOGHY-LPHOPBHVSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@H](C[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000540595032 1118139200 /nfs/dbraw/zinc/13/92/00/1118139200.db2.gz SLFRICRCRKOGHY-APWZRJJASA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000540708154 1118196171 /nfs/dbraw/zinc/19/61/71/1118196171.db2.gz MSJJAKRYPUVTDX-RBBKRZOGSA-N 2 0 356.510 4.205 20 0 FIADRP CCc1ccc([C@H](CC)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000540992091 1118341756 /nfs/dbraw/zinc/34/17/56/1118341756.db2.gz UVJQBSCUYXWKME-ZEQRLZLVSA-N 2 0 366.549 4.447 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)N(C)[C@H](C)c2ccccc2)CC1 ZINC000541084247 1118376486 /nfs/dbraw/zinc/37/64/86/1118376486.db2.gz MJEYDKXDGZGJHY-HXUWFJFHSA-N 2 0 373.585 4.040 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)CC2)cc1 ZINC000464070102 1118429921 /nfs/dbraw/zinc/42/99/21/1118429921.db2.gz ITBNTGCXWDMDHU-XPWALMASSA-N 2 0 356.554 4.084 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000541215499 1118430899 /nfs/dbraw/zinc/43/08/99/1118430899.db2.gz DVNKLMSHNCLXKQ-RZUBCFFCSA-N 2 0 368.569 4.285 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Br)[C@H](C)C1 ZINC000541281476 1118462141 /nfs/dbraw/zinc/46/21/41/1118462141.db2.gz HUCZHWNKDOUKRQ-QAPCUYQASA-N 2 0 353.348 4.044 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000541384177 1118496581 /nfs/dbraw/zinc/49/65/81/1118496581.db2.gz PIBNINGYTSYDPS-GOSISDBHSA-N 2 0 371.488 4.013 20 0 FIADRP O=C1CC[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)c2ccccc2N1 ZINC000541545905 1118550753 /nfs/dbraw/zinc/55/07/53/1118550753.db2.gz PPIOJLUXVYWVIE-LJQANCHMSA-N 2 0 369.534 4.023 20 0 FIADRP Cc1ccccc1OCCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845037 1118718788 /nfs/dbraw/zinc/71/87/88/1118718788.db2.gz DBUDZBVTNPENLR-JOCHJYFZSA-N 2 0 352.522 4.218 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[NH+]3C(C)C)cc1)C(C)C ZINC000465366117 1118930390 /nfs/dbraw/zinc/93/03/90/1118930390.db2.gz RFAQOLQYAWSXFN-YADHBBJMSA-N 2 0 371.569 4.004 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3sc(C)nc3C)CC2)cc1 ZINC000178157255 1119374261 /nfs/dbraw/zinc/37/42/61/1119374261.db2.gz QPSSRPMNACQUJB-HNNXBMFYSA-N 2 0 373.566 4.331 20 0 FIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000178284065 1119382085 /nfs/dbraw/zinc/38/20/85/1119382085.db2.gz XXZZRQSQWJLYOR-SFHVURJKSA-N 2 0 358.551 4.470 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311994850 1119397108 /nfs/dbraw/zinc/39/71/08/1119397108.db2.gz SSARSCPBBXKVOU-LPHOPBHVSA-N 2 0 360.448 4.288 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(-n3ccnc3)cs2)CC1 ZINC000542465704 1119448371 /nfs/dbraw/zinc/44/83/71/1119448371.db2.gz JZDJXFAKNOTEKE-SFHVURJKSA-N 2 0 372.582 4.410 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183155225 1119567012 /nfs/dbraw/zinc/56/70/12/1119567012.db2.gz WGQFNLPYSZFWGF-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000183155189 1119567062 /nfs/dbraw/zinc/56/70/62/1119567062.db2.gz WGQFNLPYSZFWGF-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCCC2=O)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183998 1119568450 /nfs/dbraw/zinc/56/84/50/1119568450.db2.gz WUFXWSIDAOHZKB-NLWGTHIKSA-N 2 0 369.553 4.117 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(-n2ccnc2)cc1 ZINC000183190287 1119568526 /nfs/dbraw/zinc/56/85/26/1119568526.db2.gz GEMFAJHZLWHZTL-CMKODMSKSA-N 2 0 352.526 4.176 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183190325 1119568575 /nfs/dbraw/zinc/56/85/75/1119568575.db2.gz GEMFAJHZLWHZTL-NLWGTHIKSA-N 2 0 352.526 4.176 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cncc(C)c2)CC1 ZINC000184346449 1119604421 /nfs/dbraw/zinc/60/44/21/1119604421.db2.gz XMGCDKIBFUJQFM-MSOLQXFVSA-N 2 0 370.516 4.083 20 0 FIADRP Cc1nc2ccc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc2s1 ZINC000494352503 1119833111 /nfs/dbraw/zinc/83/31/11/1119833111.db2.gz UXOKEDXXCWNUGO-UHFFFAOYSA-N 2 0 351.519 4.490 20 0 FIADRP Cc1nc2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cc2s1 ZINC000494355711 1119834232 /nfs/dbraw/zinc/83/42/32/1119834232.db2.gz HJJOUFAZLJHBEE-UHFFFAOYSA-N 2 0 351.519 4.490 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC000189191199 1119852288 /nfs/dbraw/zinc/85/22/88/1119852288.db2.gz AQBZWOLGIYXJFC-UHFFFAOYSA-N 2 0 350.865 4.099 20 0 FIADRP CC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000191460207 1119978334 /nfs/dbraw/zinc/97/83/34/1119978334.db2.gz HHSVBVYCGTXTQO-IBGZPJMESA-N 2 0 357.542 4.232 20 0 FIADRP CCC1(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000494621175 1120000086 /nfs/dbraw/zinc/00/00/86/1120000086.db2.gz NQWVNSPNMFFRAL-BHIFYINESA-N 2 0 368.565 4.226 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccnn1-c1ccccc1 ZINC000467384315 1120035922 /nfs/dbraw/zinc/03/59/22/1120035922.db2.gz VVNXLXBEOPEDTG-FQEVSTJZSA-N 2 0 374.532 4.435 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cnn1C(C)(C)C ZINC000195132447 1120119674 /nfs/dbraw/zinc/11/96/74/1120119674.db2.gz JRXJOOUDBYLEMS-YLJYHZDGSA-N 2 0 354.542 4.119 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]C2CCC(c3nc(C)no3)CC2)cc1 ZINC000494881272 1120354762 /nfs/dbraw/zinc/35/47/62/1120354762.db2.gz WFWKOIQZFHBQLI-UHFFFAOYSA-N 2 0 356.514 4.036 20 0 FIADRP C[C@H]([NH2+]CCc1cccc(OC(F)(F)F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542533268 1120431705 /nfs/dbraw/zinc/43/17/05/1120431705.db2.gz KXLAJIIEBCQYKG-RDJZCZTQSA-N 2 0 370.459 4.370 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)C1CCCC1 ZINC000495076345 1120459583 /nfs/dbraw/zinc/45/95/83/1120459583.db2.gz ZFHHEMBUIWYDRW-WMZHIEFXSA-N 2 0 356.554 4.317 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)C1CCCC1 ZINC000495080582 1120464120 /nfs/dbraw/zinc/46/41/20/1120464120.db2.gz RBSXKADDWUCJLT-DNVJHFABSA-N 2 0 356.554 4.194 20 0 FIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000670153973 1120710125 /nfs/dbraw/zinc/71/01/25/1120710125.db2.gz SFLCCHJPFFMXGP-SCTDSRPQSA-N 2 0 363.343 4.433 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495434251 1120809525 /nfs/dbraw/zinc/80/95/25/1120809525.db2.gz REDPQJITYKWERW-MZKRTTBSSA-N 2 0 374.532 4.434 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(C)cc2)CC1 ZINC000236984532 1120972133 /nfs/dbraw/zinc/97/21/33/1120972133.db2.gz XBCFJGXRIWTLNW-SFHVURJKSA-N 2 0 355.501 4.127 20 0 FIADRP Clc1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)ccn1 ZINC000762925218 1120997879 /nfs/dbraw/zinc/99/78/79/1120997879.db2.gz FFCHSYPPRNAYFG-UHFFFAOYSA-N 2 0 355.913 4.223 20 0 FIADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(Br)s3)s2)C1 ZINC001235750962 1121116327 /nfs/dbraw/zinc/11/63/27/1121116327.db2.gz TXXYXMRPHGSZIZ-JTQLQIEISA-N 2 0 357.342 4.020 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000155083646 1121177713 /nfs/dbraw/zinc/17/77/13/1121177713.db2.gz NSLMHZIZAIDTDU-ZWKOTPCHSA-N 2 0 365.521 4.320 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000397541028 1121213729 /nfs/dbraw/zinc/21/37/29/1121213729.db2.gz AWRHWFSDIAEFEW-KRWDZBQOSA-N 2 0 358.551 4.043 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000397563466 1121223194 /nfs/dbraw/zinc/22/31/94/1121223194.db2.gz ZKWVZGAMERUQFF-QGZVFWFLSA-N 2 0 358.913 4.018 20 0 FIADRP Cc1cc(C)n(-c2ccccc2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000123493158 1121610131 /nfs/dbraw/zinc/61/01/31/1121610131.db2.gz BBPVTHJYCSTOSH-UHFFFAOYSA-N 2 0 366.553 4.376 20 0 FIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)o2)cc1 ZINC000123612151 1121618090 /nfs/dbraw/zinc/61/80/90/1121618090.db2.gz ADZJPTUHPRYMRL-KRWDZBQOSA-N 2 0 356.514 4.160 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123618738 1121619157 /nfs/dbraw/zinc/61/91/57/1121619157.db2.gz SNZWHHDZANUSJM-IBGZPJMESA-N 2 0 373.585 4.499 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000671743238 1121653229 /nfs/dbraw/zinc/65/32/29/1121653229.db2.gz XXCJPNNWZBQWAW-INIZCTEOSA-N 2 0 365.477 4.096 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccc(OC)cc3)o2)CC1 ZINC000065448582 1121675530 /nfs/dbraw/zinc/67/55/30/1121675530.db2.gz QBDLSZZPDOWXJV-UHFFFAOYSA-N 2 0 371.525 4.294 20 0 FIADRP COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000124602213 1121707600 /nfs/dbraw/zinc/70/76/00/1121707600.db2.gz AHWSGHCEMWOZDJ-QRVBRYPASA-N 2 0 368.521 4.155 20 0 FIADRP COc1ccc2oc(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)cc2c1 ZINC000124904260 1121730525 /nfs/dbraw/zinc/73/05/25/1121730525.db2.gz UVYPQGQVESFORJ-UHFFFAOYSA-N 2 0 368.477 4.062 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1 ZINC000125567385 1121792229 /nfs/dbraw/zinc/79/22/29/1121792229.db2.gz QGMPWNFSJNRXBP-RBUKOAKNSA-N 2 0 374.573 4.333 20 0 FIADRP CCCN(C)[C@@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764442 1121798620 /nfs/dbraw/zinc/79/86/20/1121798620.db2.gz IWQIVHGFKUOXPP-UZLBHIALSA-N 2 0 351.966 4.043 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c(C)n1 ZINC000126444365 1121955466 /nfs/dbraw/zinc/95/54/66/1121955466.db2.gz LTTZWBIUOPNAKJ-QGZVFWFLSA-N 2 0 352.526 4.176 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000126476831 1121958900 /nfs/dbraw/zinc/95/89/00/1121958900.db2.gz GWTIPSNZLUSQBS-SRBWVJFJSA-N 2 0 352.526 4.155 20 0 FIADRP CCn1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)cn1 ZINC000112096254 1121963166 /nfs/dbraw/zinc/96/31/66/1121963166.db2.gz APDUKQNMAGOYLC-UHFFFAOYSA-N 2 0 374.532 4.456 20 0 FIADRP CCCC[NH+]1CCC(C[NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608798 1121970726 /nfs/dbraw/zinc/97/07/26/1121970726.db2.gz DNXJLCOXCMBZTC-UNMCSNQZSA-N 2 0 360.542 4.017 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126664008 1121974832 /nfs/dbraw/zinc/97/48/32/1121974832.db2.gz UTYHKTQBOOAEJV-VFNWGFHPSA-N 2 0 371.475 4.055 20 0 FIADRP CC(C)N(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(C)C ZINC000497275609 1121992376 /nfs/dbraw/zinc/99/23/76/1121992376.db2.gz KTLNMHFBIJBZSF-HXUWFJFHSA-N 2 0 373.585 4.186 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2c(F)cccc2F)cc1 ZINC000917008329 1122000041 /nfs/dbraw/zinc/00/00/41/1122000041.db2.gz JQNNPQFWRIUWJD-HRAATJIYSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)c(F)c3)cc2)C1 ZINC000917008509 1122000215 /nfs/dbraw/zinc/00/02/15/1122000215.db2.gz KUSABSRGESQXPO-ZHRRBRCNSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001168611641 1122009391 /nfs/dbraw/zinc/00/93/91/1122009391.db2.gz WJOYKVYUNLVRHQ-FXAWDEMLSA-N 2 0 360.542 4.156 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168613677 1122019854 /nfs/dbraw/zinc/01/98/54/1122019854.db2.gz JYCIXDXMBLTLHU-FPOVZHCZSA-N 2 0 360.542 4.015 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([N@@H+](Cc3ccccc3)C[C@H](C)C[NH3+])CCO2)cc1 ZINC001168615489 1122068842 /nfs/dbraw/zinc/06/88/42/1122068842.db2.gz OFDINLDFYPIIFB-AAIMPIBUSA-N 2 0 368.521 4.012 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)CCO2)cc1 ZINC001168616021 1122099040 /nfs/dbraw/zinc/09/90/40/1122099040.db2.gz QEERKWQTBIGAJH-JTHBVZDNSA-N 2 0 372.553 4.160 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)c1 ZINC000186407569 1122100101 /nfs/dbraw/zinc/10/01/01/1122100101.db2.gz LSKRLIFKHPKXGF-UHFFFAOYSA-N 2 0 368.521 4.462 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000186406344 1122100138 /nfs/dbraw/zinc/10/01/38/1122100138.db2.gz ZSKPFJDGOMPPDO-UHFFFAOYSA-N 2 0 368.521 4.462 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC001168619661 1122167451 /nfs/dbraw/zinc/16/74/51/1122167451.db2.gz ZLUHQBNBAOWUMR-REWPJTCUSA-N 2 0 372.553 4.302 20 0 FIADRP CC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000128292635 1122224986 /nfs/dbraw/zinc/22/49/86/1122224986.db2.gz NXRXRSZAGUXMQR-SFHVURJKSA-N 2 0 358.357 4.062 20 0 FIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542693568 1122289120 /nfs/dbraw/zinc/28/91/20/1122289120.db2.gz JVPIFISCNOFNHN-DQHWKFJXSA-N 2 0 356.460 4.478 20 0 FIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000128565547 1122346595 /nfs/dbraw/zinc/34/65/95/1122346595.db2.gz RGJQQJBYOVONRQ-FQEVSTJZSA-N 2 0 351.538 4.032 20 0 FIADRP C[C@H]([NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000556094859 1122648165 /nfs/dbraw/zinc/64/81/65/1122648165.db2.gz ZGQPJHHNVKJTNG-AVCGJXAMSA-N 2 0 360.505 4.358 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1cnn(C)c1 ZINC000129861302 1122705294 /nfs/dbraw/zinc/70/52/94/1122705294.db2.gz JPTAVLOIQIEBRQ-QFIPXVFZSA-N 2 0 354.542 4.426 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)[C@@H](C)C1 ZINC000556216719 1122735452 /nfs/dbraw/zinc/73/54/52/1122735452.db2.gz JGGIOVATYXMTOU-LPHOPBHVSA-N 2 0 354.485 4.025 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCC[C@H]3C3CC3)C3(C2)CCOCC3)cc1 ZINC000556233538 1122751155 /nfs/dbraw/zinc/75/11/55/1122751155.db2.gz QJHWRGCRBSRDQZ-VABKMULXSA-N 2 0 368.565 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCC[C@@H]3C3CC3)C3(C2)CCOCC3)cc1 ZINC000556233546 1122751324 /nfs/dbraw/zinc/75/13/24/1122751324.db2.gz QJHWRGCRBSRDQZ-ZRBLBEILSA-N 2 0 368.565 4.084 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2CCOCC2)c2ccc(F)cc2)CC1 ZINC000556237541 1122754276 /nfs/dbraw/zinc/75/42/76/1122754276.db2.gz FISRUEOCOFWVKG-JOCHJYFZSA-N 2 0 362.533 4.395 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1Br ZINC000556230776 1122757036 /nfs/dbraw/zinc/75/70/36/1122757036.db2.gz ASAWZUVYPWDICP-HNNXBMFYSA-N 2 0 369.347 4.374 20 0 FIADRP CC(C)c1nnc([C@@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)[nH]1 ZINC000556262794 1122771863 /nfs/dbraw/zinc/77/18/63/1122771863.db2.gz XLPJVVYTWKTGOX-IPJUCJBFSA-N 2 0 355.530 4.022 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccco1)c1ccc(Br)cc1 ZINC000498444003 1122804788 /nfs/dbraw/zinc/80/47/88/1122804788.db2.gz OCQNIYUXEOZXBD-QGZVFWFLSA-N 2 0 351.288 4.063 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc(F)cc(Cl)c3)cc2)CC1 ZINC000556408831 1122875154 /nfs/dbraw/zinc/87/51/54/1122875154.db2.gz FQJCTCHXKAMVAP-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP CC(C)OCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556891907 1123179312 /nfs/dbraw/zinc/17/93/12/1123179312.db2.gz HHVRNECLRFAXGC-XPWALMASSA-N 2 0 358.570 4.472 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000131791568 1123187498 /nfs/dbraw/zinc/18/74/98/1123187498.db2.gz CBIFVIANFGLJPQ-DSKINZAPSA-N 2 0 362.558 4.119 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CCc1nccn1Cc1ccccc1 ZINC000132146744 1123222535 /nfs/dbraw/zinc/22/25/35/1123222535.db2.gz GDTFFCJVGWNXMT-OAQYLSRUSA-N 2 0 361.489 4.286 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499138843 1123281248 /nfs/dbraw/zinc/28/12/48/1123281248.db2.gz JOWDFWCAYNVKNS-BUZMGHMJSA-N 3 0 369.597 4.426 20 0 FIADRP C[C@H]1CCC[N@@H+](C(C)(C)CN[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499145498 1123286540 /nfs/dbraw/zinc/28/65/40/1123286540.db2.gz HDYNTLWATNIGCA-XXTHSBEZSA-N 2 0 369.597 4.282 20 0 FIADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499158123 1123298385 /nfs/dbraw/zinc/29/83/85/1123298385.db2.gz RSQKKRXQADZBKE-IFPLKCGESA-N 2 0 356.554 4.367 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1C ZINC000499163955 1123301826 /nfs/dbraw/zinc/30/18/26/1123301826.db2.gz JIWGDMBZOBABLS-OWZKRDHZSA-N 2 0 369.578 4.342 20 0 FIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1 ZINC000132646834 1123312979 /nfs/dbraw/zinc/31/29/79/1123312979.db2.gz JOBIXPXQICVBPN-IBGZPJMESA-N 2 0 352.522 4.111 20 0 FIADRP CCCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133105633 1123421096 /nfs/dbraw/zinc/42/10/96/1123421096.db2.gz YOYGSVIHMVHQFK-WOJBJXKFSA-N 2 0 374.569 4.407 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133155181 1123436527 /nfs/dbraw/zinc/43/65/27/1123436527.db2.gz OXSAUGUVPZFKHB-PMACEKPBSA-N 2 0 374.569 4.263 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCOC1 ZINC000133413189 1123485287 /nfs/dbraw/zinc/48/52/87/1123485287.db2.gz GRRQWVOXZNZKRB-GMAHTHKFSA-N 2 0 352.522 4.320 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1ccc(-c2ccccc2Cl)o1 ZINC000236938722 1123584922 /nfs/dbraw/zinc/58/49/22/1123584922.db2.gz NJKGUVHBTHJYFV-OAHLLOKOSA-N 2 0 350.890 4.046 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000134189080 1123602909 /nfs/dbraw/zinc/60/29/09/1123602909.db2.gz OGOSGNINARULOQ-UHFFFAOYSA-N 2 0 353.485 4.196 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccccc1 ZINC000615316034 1123988835 /nfs/dbraw/zinc/98/88/35/1123988835.db2.gz HXXRXNPFWLUMFE-MOPGFXCFSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(CO)c1 ZINC000245612357 1124140916 /nfs/dbraw/zinc/14/09/16/1124140916.db2.gz JWXOKLWDAQWERD-RTBURBONSA-N 2 0 352.522 4.262 20 0 FIADRP OCCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245737522 1124228935 /nfs/dbraw/zinc/22/89/35/1124228935.db2.gz RAFRUBAGZDADFU-XQUALCHDSA-N 2 0 364.533 4.285 20 0 FIADRP COCc1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245775690 1124247186 /nfs/dbraw/zinc/24/71/86/1124247186.db2.gz XZSWVHSXONDNTA-WBDAEOGXSA-N 2 0 350.506 4.118 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000246302696 1124440388 /nfs/dbraw/zinc/44/03/88/1124440388.db2.gz DEHAHHOCHRNDHX-SLFFLAALSA-N 2 0 350.934 4.149 20 0 FIADRP CCCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1 ZINC000542846111 1124443580 /nfs/dbraw/zinc/44/35/80/1124443580.db2.gz JWAVGAPXJVDRGJ-GOTSBHOMSA-N 2 0 352.522 4.274 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)[C@@H](C)C1 ZINC000246564051 1124534641 /nfs/dbraw/zinc/53/46/41/1124534641.db2.gz FFCKNVLHHXJKEK-YWZLYKJASA-N 2 0 372.944 4.268 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000246916837 1124573189 /nfs/dbraw/zinc/57/31/89/1124573189.db2.gz GCCWQQHCIPLPHZ-VAMGGRTRSA-N 2 0 367.537 4.289 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)c1cccc(OCC[NH+](C)C)c1 ZINC000246920085 1124573408 /nfs/dbraw/zinc/57/34/08/1124573408.db2.gz GHRWQBKWOVDVOU-CDNPAEQRSA-N 2 0 368.521 4.198 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)[C@@H](C)C1 ZINC000247088396 1124589167 /nfs/dbraw/zinc/58/91/67/1124589167.db2.gz RKFVUAXRFXUNGU-YSSFQJQWSA-N 2 0 350.934 4.054 20 0 FIADRP [NH3+]CC1CC[NH+](Cc2ccc(-c3ccc(Br)s3)s2)CC1 ZINC001205041272 1124717828 /nfs/dbraw/zinc/71/78/28/1124717828.db2.gz RUVLBEVEMNLNAQ-UHFFFAOYSA-N 2 0 371.369 4.410 20 0 FIADRP CN1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000248120073 1124743558 /nfs/dbraw/zinc/74/35/58/1124743558.db2.gz NFYADQVIDAVOQZ-PBHICJAKSA-N 2 0 359.514 4.258 20 0 FIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000248161995 1124747929 /nfs/dbraw/zinc/74/79/29/1124747929.db2.gz SGYHSOYJXZZQMG-LPHOPBHVSA-N 2 0 373.566 4.006 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248396050 1124759812 /nfs/dbraw/zinc/75/98/12/1124759812.db2.gz GSSAIRGZWAVIIX-IDZYALCFSA-N 2 0 367.537 4.285 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc(F)ccc1F ZINC000248434432 1124768221 /nfs/dbraw/zinc/76/82/21/1124768221.db2.gz DWUJRNAHHQMPFX-SIKLNZKXSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](C2CC2)[C@H]2CCCCO2)CC1 ZINC000655789025 1124803552 /nfs/dbraw/zinc/80/35/52/1124803552.db2.gz UAHNCFXQECIKCQ-SXSPYAJSSA-N 2 0 356.554 4.019 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168686007 1124823578 /nfs/dbraw/zinc/82/35/78/1124823578.db2.gz VLHCVJMGQBIHAN-UYAOXDASSA-N 2 0 354.925 4.309 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C2CC2)[C@H]2CCCCO2)CC1 ZINC000655789027 1124838995 /nfs/dbraw/zinc/83/89/95/1124838995.db2.gz UAHNCFXQECIKCQ-YSZBQJHXSA-N 2 0 356.554 4.019 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000249108334 1124843948 /nfs/dbraw/zinc/84/39/48/1124843948.db2.gz MANRUCRJQXVWNS-LTYHASHMSA-N 2 0 363.549 4.293 20 0 FIADRP COc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@H]4CCC[C@@H](C)C4)CC3)c21 ZINC000181331784 1124861693 /nfs/dbraw/zinc/86/16/93/1124861693.db2.gz GCZGWFQZEAUQIE-XLIONFOSSA-N 2 0 369.553 4.352 20 0 FIADRP Cc1cnn(CCCCC[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000249502423 1124861764 /nfs/dbraw/zinc/86/17/64/1124861764.db2.gz XPAPQNFTGUMDSW-SGRGSNTQSA-N 2 0 368.569 4.108 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+]Cc3ccccc3OCC3CC3)CC2)cc1 ZINC000063551446 1124928830 /nfs/dbraw/zinc/92/88/30/1124928830.db2.gz NDJFEKMJPGMHPU-UHFFFAOYSA-N 2 0 364.533 4.477 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000090417512 1124994731 /nfs/dbraw/zinc/99/47/31/1124994731.db2.gz HVHOJONUWFKUQC-WZONZLPQSA-N 2 0 356.554 4.278 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C ZINC000091261382 1125059933 /nfs/dbraw/zinc/05/99/33/1125059933.db2.gz PEACFWLREHVLCI-GJZGRUSLSA-N 2 0 350.938 4.388 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285600 1125062058 /nfs/dbraw/zinc/06/20/58/1125062058.db2.gz ZIBDMCHFEGEQOX-APWZRJJASA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)C1CCCC1 ZINC000091343539 1125066719 /nfs/dbraw/zinc/06/67/19/1125066719.db2.gz HWIHFHSBTVYVNV-JPYJTQIMSA-N 2 0 372.553 4.017 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCO[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000672601493 1125191807 /nfs/dbraw/zinc/19/18/07/1125191807.db2.gz HKYLOFAFWQEYOC-MOPGFXCFSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC(F)F)cc1 ZINC000092856880 1125247425 /nfs/dbraw/zinc/24/74/25/1125247425.db2.gz UTQBGWWQIQSHKJ-HNNXBMFYSA-N 2 0 361.436 4.250 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cnc2ccccc2c1 ZINC000499625915 1125366408 /nfs/dbraw/zinc/36/64/08/1125366408.db2.gz OCARCOQPNUAOHM-OALUTQOASA-N 2 0 359.517 4.481 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)ccc1OC ZINC000182353322 1125424094 /nfs/dbraw/zinc/42/40/94/1125424094.db2.gz JHNATDUKSXZQPI-QGZVFWFLSA-N 2 0 351.494 4.259 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccccc3)nc2)c1 ZINC000065976488 1125439544 /nfs/dbraw/zinc/43/95/44/1125439544.db2.gz BAKPLCXPFXIBMD-UHFFFAOYSA-N 2 0 360.505 4.274 20 0 FIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1OC ZINC000065976612 1125440241 /nfs/dbraw/zinc/44/02/41/1125440241.db2.gz AOPZGPQPGPVBFW-UHFFFAOYSA-N 2 0 356.510 4.224 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000093597713 1125452194 /nfs/dbraw/zinc/45/21/94/1125452194.db2.gz GMSRMPVBPVOLGV-FQEVSTJZSA-N 2 0 350.506 4.280 20 0 FIADRP c1cc2cc(CC[NH2+][C@H]3CCN(Cc4ccccc4)C4(CC4)C3)ccc2[nH]1 ZINC000563121647 568222623 /nfs/dbraw/zinc/22/26/23/568222623.db2.gz ADBKZOKJAPOGPV-QFIPXVFZSA-N 2 0 359.517 4.497 20 0 FIADRP Brc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000390782473 568226782 /nfs/dbraw/zinc/22/67/82/568226782.db2.gz SBIDJOAKUZFYII-IBGZPJMESA-N 2 0 373.338 4.451 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(C)cc2C)CC1 ZINC000303294479 568265093 /nfs/dbraw/zinc/26/50/93/568265093.db2.gz OUXGSOPGOHIBRK-IBGZPJMESA-N 2 0 369.528 4.435 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc(C)ccc3F)CC2)cc1 ZINC000604891677 568381964 /nfs/dbraw/zinc/38/19/64/568381964.db2.gz LFOAWKGXPSNFKI-UHFFFAOYSA-N 2 0 356.485 4.145 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@H]2C2CC[NH2+]CC2)nc1 ZINC001164419813 718893483 /nfs/dbraw/zinc/89/34/83/718893483.db2.gz RDBISPNAAPOEHH-VXKWHMMOSA-N 2 0 370.585 4.377 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2OCc2ccccn2)CC1 ZINC000093688517 1125491803 /nfs/dbraw/zinc/49/18/03/1125491803.db2.gz CEVZZRPXHOQPEQ-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)ccc1OC ZINC000182505926 1125539776 /nfs/dbraw/zinc/53/97/76/1125539776.db2.gz HZMIWOWGPIBDON-HNNXBMFYSA-N 2 0 361.917 4.436 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2cccs2)c1 ZINC000093961898 1125545563 /nfs/dbraw/zinc/54/55/63/1125545563.db2.gz GDMXMVSTHMFUOV-UHFFFAOYSA-N 2 0 368.550 4.279 20 0 FIADRP CCc1cnccc1[C@@H](C)[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccncc1CC ZINC000543051358 1125565875 /nfs/dbraw/zinc/56/58/75/1125565875.db2.gz AKHQHVRSRVRASY-BCDXTJNWSA-N 2 0 354.542 4.239 20 0 FIADRP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC001648785837 1079569581 /nfs/dbraw/zinc/56/95/81/1079569581.db2.gz HSNLNFXWOWAOLG-RDPSFJRHSA-N 2 0 363.549 4.287 20 0 FIADRP Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cc(OC(F)F)ccc2[nH+]1 ZINC000579746300 1079603569 /nfs/dbraw/zinc/60/35/69/1079603569.db2.gz HQUKXKRPXHRISW-YIONKMFJSA-N 2 0 361.436 4.206 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546893 1079672077 /nfs/dbraw/zinc/67/20/77/1079672077.db2.gz WMJZWRFBSIFUSZ-IFMALSPDSA-N 2 0 368.496 4.382 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc(C)c1F ZINC000579820549 1079962130 /nfs/dbraw/zinc/96/21/30/1079962130.db2.gz NHFCCENXLIPKEH-KRWDZBQOSA-N 2 0 359.489 4.019 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CC1CCC(c2ccccc2)CC1 ZINC000547743966 1080373888 /nfs/dbraw/zinc/37/38/88/1080373888.db2.gz DBHUTXHPHSIVKV-UNWXKSQRSA-N 2 0 356.554 4.144 20 0 FIADRP CC(C)[C@@H](CN[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)[NH+]1CCC(C)CC1 ZINC001648791882 1080495677 /nfs/dbraw/zinc/49/56/77/1080495677.db2.gz CQSHYYJQVCOPJW-MDNUFGMLSA-N 2 0 357.586 4.168 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)CC3 ZINC000180713682 1080539047 /nfs/dbraw/zinc/53/90/47/1080539047.db2.gz VFYDSIMIBVLJMM-SFHVURJKSA-N 2 0 351.538 4.330 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)CC[C@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000236636452 1080884158 /nfs/dbraw/zinc/88/41/58/1080884158.db2.gz XNJOPOSPGZUCAR-QFIPXVFZSA-N 2 0 365.521 4.337 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(C(F)(F)F)cn2)CC1 ZINC000683520847 1081046085 /nfs/dbraw/zinc/04/60/85/1081046085.db2.gz CISKDCFPZJEIOB-UHFFFAOYSA-N 2 0 357.464 4.434 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc(O)ccc2Br)C1 ZINC001648811130 1081125806 /nfs/dbraw/zinc/12/58/06/1081125806.db2.gz FGFAVANTHTVPOK-GASCZTMLSA-N 2 0 369.347 4.002 20 0 FIADRP Cc1nn(-c2ccccc2Cl)cc1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000655753387 1081171121 /nfs/dbraw/zinc/17/11/21/1081171121.db2.gz ZSBHQWDUEKFLQM-UHFFFAOYSA-N 2 0 360.933 4.044 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C)o2)c1 ZINC000121013534 1081194301 /nfs/dbraw/zinc/19/43/01/1081194301.db2.gz VZKWUUFCGKXAJT-UHFFFAOYSA-N 2 0 352.482 4.110 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000655848603 1081257359 /nfs/dbraw/zinc/25/73/59/1081257359.db2.gz JEFWVMMYWFOEMV-DUXKGJEZSA-N 2 0 357.542 4.134 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC001648826272 1081257724 /nfs/dbraw/zinc/25/77/24/1081257724.db2.gz AFGKJFQSVDPANY-UHFFFAOYSA-N 2 0 356.485 4.499 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3ccccc3nc2OC)c1 ZINC001648826664 1081262578 /nfs/dbraw/zinc/26/25/78/1081262578.db2.gz NISLENCTVZLRKV-UHFFFAOYSA-N 2 0 363.505 4.375 20 0 FIADRP Cc1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(C)c1Br ZINC001648835616 1081277614 /nfs/dbraw/zinc/27/76/14/1081277614.db2.gz XHBYBVOAJHGRAX-UHFFFAOYSA-N 2 0 351.332 4.030 20 0 FIADRP O[C@@H](C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1cccc2ccccc21 ZINC001167325463 1081404148 /nfs/dbraw/zinc/40/41/48/1081404148.db2.gz BTXVABYKOHKMRM-RDPSFJRHSA-N 2 0 366.549 4.461 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000397710769 1081451632 /nfs/dbraw/zinc/45/16/32/1081451632.db2.gz YTHOSBCTXDQPPM-OAQYLSRUSA-N 2 0 372.940 4.408 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cccc5cccnc54)C[C@@H]3C2)cc1 ZINC000312614218 1081459419 /nfs/dbraw/zinc/45/94/19/1081459419.db2.gz GEBXRVCSAWITEM-GGAORHGYSA-N 2 0 357.501 4.189 20 0 FIADRP C[N@H+](CCN1CC[NH+](Cc2cccc3ccccc32)CC1)Cc1ccccc1 ZINC001167336782 1081468545 /nfs/dbraw/zinc/46/85/45/1081468545.db2.gz BFSYBTIQGHYJHF-UHFFFAOYSA-N 2 0 373.544 4.089 20 0 FIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1 ZINC000537956460 1081504697 /nfs/dbraw/zinc/50/46/97/1081504697.db2.gz RQIRBZVHWMPONH-SLFFLAALSA-N 2 0 350.934 4.149 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](C(=O)c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000656127335 1081715742 /nfs/dbraw/zinc/71/57/42/1081715742.db2.gz ZIGIYZQFVPJRMK-CECAUBDESA-N 2 0 361.489 4.022 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000580262205 1081786649 /nfs/dbraw/zinc/78/66/49/1081786649.db2.gz ONDTXMDDESECEQ-ZDUSSCGKSA-N 2 0 360.383 4.445 20 0 FIADRP CCN(C(=O)c1ccc([C@H](C)[NH3+])cc1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000580442652 1081949258 /nfs/dbraw/zinc/94/92/58/1081949258.db2.gz KWHXTBRCXLIVIB-SPEDKVCISA-N 2 0 365.521 4.004 20 0 FIADRP CSC1(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)CC[NH+](C)CC1 ZINC000580643385 1082063060 /nfs/dbraw/zinc/06/30/60/1082063060.db2.gz FATYSHFPSLDDFU-UHFFFAOYSA-N 2 0 368.974 4.046 20 0 FIADRP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](CCc2ccc(C(C)(C)C)cc2)CC1 ZINC000580745972 1082120038 /nfs/dbraw/zinc/12/00/38/1082120038.db2.gz DBSABHFRJRYEOS-OYRHEFFESA-N 2 0 371.613 4.017 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@H]([NH3+])c2ccccc2)cc1 ZINC000580890675 1082207963 /nfs/dbraw/zinc/20/79/63/1082207963.db2.gz OWAHVXDELALJSZ-GCJKJVERSA-N 2 0 365.521 4.480 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)C2CCC2)cc1 ZINC000581274988 1082427771 /nfs/dbraw/zinc/42/77/71/1082427771.db2.gz MSQBBSRRZFYXHS-QHCPKHFHSA-N 2 0 367.537 4.352 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1CCCCCC1 ZINC000510389886 1082477446 /nfs/dbraw/zinc/47/74/46/1082477446.db2.gz UHKABTCRXCCKQB-MOPGFXCFSA-N 2 0 357.542 4.264 20 0 FIADRP [NH3+]C[C@H](Cc1ccccc1)[C@H]1CCCC[N@@H+]1Cc1scnc1C1CC1 ZINC000581429537 1082571793 /nfs/dbraw/zinc/57/17/93/1082571793.db2.gz PQYOHUZEVONNKQ-RBUKOAKNSA-N 2 0 355.551 4.193 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000581558889 1082662456 /nfs/dbraw/zinc/66/24/56/1082662456.db2.gz DXBBFTRJGWDQJG-ROUUACIJSA-N 2 0 355.482 4.022 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000581558890 1082662517 /nfs/dbraw/zinc/66/25/17/1082662517.db2.gz DXBBFTRJGWDQJG-ZWKOTPCHSA-N 2 0 355.482 4.022 20 0 FIADRP CCOCc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000581574976 1082672251 /nfs/dbraw/zinc/67/22/51/1082672251.db2.gz WQRRPOGTESFBRC-AUSIDOKSSA-N 2 0 352.522 4.223 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1F ZINC000656684023 1082717859 /nfs/dbraw/zinc/71/78/59/1082717859.db2.gz SAQCJIVYCSSKDF-NRFANRHFSA-N 2 0 359.464 4.313 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)C1 ZINC000647171284 1082772572 /nfs/dbraw/zinc/77/25/72/1082772572.db2.gz DWSYSRXXEMEJEB-FYYLOGMGSA-N 2 0 369.597 4.285 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000684394904 1082828341 /nfs/dbraw/zinc/82/83/41/1082828341.db2.gz OAHLTNVATQNGQA-WXFUMESZSA-N 2 0 363.549 4.213 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)[C@@H](C)C1 ZINC000430758016 1083146026 /nfs/dbraw/zinc/14/60/26/1083146026.db2.gz YHQTVEOAHDYVQP-OWCBBSPXSA-N 2 0 369.322 4.154 20 0 FIADRP C[C@@H](c1ccccc1F)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430923397 1083237765 /nfs/dbraw/zinc/23/77/65/1083237765.db2.gz DKQZXKQFIUWPSC-SFHVURJKSA-N 2 0 361.549 4.015 20 0 FIADRP Cc1cccc([C@@H](C)[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000430925464 1083238641 /nfs/dbraw/zinc/23/86/41/1083238641.db2.gz LSFDMVVHMZZLJW-HXUWFJFHSA-N 2 0 357.586 4.184 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000510800376 1083317139 /nfs/dbraw/zinc/31/71/39/1083317139.db2.gz ZAYPGAARTVBCHX-QGZVFWFLSA-N 2 0 372.940 4.478 20 0 FIADRP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000658266635 1083379496 /nfs/dbraw/zinc/37/94/96/1083379496.db2.gz XTVJQAHFXZJLPJ-DMKPSLHHSA-N 2 0 352.469 4.246 20 0 FIADRP CCOC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000658318692 1083406327 /nfs/dbraw/zinc/40/63/27/1083406327.db2.gz SDLCTOMDGZPNBT-HWELCPFYSA-N 2 0 356.554 4.226 20 0 FIADRP COc1cccc(C2([NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)CCC2)c1 ZINC000658323462 1083409578 /nfs/dbraw/zinc/40/95/78/1083409578.db2.gz LNNVMJQVXACKFF-GOSISDBHSA-N 2 0 368.521 4.366 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000192682940 1083510367 /nfs/dbraw/zinc/51/03/67/1083510367.db2.gz MCNZTCKSURZICL-JOCHJYFZSA-N 2 0 367.537 4.444 20 0 FIADRP Cc1nc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)sc1C ZINC000535673568 1083569139 /nfs/dbraw/zinc/56/91/39/1083569139.db2.gz AFGMKSRIJLOJGY-UHFFFAOYSA-N 2 0 355.551 4.248 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000535813178 1083685146 /nfs/dbraw/zinc/68/51/46/1083685146.db2.gz MQCHCRFCDQCQKV-UHFFFAOYSA-N 2 0 360.933 4.282 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccc(F)c2)s1 ZINC000535807966 1083693591 /nfs/dbraw/zinc/69/35/91/1083693591.db2.gz KKAUJRGCUBGBLF-MISYRCLQSA-N 2 0 374.525 4.238 20 0 FIADRP C[C@@H](c1nc2ccccc2o1)[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000181139705 1083811529 /nfs/dbraw/zinc/81/15/29/1083811529.db2.gz ZKDBSLCCIPEGMP-KSZLIROESA-N 2 0 371.525 4.100 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000181318887 1083871879 /nfs/dbraw/zinc/87/18/79/1083871879.db2.gz DEOKKHRSLAODOL-IERDGZPVSA-N 2 0 372.484 4.331 20 0 FIADRP CCOc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)ccc1OC ZINC000065976661 1083904377 /nfs/dbraw/zinc/90/43/77/1083904377.db2.gz NQUOXKNSASDNPT-UHFFFAOYSA-N 2 0 356.510 4.224 20 0 FIADRP C[C@@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177489963 1083999606 /nfs/dbraw/zinc/99/96/06/1083999606.db2.gz FHEAFNSXRZKUPE-FUHWJXTLSA-N 2 0 367.578 4.017 20 0 FIADRP CC[N@H+](CCC[NH+](C)C)Cc1cc(C)c(OCc2ccccn2)c(C)c1 ZINC000570318244 1084027873 /nfs/dbraw/zinc/02/78/73/1084027873.db2.gz DYZCJBFWWOMWFR-UHFFFAOYSA-N 2 0 355.526 4.051 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000511003157 1084100486 /nfs/dbraw/zinc/10/04/86/1084100486.db2.gz VETZXPSGJUPPRW-BTYIYWSLSA-N 2 0 372.484 4.113 20 0 FIADRP C[C@H](NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cc2n(n1)CCC2 ZINC000414055557 1084378158 /nfs/dbraw/zinc/37/81/58/1084378158.db2.gz CQORJYUSHVHLJY-ROUUACIJSA-N 2 0 352.526 4.055 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc2c(s1)CCCC2 ZINC000537970689 1084381194 /nfs/dbraw/zinc/38/11/94/1084381194.db2.gz HLFLKRPZLLCJRY-BRWVUGGUSA-N 2 0 350.572 4.167 20 0 FIADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@H](C)CCN3CC[NH+](C)CC3)cc2)c1 ZINC000472127778 1084425431 /nfs/dbraw/zinc/42/54/31/1084425431.db2.gz IRGMZNIHONBPSP-OAQYLSRUSA-N 2 0 365.565 4.086 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@@H]4CCC[C@@H](C)C4)CC3)CC2)c1 ZINC000582032415 1084493281 /nfs/dbraw/zinc/49/32/81/1084493281.db2.gz HGLIODLLXXBCKC-WIYYLYMNSA-N 2 0 356.554 4.360 20 0 FIADRP C[C@H](NCc1ccn(-c2ccc(Cl)cc2)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000467185402 1084658876 /nfs/dbraw/zinc/65/88/76/1084658876.db2.gz FFKOTSKFTDTLDX-IRXDYDNUSA-N 2 0 372.944 4.268 20 0 FIADRP CSC1(C[NH2+]CCCc2c(Cl)cccc2Cl)CC[NH+](C)CC1 ZINC000582115020 1084662082 /nfs/dbraw/zinc/66/20/82/1084662082.db2.gz TWVWXYZRHVNZIS-UHFFFAOYSA-N 2 0 361.382 4.343 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414181099 1084751722 /nfs/dbraw/zinc/75/17/22/1084751722.db2.gz MMPTYFPHZBNBLK-LPHOPBHVSA-N 2 0 357.567 4.425 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414181543 1084752190 /nfs/dbraw/zinc/75/21/90/1084752190.db2.gz MMPTYFPHZBNBLK-QFBILLFUSA-N 2 0 357.567 4.425 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)[C@H](C)C1 ZINC000414183705 1084760806 /nfs/dbraw/zinc/76/08/06/1084760806.db2.gz OAXOWFHDWUTSNH-VVWQDTPRSA-N 2 0 368.924 4.062 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000582208814 1084761468 /nfs/dbraw/zinc/76/14/68/1084761468.db2.gz NVXSPBDMHRHVHW-LLGFUMIMSA-N 2 0 369.553 4.265 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(C)c1 ZINC000582208920 1084762849 /nfs/dbraw/zinc/76/28/49/1084762849.db2.gz SNPGOKBLKDMSGT-OAQYLSRUSA-N 2 0 357.586 4.022 20 0 FIADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000414219985 1084846978 /nfs/dbraw/zinc/84/69/78/1084846978.db2.gz IKYNOWDUDYHSOF-DYRSVQDXSA-N 2 0 362.517 4.084 20 0 FIADRP COCc1csc(C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000657400185 1084903859 /nfs/dbraw/zinc/90/38/59/1084903859.db2.gz XASVASYQMOWOKW-IAGOWNOFSA-N 2 0 358.551 4.141 20 0 FIADRP COCc1csc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000657415572 1084957672 /nfs/dbraw/zinc/95/76/72/1084957672.db2.gz LAFINQVDDKSEHK-HKUYNNGSSA-N 2 0 358.551 4.285 20 0 FIADRP COCc1csc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000657415573 1084958009 /nfs/dbraw/zinc/95/80/09/1084958009.db2.gz LAFINQVDDKSEHK-IEBWSBKVSA-N 2 0 358.551 4.285 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000414296369 1084987999 /nfs/dbraw/zinc/98/79/99/1084987999.db2.gz FGLHNAXSFLKZCH-XLIONFOSSA-N 2 0 370.562 4.303 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)CC1 ZINC000472584088 1085049907 /nfs/dbraw/zinc/04/99/07/1085049907.db2.gz GOVNTAOTMZVGSZ-QDGLUTFLSA-N 2 0 369.597 4.361 20 0 FIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+]Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC000657454037 1085107133 /nfs/dbraw/zinc/10/71/33/1085107133.db2.gz DDHBSKDYPWSHOY-JCNLHEQBSA-N 2 0 372.394 4.322 20 0 FIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC000472231010 1085133766 /nfs/dbraw/zinc/13/37/66/1085133766.db2.gz IBQDRRUBWOQRKF-FQEVSTJZSA-N 2 0 352.522 4.272 20 0 FIADRP COc1cc(C[NH2+]CCCn2ccnc2C)c(-c2ccccc2)cc1OC ZINC000048750427 1085193750 /nfs/dbraw/zinc/19/37/50/1085193750.db2.gz YBGFPKJCDGZBCR-UHFFFAOYSA-N 2 0 365.477 4.056 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)C2)cc1 ZINC000684928076 1085195904 /nfs/dbraw/zinc/19/59/04/1085195904.db2.gz YQVCYVVFHVGJSS-SSGKUCQKSA-N 2 0 356.554 4.084 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000468857349 1085221313 /nfs/dbraw/zinc/22/13/13/1085221313.db2.gz HOOSWOZZDNXBBR-NHCUHLMSSA-N 2 0 363.977 4.043 20 0 FIADRP Clc1cc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c(Cl)s1 ZINC000657538355 1085455443 /nfs/dbraw/zinc/45/54/43/1085455443.db2.gz ZPCOGRGIIKFKIF-UHFFFAOYSA-N 2 0 363.354 4.036 20 0 FIADRP FC(F)(F)[C@H](CNC1CC[NH+](Cc2ccccc2)CC1)OC1CCCC1 ZINC000657587027 1085648479 /nfs/dbraw/zinc/64/84/79/1085648479.db2.gz OWRGHIOLSJDTCK-IBGZPJMESA-N 2 0 370.459 4.131 20 0 FIADRP O[C@H](C[C@@H]1CCCCC[N@@H+]1CCC[NH+]1CCCCC1)c1cccs1 ZINC000161400972 1085684149 /nfs/dbraw/zinc/68/41/49/1085684149.db2.gz KUFUJPWLNSLKDW-RBUKOAKNSA-N 2 0 350.572 4.292 20 0 FIADRP FC(F)(F)c1cccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000657611972 1085689894 /nfs/dbraw/zinc/68/98/94/1085689894.db2.gz GQOCGTMNWGSARV-UHFFFAOYSA-N 2 0 363.427 4.102 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000236874948 1085863601 /nfs/dbraw/zinc/86/36/01/1085863601.db2.gz VJQGADLKLWBXBU-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP CC(C)(CO)[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000090657613 1085871017 /nfs/dbraw/zinc/87/10/17/1085871017.db2.gz RVSCKBMJCHEBJW-JOCHJYFZSA-N 2 0 358.570 4.175 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347825 1085919128 /nfs/dbraw/zinc/91/91/28/1085919128.db2.gz MVCNFROEBZHNDE-SDCOAXJVSA-N 2 0 357.325 4.273 20 0 FIADRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(OC(F)F)cc1 ZINC000582994544 1086005063 /nfs/dbraw/zinc/00/50/63/1086005063.db2.gz GXRWCZQGSQHVTI-MRXNPFEDSA-N 2 0 358.498 4.156 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2OC(F)F)[C@@H](C)C1 ZINC000583174401 1086351959 /nfs/dbraw/zinc/35/19/59/1086351959.db2.gz AWZXJHNAOQRLAK-QNPCKFRZSA-N 2 0 352.469 4.353 20 0 FIADRP C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293730 1086398884 /nfs/dbraw/zinc/39/88/84/1086398884.db2.gz MMNVSZOITBJOGU-ZBFHGGJFSA-N 2 0 362.468 4.204 20 0 FIADRP c1ccc(Oc2cccnc2)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1 ZINC000662293930 1086399638 /nfs/dbraw/zinc/39/96/38/1086399638.db2.gz VGFOIXUAYUOBGO-LJQANCHMSA-N 2 0 351.494 4.086 20 0 FIADRP c1c(C2CC[NH+](Cc3cccc4ccccc43)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662328164 1086418362 /nfs/dbraw/zinc/41/83/62/1086418362.db2.gz ZLDKJNBJFSOGKF-UHFFFAOYSA-N 2 0 374.532 4.410 20 0 FIADRP O=C(C[C@@H]1[NH2+]Cc2ccccc21)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000662417838 1086434635 /nfs/dbraw/zinc/43/46/35/1086434635.db2.gz WXWORUTXPLNGQD-QFIPXVFZSA-N 2 0 363.505 4.236 20 0 FIADRP CC(C)[C@H](O)[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccccc1 ZINC000657745659 1086466140 /nfs/dbraw/zinc/46/61/40/1086466140.db2.gz JOYMRONJULOLSS-RPWUZVMVSA-N 2 0 366.549 4.041 20 0 FIADRP Cc1nccc([C@@H]2CCC[N@H+](Cc3ccc(C[NH+]4CCCCC4)cc3)C2)n1 ZINC000662504874 1086474811 /nfs/dbraw/zinc/47/48/11/1086474811.db2.gz GKERALXLSIECDU-JOCHJYFZSA-N 2 0 364.537 4.151 20 0 FIADRP c1csc([C@@H](Cc2ccncc2)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC000663467045 1086568986 /nfs/dbraw/zinc/56/89/86/1086568986.db2.gz ZFCATSARAAPNIX-WOJBJXKFSA-N 2 0 355.551 4.139 20 0 FIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511989780 1086582064 /nfs/dbraw/zinc/58/20/64/1086582064.db2.gz MEOUPPNUBBRVBC-FFJFPXHCSA-N 2 0 356.460 4.478 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COCc2ccncc2)C1 ZINC001167821045 1086583298 /nfs/dbraw/zinc/58/32/98/1086583298.db2.gz ACYRDDYXGDDIOA-WWNPGLIZSA-N 2 0 373.585 4.211 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N2Cc3ccccc3NC2=O)CC1 ZINC001167825218 1086612247 /nfs/dbraw/zinc/61/22/47/1086612247.db2.gz HOWCEBBQVAXKAI-GOSISDBHSA-N 2 0 372.557 4.009 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(OCc2ccccc2F)CC1 ZINC001167826192 1086615560 /nfs/dbraw/zinc/61/55/60/1086615560.db2.gz ONAIHTHIGGFQJO-SFHVURJKSA-N 2 0 350.522 4.317 20 0 FIADRP C[C@H]1C[N@H+](CCCNCc2ccc(-c3ccccc3Cl)o2)CCCO1 ZINC000432361200 1086659807 /nfs/dbraw/zinc/65/98/07/1086659807.db2.gz YPXMKUSDIBVROV-INIZCTEOSA-N 2 0 362.901 4.191 20 0 FIADRP C[C@H]1C[C@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000525641291 1086669123 /nfs/dbraw/zinc/66/91/23/1086669123.db2.gz ICHJBCDEXATZJG-PKOBYXMFSA-N 2 0 372.557 4.055 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CCCO1 ZINC000432413228 1086736596 /nfs/dbraw/zinc/73/65/96/1086736596.db2.gz LMBGGSLROUUIKV-DNVCBOLYSA-N 2 0 370.459 4.247 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4)cc3)C2)C1 ZINC000650705405 1086749172 /nfs/dbraw/zinc/74/91/72/1086749172.db2.gz GFJGPMZVMVFFFL-YTFSRNRJSA-N 2 0 350.506 4.072 20 0 FIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432424575 1086749233 /nfs/dbraw/zinc/74/92/33/1086749233.db2.gz PGUFCYTUUKMARB-NQIIRXRSSA-N 2 0 360.542 4.114 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000650706440 1086755810 /nfs/dbraw/zinc/75/58/10/1086755810.db2.gz KOJFAGDMBVZWKY-POAQFYNOSA-N 2 0 374.525 4.273 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)cn1 ZINC000512096774 1086763179 /nfs/dbraw/zinc/76/31/79/1086763179.db2.gz AKRNAUYWJYSNQC-RTBURBONSA-N 2 0 351.538 4.412 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3)cc2)C1 ZINC000650722569 1086819174 /nfs/dbraw/zinc/81/91/74/1086819174.db2.gz WQFLPBYVCWGERB-ZLNRFVROSA-N 2 0 350.506 4.214 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000650723009 1086822127 /nfs/dbraw/zinc/82/21/27/1086822127.db2.gz GFEKJMSDILSTOL-RLLQIKCJSA-N 2 0 374.525 4.415 20 0 FIADRP CC(C)n1ccc(C[C@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000583663670 1086907314 /nfs/dbraw/zinc/90/73/14/1086907314.db2.gz QEXOWUIFHAMUMQ-RBBKRZOGSA-N 2 0 368.569 4.287 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000650758391 1086973419 /nfs/dbraw/zinc/97/34/19/1086973419.db2.gz OKKNDZRVPYQEDR-GOSISDBHSA-N 2 0 350.384 4.082 20 0 FIADRP Fc1ccc(-c2nc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cs2)cc1 ZINC000657812227 1087078195 /nfs/dbraw/zinc/07/81/95/1087078195.db2.gz OYYJJANSMPSDLY-UHFFFAOYSA-N 2 0 359.514 4.161 20 0 FIADRP Cc1ccc(-c2ncc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)s2)cc1 ZINC000657813642 1087078547 /nfs/dbraw/zinc/07/85/47/1087078547.db2.gz VZBOKEGCBGWQRZ-UHFFFAOYSA-N 2 0 355.551 4.330 20 0 FIADRP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@@H](CNc4cccc(C)[nH+]4)C3)s2)o1 ZINC000092813393 1087105520 /nfs/dbraw/zinc/10/55/20/1087105520.db2.gz HBZGNCAZWKYAHU-INIZCTEOSA-N 2 0 368.506 4.349 20 0 FIADRP Cc1nc(C(C)C)oc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000428231265 1087158498 /nfs/dbraw/zinc/15/84/98/1087158498.db2.gz RAPNKARJTONXSR-UHFFFAOYSA-N 2 0 355.526 4.450 20 0 FIADRP Cc1cnc2n1CCC21CC[NH+](Cc2cc(C)cc(C(F)(F)F)c2)CC1 ZINC001143454323 1087288206 /nfs/dbraw/zinc/28/82/06/1087288206.db2.gz GCMLGOOMEWYMPP-UHFFFAOYSA-N 2 0 363.427 4.456 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000084018233 1087344875 /nfs/dbraw/zinc/34/48/75/1087344875.db2.gz JQVQJZPIVNLQHJ-IRXDYDNUSA-N 2 0 365.587 4.170 20 0 FIADRP CC(C)[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091283692 1087426599 /nfs/dbraw/zinc/42/65/99/1087426599.db2.gz IHQVIGAIFVNAFV-IBGZPJMESA-N 2 0 371.491 4.018 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1F)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000468384708 1087525815 /nfs/dbraw/zinc/52/58/15/1087525815.db2.gz RSYLRCBNVRMADC-ZDUSSCGKSA-N 2 0 369.322 4.126 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000685662367 1087668448 /nfs/dbraw/zinc/66/84/48/1087668448.db2.gz FSDWPRMQGKBZJU-WZONZLPQSA-N 2 0 352.522 4.299 20 0 FIADRP Fc1ccc(C2=CC[C@@H]([NH2+]CC3CC[NH+](C4CCOCC4)CC3)CC2)cc1 ZINC000658067714 1087709676 /nfs/dbraw/zinc/70/96/76/1087709676.db2.gz PSFJPXZMMGAUFC-JOCHJYFZSA-N 2 0 372.528 4.242 20 0 FIADRP Cc1ccc(C[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)cc1 ZINC000658068677 1087710249 /nfs/dbraw/zinc/71/02/49/1087710249.db2.gz XZPVDAIESYANTD-QHCPKHFHSA-N 2 0 358.570 4.043 20 0 FIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068546 1087710259 /nfs/dbraw/zinc/71/02/59/1087710259.db2.gz FYMGNFNSVKTAGV-LJQANCHMSA-N 2 0 358.570 4.427 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](c3cccs3)C3CCCC3)cc2)C1 ZINC000658140406 1087733618 /nfs/dbraw/zinc/73/36/18/1087733618.db2.gz QOBDEHGQNQIKBY-IRLDBZIGSA-N 2 0 370.562 4.336 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658143215 1087734995 /nfs/dbraw/zinc/73/49/95/1087734995.db2.gz XSORSJHFQDGXHX-FXAWDEMLSA-N 2 0 370.562 4.216 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658143152 1087735292 /nfs/dbraw/zinc/73/52/92/1087735292.db2.gz XBLBTDVJRHGEAL-JPYJTQIMSA-N 2 0 352.522 4.057 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](c3ccc(Cl)cc3)C3CC3)cc2)C1 ZINC000658137314 1087742016 /nfs/dbraw/zinc/74/20/16/1087742016.db2.gz GLCRBVPOYFJVAR-YADHBBJMSA-N 2 0 370.924 4.148 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000658163983 1087757360 /nfs/dbraw/zinc/75/73/60/1087757360.db2.gz MFCCEEAAXOJNRZ-FFZOFVMBSA-N 2 0 355.551 4.137 20 0 FIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000658168107 1087763003 /nfs/dbraw/zinc/76/30/03/1087763003.db2.gz VUFGICHDZAYAPO-RPWUZVMVSA-N 2 0 363.549 4.394 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168445 1087764599 /nfs/dbraw/zinc/76/45/99/1087764599.db2.gz XFDNBRYRORZESS-RBUKOAKNSA-N 2 0 367.537 4.084 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCC23CCOCC3)C1 ZINC000548861104 1087769964 /nfs/dbraw/zinc/76/99/64/1087769964.db2.gz GYYMNLUFYOGXFK-JQVVWYNYSA-N 2 0 356.554 4.213 20 0 FIADRP Cc1nc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)oc1-c1ccc(Cl)cc1 ZINC000424285562 1087896005 /nfs/dbraw/zinc/89/60/05/1087896005.db2.gz FUIZDTCXDUUAPU-AWEZNQCLSA-N 2 0 359.901 4.267 20 0 FIADRP Cc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc(OC(F)(F)F)c1 ZINC001143472707 1087945034 /nfs/dbraw/zinc/94/50/34/1087945034.db2.gz UFGMIHDFSIZJOQ-UHFFFAOYSA-N 2 0 356.432 4.201 20 0 FIADRP CCCOc1c(Cl)cc(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1OC ZINC000424378690 1087964249 /nfs/dbraw/zinc/96/42/49/1087964249.db2.gz NKVWQVHBASVZJD-OAHLLOKOSA-N 2 0 366.933 4.101 20 0 FIADRP c1c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)onc1-c1ccccc1 ZINC000057888667 1088034346 /nfs/dbraw/zinc/03/43/46/1088034346.db2.gz QCSCJWOVATZESM-UHFFFAOYSA-N 2 0 353.510 4.430 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414808314 1088180576 /nfs/dbraw/zinc/18/05/76/1088180576.db2.gz FCKWSMJRYJLFDF-GJZGRUSLSA-N 2 0 359.901 4.175 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414810470 1088200468 /nfs/dbraw/zinc/20/04/68/1088200468.db2.gz OERVQEYCAAWZPH-IAGOWNOFSA-N 2 0 353.510 4.337 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000414812617 1088225696 /nfs/dbraw/zinc/22/56/96/1088225696.db2.gz XOFSAXOAQGSOKR-OXJNMPFZSA-N 2 0 371.912 4.199 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414816756 1088269066 /nfs/dbraw/zinc/26/90/66/1088269066.db2.gz QLOLXIDDCSCIOC-DLBZAZTESA-N 2 0 353.510 4.337 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)C[C@H]3[NH2+]Cc4ccccc43)cc2)C1 ZINC000659284812 1088421819 /nfs/dbraw/zinc/42/18/19/1088421819.db2.gz HQIDJRNTLLIJSR-HTAPYJJXSA-N 2 0 363.505 4.092 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000513826830 1088425634 /nfs/dbraw/zinc/42/56/34/1088425634.db2.gz CKMGJTNGKUGMJI-UYAOXDASSA-N 2 0 360.542 4.160 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(COCc3ccccc3)c2)[C@@H]2CCC[C@H]21 ZINC000514090567 1088736569 /nfs/dbraw/zinc/73/65/69/1088736569.db2.gz VLBBGXOMWHMGAV-KMDXXIMOSA-N 2 0 364.533 4.366 20 0 FIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000514249491 1088929174 /nfs/dbraw/zinc/92/91/74/1088929174.db2.gz GUQOJAXHWFJOFI-TWMGVTGTSA-N 2 0 370.924 4.100 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000415013435 1089039108 /nfs/dbraw/zinc/03/91/08/1089039108.db2.gz KWSVPRVPKRFGKL-MRXNPFEDSA-N 2 0 354.523 4.208 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415041036 1089077762 /nfs/dbraw/zinc/07/77/62/1089077762.db2.gz PMJBCAFLQVPYAU-NQIIRXRSSA-N 2 0 360.505 4.065 20 0 FIADRP COc1cc(Br)ccc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415045459 1089089690 /nfs/dbraw/zinc/08/96/90/1089089690.db2.gz BSFRGRWZZZLJNJ-QGZVFWFLSA-N 2 0 363.299 4.028 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000415054531 1089097018 /nfs/dbraw/zinc/09/70/18/1089097018.db2.gz NRQNRMDZISZICL-QFIPXVFZSA-N 2 0 371.956 4.374 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)ccc1Oc1cccnc1 ZINC000415055572 1089101993 /nfs/dbraw/zinc/10/19/93/1089101993.db2.gz RGEATKAOHIKKAO-PZJWPPBQSA-N 2 0 351.494 4.146 20 0 FIADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000415080267 1089135392 /nfs/dbraw/zinc/13/53/92/1089135392.db2.gz JDIJINLUOGXWOK-YOEHRIQHSA-N 2 0 370.368 4.078 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000415084434 1089139548 /nfs/dbraw/zinc/13/95/48/1089139548.db2.gz PDZGAPXXLCETDA-WKHFQEMYSA-N 2 0 374.569 4.212 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCN[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000415095980 1089152923 /nfs/dbraw/zinc/15/29/23/1089152923.db2.gz AEBMWSMYHXMXKI-NFJGTOLLSA-N 2 0 355.570 4.112 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]3CCC[NH2+]C3)s2)cc1 ZINC000415097797 1089158515 /nfs/dbraw/zinc/15/85/15/1089158515.db2.gz DNJJYUMAVSDDOL-JKIFEVAISA-N 2 0 359.539 4.166 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3cc(-c4ccccc4)cs3)CC2)C1 ZINC000415126462 1089177819 /nfs/dbraw/zinc/17/78/19/1089177819.db2.gz PIHLSDQPBDHFTL-PZJWPPBQSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000415120966 1089183242 /nfs/dbraw/zinc/18/32/42/1089183242.db2.gz GWZRKDRRTQUJEA-CTNGQTDRSA-N 2 0 374.525 4.273 20 0 FIADRP CC[NH+](CC)CCOc1ccc(NC(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000415183568 1089255688 /nfs/dbraw/zinc/25/56/88/1089255688.db2.gz NPWWXQLCNRQRBE-MRXNPFEDSA-N 2 0 370.497 4.071 20 0 FIADRP C[NH+](C)C[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000549236688 1089311125 /nfs/dbraw/zinc/31/11/25/1089311125.db2.gz DNZKPMVFZUFKOF-JOCHJYFZSA-N 2 0 371.956 4.197 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(Cl)c1 ZINC000514874624 1089563203 /nfs/dbraw/zinc/56/32/03/1089563203.db2.gz CFDZDMGFKIREPI-UHFFFAOYSA-N 2 0 374.912 4.111 20 0 FIADRP C[C@@H](CC1CCOCC1)C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435424758 1089641085 /nfs/dbraw/zinc/64/10/85/1089641085.db2.gz ALLWPVVKIBTRRC-FXAWDEMLSA-N 2 0 362.583 4.145 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)ccn1 ZINC000515406288 1090014292 /nfs/dbraw/zinc/01/42/92/1090014292.db2.gz JVUPBEOBJBYSDX-SFHVURJKSA-N 2 0 353.510 4.317 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]C[C@H](C)Sc2ccc(Br)cc2)CC1 ZINC000180457545 1090205658 /nfs/dbraw/zinc/20/56/58/1090205658.db2.gz ICVXGTZPOGNJBH-AWEZNQCLSA-N 2 0 371.388 4.392 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(OC)cc2)ccc1OC ZINC000182185472 1090334463 /nfs/dbraw/zinc/33/44/63/1090334463.db2.gz JXXGZYZBIPINIH-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000182376736 1090349068 /nfs/dbraw/zinc/34/90/68/1090349068.db2.gz QSEHEKCIXZMVOZ-FZKQIMNGSA-N 2 0 352.494 4.453 20 0 FIADRP CC[NH+](CC)Cc1ccc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000549448851 1090457555 /nfs/dbraw/zinc/45/75/55/1090457555.db2.gz NTVMFLBLFMGSPD-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@H]2c2ccccc2Br)CC1 ZINC001207479931 1090543481 /nfs/dbraw/zinc/54/34/81/1090543481.db2.gz PPILKJDOOJAJQJ-SFHVURJKSA-N 2 0 351.332 4.318 20 0 FIADRP C[NH+](C)[C@H](CC(=O)Nc1cccc(C[NH+]2CCCCC2)c1)c1ccccc1 ZINC000431922946 1090677114 /nfs/dbraw/zinc/67/71/14/1090677114.db2.gz LRNOZLQIVQUVGQ-JOCHJYFZSA-N 2 0 365.521 4.304 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312429948 1090718593 /nfs/dbraw/zinc/71/85/93/1090718593.db2.gz IBQRLTRSVLGVAN-WZONZLPQSA-N 2 0 365.521 4.208 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(C)c1OC ZINC000584802777 1090904717 /nfs/dbraw/zinc/90/47/17/1090904717.db2.gz LGISMNAKVFOGRL-UHFFFAOYSA-N 2 0 356.510 4.142 20 0 FIADRP Cc1cccc([C@@H]2CCCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)c1C ZINC000500069917 1091021392 /nfs/dbraw/zinc/02/13/92/1091021392.db2.gz KZOVRDIHAPDRNT-QHCPKHFHSA-N 2 0 357.586 4.247 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CCCN2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000500102732 1091039782 /nfs/dbraw/zinc/03/97/82/1091039782.db2.gz FQCANPBTELDJTQ-DEOSSOPVSA-N 2 0 365.565 4.090 20 0 FIADRP CCn1cncc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000418076488 1091048573 /nfs/dbraw/zinc/04/85/73/1091048573.db2.gz JOIPEZQWNAUSHL-QFIPXVFZSA-N 2 0 366.553 4.026 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)C[NH2+]C2CCC3(COC(C)(C)C3)CC2)C1 ZINC001648927172 1091152032 /nfs/dbraw/zinc/15/20/32/1091152032.db2.gz LJXYERASWRXUEL-BXRCABCMSA-N 2 0 350.591 4.460 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000500401368 1091429842 /nfs/dbraw/zinc/42/98/42/1091429842.db2.gz JLRXIXGUJDTRAQ-UHFFFAOYSA-N 2 0 358.476 4.418 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[NH+]1[C@H](C)CC[C@H]1C ZINC000511766249 1091651388 /nfs/dbraw/zinc/65/13/88/1091651388.db2.gz DGSYISHTLVXBEG-QRVBRYPASA-N 2 0 357.542 4.262 20 0 FIADRP C[C@@H](c1nc2ccccc2o1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512236289 1091944623 /nfs/dbraw/zinc/94/46/23/1091944623.db2.gz GJJOHFLJARPCAI-FDDCHVKYSA-N 2 0 361.489 4.487 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(-n2cccn2)cc1 ZINC000512317910 1092029419 /nfs/dbraw/zinc/02/94/19/1092029419.db2.gz HDSVJUKWNIPNKW-BJLQDIEVSA-N 2 0 352.526 4.176 20 0 FIADRP C[C@H]1CC(NC(=[NH2+])c2ccc(F)c(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168011990 1092312845 /nfs/dbraw/zinc/31/28/45/1092312845.db2.gz UUMDZNQBZNIULO-GJZGRUSLSA-N 2 0 357.448 4.321 20 0 FIADRP COc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCCCC2)cc1OC ZINC000246081005 1092325523 /nfs/dbraw/zinc/32/55/23/1092325523.db2.gz BZEZPADFFCQAQH-PMACEKPBSA-N 2 0 372.553 4.122 20 0 FIADRP Cc1nc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)cs1 ZINC000520992718 1092404091 /nfs/dbraw/zinc/40/40/91/1092404091.db2.gz KUWHAHBUXLCHIF-UHFFFAOYSA-N 2 0 357.567 4.276 20 0 FIADRP COc1c(F)cccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001143533474 1092700362 /nfs/dbraw/zinc/70/03/62/1092700362.db2.gz CIGIWDCLJQWVRQ-UXHICEINSA-N 2 0 368.496 4.178 20 0 FIADRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000521514022 1092734776 /nfs/dbraw/zinc/73/47/76/1092734776.db2.gz FVPDYZSUHKLJOK-CRAIPNDOSA-N 2 0 361.942 4.380 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+]CCc1ccc(OCC[NH+](C)C)cc1 ZINC000442788224 1092766943 /nfs/dbraw/zinc/76/69/43/1092766943.db2.gz YBXFVCKHOSXSLX-QGZVFWFLSA-N 2 0 358.551 4.242 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000442801695 1092774497 /nfs/dbraw/zinc/77/44/97/1092774497.db2.gz PYVCLVAGNDEYAX-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2ccccc2)cc1 ZINC000442868481 1092814367 /nfs/dbraw/zinc/81/43/67/1092814367.db2.gz CIZYMWUVTQWTBI-LJQANCHMSA-N 2 0 351.538 4.030 20 0 FIADRP CC(C)C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)cc1 ZINC000442870810 1092818336 /nfs/dbraw/zinc/81/83/36/1092818336.db2.gz ABQRIRBIZOSNSK-IBGZPJMESA-N 2 0 351.966 4.043 20 0 FIADRP CC[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1 ZINC000442873286 1092820355 /nfs/dbraw/zinc/82/03/55/1092820355.db2.gz KFFOPCSKOMERAG-QGZVFWFLSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000442877174 1092830551 /nfs/dbraw/zinc/83/05/51/1092830551.db2.gz QZVNAPGBATXDKE-SFHVURJKSA-N 2 0 371.491 4.018 20 0 FIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000443005556 1092911791 /nfs/dbraw/zinc/91/17/91/1092911791.db2.gz UWKJIQBGKUNFCE-UHFFFAOYSA-N 2 0 363.427 4.415 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000521816151 1092934803 /nfs/dbraw/zinc/93/48/03/1092934803.db2.gz NCIAPQUSCPCQRW-KDURUIRLSA-N 2 0 352.522 4.463 20 0 FIADRP c1cn(-c2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2)cn1 ZINC000245660150 1092946061 /nfs/dbraw/zinc/94/60/61/1092946061.db2.gz FKBUTCQBTGHWBQ-ULPXVVAUSA-N 2 0 372.516 4.158 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H](O)c1ccc(F)cc1 ZINC000245689281 1092948601 /nfs/dbraw/zinc/94/86/01/1092948601.db2.gz KAZHVCUSKIFONH-VLDBVROHSA-N 2 0 368.496 4.033 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000512653424 1093080046 /nfs/dbraw/zinc/08/00/46/1093080046.db2.gz FDPWQVLRHVWNDA-YPAWHYETSA-N 2 0 356.554 4.084 20 0 FIADRP CCCC[N@H+](C)CC1CCN(C(=O)c2ccc(C[NH+](CC)CC)cc2)CC1 ZINC000512670931 1093117847 /nfs/dbraw/zinc/11/78/47/1093117847.db2.gz SFOVXIYUGHJFAA-UHFFFAOYSA-N 2 0 373.585 4.113 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)c1 ZINC000474053073 1093154097 /nfs/dbraw/zinc/15/40/97/1093154097.db2.gz NZOMOBUGMBNGOI-XPWALMASSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CC(C)(C)N(O)C2(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168018835 1093173768 /nfs/dbraw/zinc/17/37/68/1093173768.db2.gz FLPXBCVMHYSHSA-MBOZVWFJSA-N 2 0 359.558 4.038 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3[C@@H]3CCOC3)CC2)c1 ZINC000474069758 1093180920 /nfs/dbraw/zinc/18/09/20/1093180920.db2.gz ZAKFAYLSLVINHW-HMXCVIKNSA-N 2 0 362.583 4.145 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@@H](O)c2ccc(F)c(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168021970 1093260765 /nfs/dbraw/zinc/26/07/65/1093260765.db2.gz RQSFYNODOZLZBX-XCGNWRKASA-N 2 0 374.475 4.029 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C[C@H]1C ZINC000443623549 1093344020 /nfs/dbraw/zinc/34/40/20/1093344020.db2.gz PURMMEJMIAMNBI-OXQOHEQNSA-N 2 0 372.944 4.410 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2ccccc2-n2cccn2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023535 1093363506 /nfs/dbraw/zinc/36/35/06/1093363506.db2.gz XFBUFAZMQSUELW-WOJBJXKFSA-N 2 0 374.532 4.404 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H]2COCc3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025870 1093441755 /nfs/dbraw/zinc/44/17/55/1093441755.db2.gz KDZWUWICMYUGNL-NNTZPNAXSA-N 2 0 350.506 4.289 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000389141374 1093454682 /nfs/dbraw/zinc/45/46/82/1093454682.db2.gz VHIMAEBOXPJVON-ZWOKBUDYSA-N 2 0 356.485 4.396 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCC2CC[NH+](C)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168027919 1093525848 /nfs/dbraw/zinc/52/58/48/1093525848.db2.gz NNPHBPRKILCEJC-JHDGKUDLSA-N 3 0 357.586 4.140 20 0 FIADRP c1cc(-c2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)o2)n[nH]1 ZINC000433319306 1093579553 /nfs/dbraw/zinc/57/95/53/1093579553.db2.gz QYBKYFQEAUQCPA-UHFFFAOYSA-N 2 0 364.493 4.336 20 0 FIADRP C[N@H+](CCCO)C1CC[NH+](CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474261582 1093628428 /nfs/dbraw/zinc/62/84/28/1093628428.db2.gz ABWXVSMIEOCARE-UHFFFAOYSA-N 2 0 373.368 4.095 20 0 FIADRP C[C@H](NCC(C)(C)C[NH+](C)C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433405916 1093672790 /nfs/dbraw/zinc/67/27/90/1093672790.db2.gz JZLNWXLYXWBGJH-WMZOPIPTSA-N 2 0 366.521 4.012 20 0 FIADRP C[C@@H]1CC([NH2+]CC2(Cc3cccnc3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033285 1093710476 /nfs/dbraw/zinc/71/04/76/1093710476.db2.gz KPUCSGJZRUSSFX-WOJBJXKFSA-N 2 0 363.549 4.436 20 0 FIADRP C[C@@H]1CC([N@@H+]2CCCC[C@H](CCC[NH3+])C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033469 1093721099 /nfs/dbraw/zinc/72/10/99/1093721099.db2.gz LAJZBMGCRQMCDC-NJDAHSKKSA-N 3 0 357.586 4.269 20 0 FIADRP C[C@H]1CC([NH2+]CC2CC[NH+](C3CCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168033629 1093722141 /nfs/dbraw/zinc/72/21/41/1093722141.db2.gz MVKWEJVRTFTAJF-PMACEKPBSA-N 3 0 369.597 4.282 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNCc1cnc2ccccc2n1 ZINC000614387138 1093802256 /nfs/dbraw/zinc/80/22/56/1093802256.db2.gz AUFSGUKDOIPMHG-GOSISDBHSA-N 2 0 360.505 4.294 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2ccc(C[NH+](CC)CC)cc2)CC1 ZINC000474469942 1093816563 /nfs/dbraw/zinc/81/65/63/1093816563.db2.gz IMEYWIGOVQSPTR-UHFFFAOYSA-N 2 0 360.542 4.130 20 0 FIADRP COCc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC001648951368 1093967915 /nfs/dbraw/zinc/96/79/15/1093967915.db2.gz SXNWQHRBUWIURB-UHFFFAOYSA-N 2 0 352.522 4.499 20 0 FIADRP O=C(CCCC[NH+]1CCCC1)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000729347476 1093969046 /nfs/dbraw/zinc/96/90/46/1093969046.db2.gz IQXYJTHWYXREMT-UHFFFAOYSA-N 2 0 357.542 4.267 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC(C[NH+](CC)CC)CC2)cc1 ZINC000509914075 1094025494 /nfs/dbraw/zinc/02/54/94/1094025494.db2.gz WNTZVQRREZTFSP-UHFFFAOYSA-N 2 0 373.585 4.113 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC(F)F ZINC000513365675 1094082055 /nfs/dbraw/zinc/08/20/55/1094082055.db2.gz RRCGKMQESSSOFY-HOCLYGCPSA-N 2 0 368.468 4.039 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)cc1 ZINC000513372734 1094089942 /nfs/dbraw/zinc/08/99/42/1094089942.db2.gz QZDJQWMJHMPTMW-KNKQGSTJSA-N 2 0 371.569 4.006 20 0 FIADRP CCCn1nc(C)c(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1C ZINC000513495464 1094161994 /nfs/dbraw/zinc/16/19/94/1094161994.db2.gz QDVPEQAMTKNFJO-AVRDEDQJSA-N 2 0 368.569 4.300 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000513499328 1094172799 /nfs/dbraw/zinc/17/27/99/1094172799.db2.gz FQXXNXZCCYTYDZ-XMMPIXPASA-N 2 0 374.532 4.392 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](Cc2ccccn2)c2cccnc2)c1 ZINC000513531606 1094202192 /nfs/dbraw/zinc/20/21/92/1094202192.db2.gz IFYUVEXECWQWHG-XMMPIXPASA-N 2 0 374.532 4.392 20 0 FIADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000513678613 1094269502 /nfs/dbraw/zinc/26/95/02/1094269502.db2.gz PVOGIMNQNKQHER-BHIFYINESA-N 2 0 358.570 4.066 20 0 FIADRP CSc1cc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)ccn1 ZINC000513662420 1094270479 /nfs/dbraw/zinc/27/04/79/1094270479.db2.gz VKFMTZOYSGYAEO-UHFFFAOYSA-N 2 0 355.551 4.336 20 0 FIADRP CC(C)Oc1ccc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501027737 1094444510 /nfs/dbraw/zinc/44/45/10/1094444510.db2.gz LMWLKMSAIDHUFY-UHFFFAOYSA-N 2 0 353.510 4.217 20 0 FIADRP CC(C)CCc1nc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cs1 ZINC000501041596 1094448611 /nfs/dbraw/zinc/44/86/11/1094448611.db2.gz ZDRDGNHNWCTNQA-UHFFFAOYSA-N 2 0 372.582 4.475 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)CC1 ZINC000501059142 1094469884 /nfs/dbraw/zinc/46/98/84/1094469884.db2.gz LIRHQKMGEWKTBE-XMMPIXPASA-N 2 0 371.613 4.137 20 0 FIADRP C[N@@H+](Cc1nc(C(C)(C)C)cs1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070125 1094481479 /nfs/dbraw/zinc/48/14/79/1094481479.db2.gz RPIAEPAARRCKPO-UHFFFAOYSA-N 2 0 358.555 4.184 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501090419 1094490312 /nfs/dbraw/zinc/49/03/12/1094490312.db2.gz MPFWIQNYOJTVFC-FQEVSTJZSA-N 2 0 351.966 4.043 20 0 FIADRP [NH3+]CC[C@H]1CCC[N@@H+]([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000420315025 1094877478 /nfs/dbraw/zinc/87/74/78/1094877478.db2.gz RKSPEYBYAUNEJJ-VGOFRKELSA-N 2 0 361.489 4.153 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)nc(-c2ccc(Cl)cc2)n1 ZINC000420390975 1094909303 /nfs/dbraw/zinc/90/93/03/1094909303.db2.gz IEAXLRAAIHNERE-XLIONFOSSA-N 2 0 370.928 4.069 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000420416902 1094914121 /nfs/dbraw/zinc/91/41/21/1094914121.db2.gz WAXHYJDNMNBJSY-DZGCQCFKSA-N 2 0 352.400 4.107 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000502240044 1095244413 /nfs/dbraw/zinc/24/44/13/1095244413.db2.gz FXSOBZFDNKWVEO-SFHVURJKSA-N 2 0 374.569 4.330 20 0 FIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000502453302 1095474362 /nfs/dbraw/zinc/47/43/62/1095474362.db2.gz PCLOEDOWMSGZCC-GCJKJVERSA-N 2 0 356.510 4.206 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000421345721 1095539212 /nfs/dbraw/zinc/53/92/12/1095539212.db2.gz XNEMHQOYLGAMSJ-UHFFFAOYSA-N 2 0 350.510 4.017 20 0 FIADRP c1nn(C2CCCC2)c(-c2ccccc2)c1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000421334783 1095548534 /nfs/dbraw/zinc/54/85/34/1095548534.db2.gz QSIYEFWQHGUJOH-SFHVURJKSA-N 2 0 364.537 4.239 20 0 FIADRP Cc1ccc(C[NH2+]Cc2cccc(CN3CCO[C@@H](C)C3)c2)cc1Cl ZINC000443979512 1095567179 /nfs/dbraw/zinc/56/71/79/1095567179.db2.gz OQDBRAMARDKDND-KRWDZBQOSA-N 2 0 358.913 4.159 20 0 FIADRP COc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1OCc1ccccc1 ZINC000421379230 1095580414 /nfs/dbraw/zinc/58/04/14/1095580414.db2.gz WVFRQIFASULFTD-UHFFFAOYSA-N 2 0 368.521 4.237 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000522799477 1095690479 /nfs/dbraw/zinc/69/04/79/1095690479.db2.gz DSWPFAVZROZDKE-HBMCJLEFSA-N 2 0 365.565 4.391 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)oc1C ZINC000502699451 1095722890 /nfs/dbraw/zinc/72/28/90/1095722890.db2.gz YYVOKKWCZDKNPE-BZSNNMDCSA-N 2 0 356.510 4.356 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051038 1095769228 /nfs/dbraw/zinc/76/92/28/1095769228.db2.gz FNWXLIYUFFVCMZ-RUMRUAAYSA-N 3 0 371.613 4.480 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](C(=O)OC(C)(C)C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168051056 1095771943 /nfs/dbraw/zinc/77/19/43/1095771943.db2.gz FRJBCFMRNTWGPJ-YHELAOLJSA-N 2 0 372.553 4.092 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000421819531 1095933421 /nfs/dbraw/zinc/93/34/21/1095933421.db2.gz HPFHBLQNLBHUBQ-HNNXBMFYSA-N 2 0 355.869 4.444 20 0 FIADRP CC[N@H+](Cc1occc1C)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000414555296 1095960242 /nfs/dbraw/zinc/96/02/42/1095960242.db2.gz WZCUVGIOOVNFRN-UHFFFAOYSA-N 2 0 355.526 4.141 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)c1OC ZINC000513759853 1095966346 /nfs/dbraw/zinc/96/63/46/1095966346.db2.gz HIJMXKVIEKENQP-GOSISDBHSA-N 2 0 368.521 4.459 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000421870695 1095980775 /nfs/dbraw/zinc/98/07/75/1095980775.db2.gz FIBRHNWQTSIBSB-DQPZFDDXSA-N 2 0 367.331 4.125 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CC24CCSCC4)C3)cc1 ZINC000421872276 1095981125 /nfs/dbraw/zinc/98/11/25/1095981125.db2.gz GNLOTSVIFWUHJK-NCYKPQTJSA-N 2 0 356.579 4.305 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccsc2S1 ZINC000272774864 1096210942 /nfs/dbraw/zinc/21/09/42/1096210942.db2.gz UETWOXFXJOGREN-YJLNNSPDSA-N 2 0 374.575 4.030 20 0 FIADRP C[C@@H](C[NH+](C)CCCC[N@@H+](C)C[C@H](C)c1nccs1)c1nccs1 ZINC000273115129 1096236205 /nfs/dbraw/zinc/23/62/05/1096236205.db2.gz QRYNBKVFABGOIR-HOTGVXAUSA-N 2 0 366.600 4.151 20 0 FIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000414658838 1096357390 /nfs/dbraw/zinc/35/73/90/1096357390.db2.gz RQNSIUHPXRCBSB-UHFFFAOYSA-N 2 0 351.313 4.101 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000414663882 1096375364 /nfs/dbraw/zinc/37/53/64/1096375364.db2.gz SEDVPKAIYSUEGC-MOPGFXCFSA-N 2 0 360.505 4.017 20 0 FIADRP FC(F)(F)COc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422730280 1096464290 /nfs/dbraw/zinc/46/42/90/1096464290.db2.gz JMGJMSYAPVHWDC-GVDBMIGSSA-N 2 0 356.432 4.028 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422733115 1096465080 /nfs/dbraw/zinc/46/50/80/1096465080.db2.gz ATNQLPFCGUUVJE-BKAXWXOWSA-N 2 0 367.356 4.105 20 0 FIADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(OCc2ccccn2)cc1 ZINC000422718947 1096470476 /nfs/dbraw/zinc/47/04/76/1096470476.db2.gz LQSFANYTFFQQKH-ICSRJNTNSA-N 2 0 353.510 4.061 20 0 FIADRP CCC(CC)(CN[C@H](C)c1ccc(C[NH3+])nc1C)[NH2+][C@H](C)c1ccccc1 ZINC000422772635 1096487686 /nfs/dbraw/zinc/48/76/86/1096487686.db2.gz XHRNQRNPOJVJHL-QZTJIDSGSA-N 2 0 368.569 4.409 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)Sc1ccccc1 ZINC000422778584 1096488978 /nfs/dbraw/zinc/48/89/78/1096488978.db2.gz ATOJOKGQAKETBY-BSIFCXSSSA-N 2 0 354.519 4.013 20 0 FIADRP c1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422848724 1096504422 /nfs/dbraw/zinc/50/44/22/1096504422.db2.gz UESGEAJHHLZUEV-QHAWAJNXSA-N 2 0 351.494 4.274 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)c(Oc2ccccc2)c1 ZINC000422864717 1096507910 /nfs/dbraw/zinc/50/79/10/1096507910.db2.gz NVULFOFWKCHQPQ-FDFHNCONSA-N 2 0 366.505 4.034 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422881145 1096510710 /nfs/dbraw/zinc/51/07/10/1096510710.db2.gz POJKZXPVDHWTJK-KSSFIOAISA-N 2 0 371.352 4.149 20 0 FIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422883957 1096512075 /nfs/dbraw/zinc/51/20/75/1096512075.db2.gz WAROEBAMKBQWKN-JTAQYXEDSA-N 2 0 366.505 4.382 20 0 FIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422883958 1096512372 /nfs/dbraw/zinc/51/23/72/1096512372.db2.gz WAROEBAMKBQWKN-MIZPHKNDSA-N 2 0 366.505 4.382 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422897362 1096518333 /nfs/dbraw/zinc/51/83/33/1096518333.db2.gz ZSRZYBZCWNYCRJ-JWNTYJGQSA-N 2 0 366.505 4.380 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422897367 1096518567 /nfs/dbraw/zinc/51/85/67/1096518567.db2.gz ZTGMLPXVTALCOD-JTHBVZDNSA-N 2 0 366.505 4.211 20 0 FIADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422909868 1096521194 /nfs/dbraw/zinc/52/11/94/1096521194.db2.gz PDDMTAIKFKDGEP-YADARESESA-N 2 0 374.532 4.076 20 0 FIADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422909866 1096521228 /nfs/dbraw/zinc/52/12/28/1096521228.db2.gz PDDMTAIKFKDGEP-DVECYGJZSA-N 2 0 374.532 4.076 20 0 FIADRP C[C@@H]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@H](C[NH3+])C1 ZINC000414704265 1096526025 /nfs/dbraw/zinc/52/60/25/1096526025.db2.gz DGFJNNHFVNNSNW-XLIONFOSSA-N 2 0 372.557 4.042 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000422930944 1096528296 /nfs/dbraw/zinc/52/82/96/1096528296.db2.gz AEVYNPUCWOKBJL-UGSOOPFHSA-N 2 0 365.290 4.395 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@@H]1CCCC[C@H]1C[NH3+])C1CCCCC1 ZINC000414705571 1096531444 /nfs/dbraw/zinc/53/14/44/1096531444.db2.gz FMYAAWYPQQDCNF-FXAWDEMLSA-N 2 0 372.557 4.090 20 0 FIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422945652 1096535873 /nfs/dbraw/zinc/53/58/73/1096535873.db2.gz NOOIICFUAVILAO-ZVDOUQERSA-N 2 0 354.881 4.173 20 0 FIADRP Clc1cccc(CCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422945635 1096536092 /nfs/dbraw/zinc/53/60/92/1096536092.db2.gz NMINLQWPDDLVFN-PZJWPPBQSA-N 2 0 356.897 4.118 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423005255 1096548323 /nfs/dbraw/zinc/54/83/23/1096548323.db2.gz QYFLGWOXYSHOJF-GHTZIAJQSA-N 2 0 372.896 4.084 20 0 FIADRP Clc1ccc(COCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000423021800 1096551034 /nfs/dbraw/zinc/55/10/34/1096551034.db2.gz CXHLGRLQGKECLJ-NXHRZFHOSA-N 2 0 357.325 4.020 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000423038638 1096557832 /nfs/dbraw/zinc/55/78/32/1096557832.db2.gz OTEVTTPRTZLNCV-BSDZUQITSA-N 2 0 362.517 4.472 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](Cc2cccc(Br)c2)CC2CC2)CC1 ZINC000423046090 1096559518 /nfs/dbraw/zinc/55/95/18/1096559518.db2.gz DCURNWZHMJYNPQ-ABHNRTSZSA-N 2 0 351.332 4.020 20 0 FIADRP C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CC[NH2+]C1 ZINC000423060773 1096560999 /nfs/dbraw/zinc/56/09/99/1096560999.db2.gz IWKSTLCEKACMIJ-SUHUHFCYSA-N 2 0 354.338 4.287 20 0 FIADRP [NH3+]CC1CCC([NH2+][C@@H](c2cc(F)cc(Br)c2)C2CC2)CC1 ZINC000423051242 1096564964 /nfs/dbraw/zinc/56/49/64/1096564964.db2.gz MTFPGYMZQKPJHC-ATVIMWCOSA-N 2 0 355.295 4.146 20 0 FIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423100689 1096575052 /nfs/dbraw/zinc/57/50/52/1096575052.db2.gz VLVNKWTVBHWDBX-ZLLBNUPZSA-N 2 0 368.908 4.432 20 0 FIADRP [NH3+]CC1CCC([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 ZINC000423107958 1096583162 /nfs/dbraw/zinc/58/31/62/1096583162.db2.gz QIWJWIMRCLNYHK-DNOPENIRSA-N 2 0 370.459 4.280 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1Cl ZINC000423107727 1096583220 /nfs/dbraw/zinc/58/32/20/1096583220.db2.gz QCGWJNXLMGLUKU-WIYYLYMNSA-N 2 0 372.896 4.084 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000423106737 1096583475 /nfs/dbraw/zinc/58/34/75/1096583475.db2.gz OZDJNDPUQLCTNR-KBXCAEBGSA-N 2 0 358.448 4.280 20 0 FIADRP [NH3+]CC1CCC([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 ZINC000423107959 1096583579 /nfs/dbraw/zinc/58/35/79/1096583579.db2.gz QIWJWIMRCLNYHK-FPCQFERPSA-N 2 0 370.459 4.280 20 0 FIADRP FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423153375 1096588606 /nfs/dbraw/zinc/58/86/06/1096588606.db2.gz GKVOIGFPQHLEAA-ITQYTPKQSA-N 2 0 368.443 4.343 20 0 FIADRP c1c2ccccc2sc1CC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423140921 1096595070 /nfs/dbraw/zinc/59/50/70/1096595070.db2.gz ZSOZLXJNTJVRDP-KNQAVFIVSA-N 2 0 364.514 4.289 20 0 FIADRP Fc1cccc2c1CCC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423144512 1096595696 /nfs/dbraw/zinc/59/56/96/1096595696.db2.gz HHKHVYQQFBOOJY-JAXLGGSGSA-N 2 0 352.453 4.049 20 0 FIADRP COc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccc1OCc1cccs1 ZINC000503934100 1096600709 /nfs/dbraw/zinc/60/07/09/1096600709.db2.gz ZIEGHMZJTIOKGU-UHFFFAOYSA-N 2 0 374.550 4.157 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH+]1CCC(Cc2c(F)cccc2F)CC1 ZINC000423169637 1096600776 /nfs/dbraw/zinc/60/07/76/1096600776.db2.gz ZSBIZTKWPNLKJL-OAHLLOKOSA-N 2 0 359.464 4.143 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cc(Cl)cc(Br)c1 ZINC000423194576 1096613549 /nfs/dbraw/zinc/61/35/49/1096613549.db2.gz WWPZGDPJTJRNMU-JTQLQIEISA-N 2 0 368.706 4.115 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423214011 1096619216 /nfs/dbraw/zinc/61/92/16/1096619216.db2.gz ODACKHVNNYWFGW-CJNGLKHVSA-N 2 0 361.942 4.430 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]C[C@H]2CCC[NH2+]C2)nc1 ZINC000423214067 1096619414 /nfs/dbraw/zinc/61/94/14/1096619414.db2.gz OJGNPGNQYFRWHF-SIKLNZKXSA-N 2 0 371.956 4.040 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cc(F)ccc2F)c1 ZINC000423247067 1096628964 /nfs/dbraw/zinc/62/89/64/1096628964.db2.gz KQMDBYUYLMXUKO-XOBRGWDASA-N 2 0 362.489 4.365 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423248782 1096629770 /nfs/dbraw/zinc/62/97/70/1096629770.db2.gz NUOXRKWHDNFYNP-HNAYVOBHSA-N 2 0 359.311 4.128 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1cc(Cl)ccc1Cl)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414727763 1096629915 /nfs/dbraw/zinc/62/99/15/1096629915.db2.gz BOBFDISXDLHNGK-UONOGXRCSA-N 2 0 372.340 4.032 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423258931 1096632599 /nfs/dbraw/zinc/63/25/99/1096632599.db2.gz NDIDTBZNLLWUSY-MAUKXSAKSA-N 2 0 371.550 4.175 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423258930 1096632852 /nfs/dbraw/zinc/63/28/52/1096632852.db2.gz NDIDTBZNLLWUSY-CRAIPNDOSA-N 2 0 371.550 4.175 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](Cc2ccccc2Cl)[C@@H]2CCCO2)cc1 ZINC000423291730 1096635838 /nfs/dbraw/zinc/63/58/38/1096635838.db2.gz JPZJSSNSPQEEAR-RVHYNSKXSA-N 2 0 358.913 4.240 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(F)c(Br)c2)cc1 ZINC000423291525 1096636228 /nfs/dbraw/zinc/63/62/28/1096636228.db2.gz ISGPRSVNYFXKHU-VXGBXAGGSA-N 2 0 351.263 4.459 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]C[C@@H]([NH3+])C(C)C)nc1 ZINC000423269469 1096637981 /nfs/dbraw/zinc/63/79/81/1096637981.db2.gz HHVOVUYLPYWBLE-NHCUHLMSSA-N 2 0 359.945 4.024 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3(C)CC[NH2+]CC3)s2)cc1 ZINC000423316379 1096642148 /nfs/dbraw/zinc/64/21/48/1096642148.db2.gz ANYAOIPDSSPMDY-CQSZACIVSA-N 2 0 359.539 4.167 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OC(F)F ZINC000423293829 1096643163 /nfs/dbraw/zinc/64/31/63/1096643163.db2.gz SDLCTNDBAJJQDS-QWHCGFSZSA-N 2 0 350.409 4.167 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000423344879 1096646607 /nfs/dbraw/zinc/64/66/07/1096646607.db2.gz XDVDZCDARIVEIS-IAGOWNOFSA-N 2 0 351.494 4.333 20 0 FIADRP CC[C@@H]([NH2+]CCCC[NH3+])c1ccc(Br)cc1C(F)(F)F ZINC000423328649 1096648587 /nfs/dbraw/zinc/64/85/87/1096648587.db2.gz OAXIJNQZTPXSRS-CYBMUJFWSA-N 2 0 353.226 4.248 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000467312452 1096648678 /nfs/dbraw/zinc/64/86/78/1096648678.db2.gz FCMBFWIUSXDXMV-OAQYLSRUSA-N 2 0 354.469 4.207 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423374377 1096653367 /nfs/dbraw/zinc/65/33/67/1096653367.db2.gz IIZSSVXMEBODJG-GOSISDBHSA-N 2 0 373.294 4.056 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cccc(Br)c21 ZINC000423369509 1096658143 /nfs/dbraw/zinc/65/81/43/1096658143.db2.gz DYSFCENHFBQTID-KZULUSFZSA-N 2 0 357.295 4.390 20 0 FIADRP Brc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423383075 1096661746 /nfs/dbraw/zinc/66/17/46/1096661746.db2.gz KJHDNKHUUGGXJW-LJQANCHMSA-N 2 0 357.295 4.220 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1OC ZINC000423393626 1096663537 /nfs/dbraw/zinc/66/35/37/1096663537.db2.gz QSWMRBVIYWPSAB-INIZCTEOSA-N 2 0 354.494 4.328 20 0 FIADRP Brc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423392408 1096664004 /nfs/dbraw/zinc/66/40/04/1096664004.db2.gz QBVXLPLTJCSZDX-GOSISDBHSA-N 2 0 373.294 4.056 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(Br)cc1C(F)(F)F ZINC000423403257 1096672054 /nfs/dbraw/zinc/67/20/54/1096672054.db2.gz RYOBCOCJAQGUKX-BFVZDQMLSA-N 2 0 365.237 4.117 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC[NH2+]CC1 ZINC000423412151 1096674926 /nfs/dbraw/zinc/67/49/26/1096674926.db2.gz WHWDNPPBLKRMAL-INIZCTEOSA-N 2 0 373.566 4.094 20 0 FIADRP COCC1(C[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC[NH2+]CC1 ZINC000423412152 1096675095 /nfs/dbraw/zinc/67/50/95/1096675095.db2.gz WHWDNPPBLKRMAL-MRXNPFEDSA-N 2 0 373.566 4.094 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000423453556 1096679238 /nfs/dbraw/zinc/67/92/38/1096679238.db2.gz AQBALJDXXAGXGT-KBRIMQKVSA-N 2 0 359.514 4.434 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423448718 1096680063 /nfs/dbraw/zinc/68/00/63/1096680063.db2.gz VKXLHRVYFZLPBE-UYHISHBKSA-N 2 0 359.514 4.296 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+][C@@H](C)CCC[NH3+])nc1 ZINC000423450565 1096680549 /nfs/dbraw/zinc/68/05/49/1096680549.db2.gz HLXDOYVUKAQKSY-HRAATJIYSA-N 2 0 359.945 4.168 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423430554 1096683242 /nfs/dbraw/zinc/68/32/42/1096683242.db2.gz LBISZQGBKRHXTR-RDTXWAMCSA-N 2 0 369.347 4.024 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)CCC3)cc1 ZINC000423433429 1096684469 /nfs/dbraw/zinc/68/44/69/1096684469.db2.gz JUAZGRMVHAHZLB-JENIJYKNSA-N 2 0 371.525 4.304 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000423457350 1096688307 /nfs/dbraw/zinc/68/83/07/1096688307.db2.gz OWBRHMQTFWOJKF-NXEZZACHSA-N 2 0 353.226 4.246 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(Br)cc1C(F)(F)F ZINC000423504891 1096700500 /nfs/dbraw/zinc/70/05/00/1096700500.db2.gz LIMHGLPOKWKTST-NHCYSSNCSA-N 2 0 365.237 4.246 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2ccccc2Cl)cc1OC ZINC000423506805 1096702474 /nfs/dbraw/zinc/70/24/74/1096702474.db2.gz MILDHHBXNBGRDZ-HTZUNMPGSA-N 2 0 374.912 4.164 20 0 FIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000423508324 1096703470 /nfs/dbraw/zinc/70/34/70/1096703470.db2.gz QOLOIPKABFHVOB-HRAATJIYSA-N 2 0 366.509 4.101 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423492564 1096705183 /nfs/dbraw/zinc/70/51/83/1096705183.db2.gz NQJWFINAPAFNFB-WHOFXGATSA-N 2 0 367.324 4.266 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423492561 1096705359 /nfs/dbraw/zinc/70/53/59/1096705359.db2.gz NQJWFINAPAFNFB-CORIIIEPSA-N 2 0 367.324 4.266 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000423515706 1096711384 /nfs/dbraw/zinc/71/13/84/1096711384.db2.gz SVLXDMBHFUWVIF-SPKLELGKSA-N 2 0 350.840 4.425 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423521801 1096711991 /nfs/dbraw/zinc/71/19/91/1096711991.db2.gz TZGRNPBMPDPBKY-OXQOHEQNSA-N 2 0 356.510 4.013 20 0 FIADRP [NH3+]CCC[C@H]([NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21)c1ccccc1 ZINC000423524474 1096713285 /nfs/dbraw/zinc/71/32/85/1096713285.db2.gz XBBBVLSNVCKOJZ-FCHUYYIVSA-N 2 0 360.505 4.320 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423539355 1096716850 /nfs/dbraw/zinc/71/68/50/1096716850.db2.gz IEFBDQWZFCOHHH-LRGNLBRXSA-N 2 0 350.506 4.401 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(F)cc(Br)c1 ZINC000423553212 1096720378 /nfs/dbraw/zinc/72/03/78/1096720378.db2.gz VZBOEKNHEGVAKZ-AADNMHCOSA-N 2 0 355.295 4.017 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)cc1 ZINC000423842197 1096775429 /nfs/dbraw/zinc/77/54/29/1096775429.db2.gz KBUAEAVROUPRLR-GOSISDBHSA-N 2 0 365.521 4.233 20 0 FIADRP c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000236745025 1098863140 /nfs/dbraw/zinc/86/31/40/1098863140.db2.gz IFGDKOVETFGHCR-UHFFFAOYSA-N 2 0 371.528 4.299 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1c[nH]nc1-c1ccsc1 ZINC000436279471 1098882708 /nfs/dbraw/zinc/88/27/08/1098882708.db2.gz IWHSCIRUILAIAB-UHFFFAOYSA-N 2 0 354.523 4.270 20 0 FIADRP Fc1cccc2[nH]c(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)cc21 ZINC000436280063 1098883517 /nfs/dbraw/zinc/88/35/17/1098883517.db2.gz JNPPYXRTQWVJHZ-UHFFFAOYSA-N 2 0 357.498 4.370 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2c[nH]nc2-c2ccsc2)cc1 ZINC000436271553 1098897267 /nfs/dbraw/zinc/89/72/67/1098897267.db2.gz DSPDYRFZZGWZNZ-UHFFFAOYSA-N 2 0 354.523 4.270 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436293581 1098908044 /nfs/dbraw/zinc/90/80/44/1098908044.db2.gz VRZFUEYEPWILAX-BHIYHBOVSA-N 2 0 356.485 4.363 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)c1 ZINC000515761951 1098919023 /nfs/dbraw/zinc/91/90/23/1098919023.db2.gz IMKGOACLQXCDFR-MRXNPFEDSA-N 2 0 373.928 4.299 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)[C@H](C)C1 ZINC000437090271 1099594601 /nfs/dbraw/zinc/59/46/01/1099594601.db2.gz AGSNXTKBMJPFAI-ADHNFCLRSA-N 2 0 358.570 4.124 20 0 FIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000516620385 1099661706 /nfs/dbraw/zinc/66/17/06/1099661706.db2.gz KIKCWIASHAENLH-CUUWFGFTSA-N 2 0 356.554 4.365 20 0 FIADRP C[C@@H]1c2cccn2CC[N@H+]1CCCCCC[NH+]1CCn2cccc2[C@@H]1C ZINC000729815060 1099696280 /nfs/dbraw/zinc/69/62/80/1099696280.db2.gz NAWFDWDRBUZKDE-BGYRXZFFSA-N 2 0 354.542 4.303 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000516689868 1099728531 /nfs/dbraw/zinc/72/85/31/1099728531.db2.gz LLWBASXNKNNBFG-CWWKMALHSA-N 2 0 350.453 4.296 20 0 FIADRP C[C@H](CN(C)Cc1ccccc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693255 1099827899 /nfs/dbraw/zinc/82/78/99/1099827899.db2.gz CQOQVFOKGYJMOR-PQNGQFLHSA-N 2 0 365.565 4.007 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000508702550 1099854473 /nfs/dbraw/zinc/85/44/73/1099854473.db2.gz ZKXCZHZWMQHWIP-HWHRFOGPSA-N 2 0 358.570 4.470 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000508714820 1099885673 /nfs/dbraw/zinc/88/56/73/1099885673.db2.gz CAAKPCUOZVVPQH-OIBXWCBGSA-N 2 0 351.538 4.321 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709970 1099899863 /nfs/dbraw/zinc/89/98/63/1099899863.db2.gz KNQCSAZHQMXPGQ-JKLQHZFJSA-N 2 0 358.570 4.328 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000508709811 1099900966 /nfs/dbraw/zinc/90/09/66/1099900966.db2.gz JOMTZMFQRRLSSA-YKSBVNFPSA-N 3 0 365.565 4.139 20 0 FIADRP CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)C[NH2+]CC2 ZINC000517034931 1099996702 /nfs/dbraw/zinc/99/67/02/1099996702.db2.gz CPKHWLCLRCRZMN-QFIPXVFZSA-N 2 0 360.505 4.039 20 0 FIADRP CC(C)C[C@H](C)Oc1cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)ccn1 ZINC000459404532 1100111590 /nfs/dbraw/zinc/11/15/90/1100111590.db2.gz DADZOWKAIKFPMG-SFHVURJKSA-N 2 0 368.525 4.049 20 0 FIADRP CCOc1cc(C[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc(Cl)c1O ZINC000459416363 1100143156 /nfs/dbraw/zinc/14/31/56/1100143156.db2.gz XIKPDVNISPEOEV-UHFFFAOYSA-N 2 0 362.901 4.186 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc(C(C)(C)C)s1 ZINC000517198857 1100155374 /nfs/dbraw/zinc/15/53/74/1100155374.db2.gz WDCFAZQNISMMJO-UHFFFAOYSA-N 2 0 361.555 4.061 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2c(O)cccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000517187773 1100160134 /nfs/dbraw/zinc/16/01/34/1100160134.db2.gz YKJJSRKGZYWFHP-JLMWRMLUSA-N 2 0 350.506 4.270 20 0 FIADRP Brc1cccc2c1CC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434805 1100173728 /nfs/dbraw/zinc/17/37/28/1100173728.db2.gz UXSNLKANYYPAPM-LJQANCHMSA-N 2 0 372.310 4.090 20 0 FIADRP CC[N@@H+](Cc1ccc(-n2ccnc2)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709349 1100227667 /nfs/dbraw/zinc/22/76/67/1100227667.db2.gz BMPYGWYRGWKMGX-HSZRJFAPSA-N 2 0 374.532 4.216 20 0 FIADRP COc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)C2 ZINC000425932383 1100307463 /nfs/dbraw/zinc/30/74/63/1100307463.db2.gz PXEKFVXYPQHCOK-LJQANCHMSA-N 2 0 370.562 4.116 20 0 FIADRP FC(F)(F)[C@@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Cc1ccccc1 ZINC000459569809 1100317404 /nfs/dbraw/zinc/31/74/04/1100317404.db2.gz ZPTFEQODAHHSMF-QGZVFWFLSA-N 2 0 363.427 4.061 20 0 FIADRP C[C@H]([NH2+]CCOc1ccccc1Cl)c1ccc(OCC[NH+](C)C)cc1 ZINC000536828512 1100326709 /nfs/dbraw/zinc/32/67/09/1100326709.db2.gz ULUKRAANYKJMBZ-INIZCTEOSA-N 2 0 362.901 4.010 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@@H]4CC[N@H+](C)C[C@H]4C)cc3)ccc2O1 ZINC000536838064 1100349195 /nfs/dbraw/zinc/34/91/95/1100349195.db2.gz GNOJDLTZNSUSCX-DRSNIGMVSA-N 2 0 350.506 4.107 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000536844284 1100356885 /nfs/dbraw/zinc/35/68/85/1100356885.db2.gz HWSNDMDHWMMEEG-PCCBWWKXSA-N 2 0 362.945 4.075 20 0 FIADRP C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000536852780 1100366524 /nfs/dbraw/zinc/36/65/24/1100366524.db2.gz PTQGAGZMGXCRAE-AUUYWEPGSA-N 2 0 360.885 4.065 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCSc3ccc(Cl)cc32)C[C@H](C)O1 ZINC000536861939 1100379441 /nfs/dbraw/zinc/37/94/41/1100379441.db2.gz IKPHQBXLUAJAPT-DAYGRLMNSA-N 2 0 368.974 4.356 20 0 FIADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000438116804 1100442925 /nfs/dbraw/zinc/44/29/25/1100442925.db2.gz KCRUERIFKQSUOZ-FYYLOGMGSA-N 2 0 356.554 4.074 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000517537225 1100474976 /nfs/dbraw/zinc/47/49/76/1100474976.db2.gz LXNXNELSYIBOBT-RTBURBONSA-N 2 0 368.569 4.337 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426031404 1100682905 /nfs/dbraw/zinc/68/29/05/1100682905.db2.gz RSTBAUQQBMLUJQ-HBMCJLEFSA-N 2 0 357.929 4.481 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000517936817 1100804617 /nfs/dbraw/zinc/80/46/17/1100804617.db2.gz ZLVATJAOEJHQSI-CRAIPNDOSA-N 2 0 371.912 4.152 20 0 FIADRP Cc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000517968723 1100838859 /nfs/dbraw/zinc/83/88/59/1100838859.db2.gz HJJVUKPKTQVCLH-FQEVSTJZSA-N 2 0 370.562 4.075 20 0 FIADRP [NH3+]C[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414946057 1100892198 /nfs/dbraw/zinc/89/21/98/1100892198.db2.gz SIZOKWOTOAABPA-DEOSSOPVSA-N 2 0 359.517 4.094 20 0 FIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414949308 1100905812 /nfs/dbraw/zinc/90/58/12/1100905812.db2.gz ZTNDRMIEXSMHKI-WBMJQRKESA-N 2 0 365.340 4.265 20 0 FIADRP C[N@@H+](Cc1cnc(-c2ccco2)s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000426160896 1100930865 /nfs/dbraw/zinc/93/08/65/1100930865.db2.gz MCLAYZFSKZPEEJ-UHFFFAOYSA-N 2 0 368.506 4.147 20 0 FIADRP Cc1ccc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C[NH+](C)C)c1 ZINC000438846345 1100975019 /nfs/dbraw/zinc/97/50/19/1100975019.db2.gz ASAKFBQHTXUVCA-PZJWPPBQSA-N 2 0 351.538 4.379 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC000518274764 1101058223 /nfs/dbraw/zinc/05/82/23/1101058223.db2.gz WKQRZWPCYCINKG-JOCHJYFZSA-N 2 0 352.522 4.476 20 0 FIADRP C[C@@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001167964326 1101349611 /nfs/dbraw/zinc/34/96/11/1101349611.db2.gz OXLPUZDLYCQICJ-NWAUJJNUSA-N 2 0 367.581 4.035 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760161996 1101487545 /nfs/dbraw/zinc/48/75/45/1101487545.db2.gz WNRSOGZEJKTBQW-LBPRGKRZSA-N 2 0 352.309 4.488 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000414999986 1101514251 /nfs/dbraw/zinc/51/42/51/1101514251.db2.gz JSUFNCAXPKMUJG-HNAYVOBHSA-N 2 0 371.912 4.199 20 0 FIADRP Cc1nccn1CCCC[N@@H+]1CCc2cc(Br)cc(C)c2C1 ZINC000537176308 1101520810 /nfs/dbraw/zinc/52/08/10/1101520810.db2.gz ARCDBXIKZHDBPO-UHFFFAOYSA-N 2 0 362.315 4.101 20 0 FIADRP Cn1cnc2cc(CN3CC[C@H]4[C@@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc21 ZINC000537202876 1101554931 /nfs/dbraw/zinc/55/49/31/1101554931.db2.gz CBPXYUQCRYLGNF-GMAHTHKFSA-N 2 0 374.532 4.060 20 0 FIADRP C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000060368357 1101937839 /nfs/dbraw/zinc/93/78/39/1101937839.db2.gz KFYJXOZIPMGACW-ZACQAIPSSA-N 2 0 350.934 4.222 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC2CC[NH2+]CC2)c2ccc(F)c(F)c2)c1 ZINC000519138372 1101949654 /nfs/dbraw/zinc/94/96/54/1101949654.db2.gz YJTQRCUMHIBYQA-FQEVSTJZSA-N 2 0 362.489 4.365 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cnc(C4CCC4)s3)cc2)CC1 ZINC000519168410 1101983821 /nfs/dbraw/zinc/98/38/21/1101983821.db2.gz BUGNUTQOFXLMSW-UHFFFAOYSA-N 2 0 371.550 4.173 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1OCC ZINC000415009026 1102043466 /nfs/dbraw/zinc/04/34/66/1102043466.db2.gz SZONBTMRHIUBKC-GOEBONIOSA-N 2 0 354.922 4.135 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000415012834 1102248324 /nfs/dbraw/zinc/24/83/24/1102248324.db2.gz XRYDZVWRFGZCPO-AHCXZYCDSA-N 2 0 358.423 4.230 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cccc(OCc2ccccn2)c1)c1ccccc1 ZINC000415048146 1102269421 /nfs/dbraw/zinc/26/94/21/1102269421.db2.gz FRGMMSQMTPHLEX-HSZRJFAPSA-N 2 0 361.489 4.230 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCS2 ZINC000187729021 1102304640 /nfs/dbraw/zinc/30/46/40/1102304640.db2.gz HXNPBQWMAWJYMB-FQEVSTJZSA-N 2 0 356.535 4.474 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(CO)c1 ZINC000121224809 1102348588 /nfs/dbraw/zinc/34/85/88/1102348588.db2.gz GYZATURYCFVEKU-OALUTQOASA-N 2 0 352.522 4.262 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]3CC[NH2+][C@@H](C)C3)s2)cc1 ZINC000415107396 1102353898 /nfs/dbraw/zinc/35/38/98/1102353898.db2.gz NUZVEMYGDHHJEA-OFQRWUPVSA-N 2 0 359.539 4.166 20 0 FIADRP Cc1nc(C[NH+]2CCC(CC[NH+](C)C)CC2)oc1-c1ccc(Cl)cc1 ZINC000121237996 1102354109 /nfs/dbraw/zinc/35/41/09/1102354109.db2.gz XPRFFVCIHMFYRG-UHFFFAOYSA-N 2 0 361.917 4.467 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c(Cl)c1 ZINC000532461119 1102360701 /nfs/dbraw/zinc/36/07/01/1102360701.db2.gz ZRFKZPOPFRYBKG-AWEZNQCLSA-N 2 0 365.949 4.264 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000121274593 1102361488 /nfs/dbraw/zinc/36/14/88/1102361488.db2.gz JCHPKVKXGRVKNY-MOPGFXCFSA-N 2 0 363.615 4.111 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Br)c2)[C@@H](C)C1 ZINC000537635825 1102382710 /nfs/dbraw/zinc/38/27/10/1102382710.db2.gz ZDQLHQXDHLTUPY-MPGHIAIKSA-N 2 0 353.348 4.215 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1cccc(Br)c1 ZINC000532488675 1102429651 /nfs/dbraw/zinc/42/96/51/1102429651.db2.gz XOWCKHHFOQVKMX-JKIFEVAISA-N 2 0 353.348 4.045 20 0 FIADRP C[C@@H](c1nnc(-c2ccccc2)o1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000121670341 1102433193 /nfs/dbraw/zinc/43/31/93/1102433193.db2.gz RSYMFMABKDAWOV-SFHVURJKSA-N 2 0 368.525 4.386 20 0 FIADRP COC(=O)c1cccc(C[N@H+](C2CCC(C)CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001168205871 1102469569 /nfs/dbraw/zinc/46/95/69/1102469569.db2.gz LMIZLIXYLVMEIV-BXQDZUEOSA-N 2 0 358.526 4.124 20 0 FIADRP Cc1cc(Br)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167973475 1102526468 /nfs/dbraw/zinc/52/64/68/1102526468.db2.gz LNLQBWNWCPKNBG-YQQQUEKLSA-N 2 0 363.343 4.253 20 0 FIADRP Cc1ccc2ncc(C[NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)n2c1 ZINC001648986699 1102585962 /nfs/dbraw/zinc/58/59/62/1102585962.db2.gz WAQALSZIJPUSLE-UHFFFAOYSA-N 2 0 362.521 4.309 20 0 FIADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550881908 1102653674 /nfs/dbraw/zinc/65/36/74/1102653674.db2.gz FVONANQCVCXADB-VSKRKVRLSA-N 2 0 370.581 4.330 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1cccs1 ZINC000550887730 1102658180 /nfs/dbraw/zinc/65/81/80/1102658180.db2.gz ZFQBEMGUCRXEAO-UYAOXDASSA-N 2 0 370.562 4.328 20 0 FIADRP CC1(C)C[N@H+](CCc2cncs2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836552 1102675308 /nfs/dbraw/zinc/67/53/08/1102675308.db2.gz LDXPYTVEWPUWLL-NRFANRHFSA-N 2 0 369.578 4.308 20 0 FIADRP CC[C@H]1CN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC[C@@H]1[NH3+] ZINC000666657046 1102676398 /nfs/dbraw/zinc/67/63/98/1102676398.db2.gz KSJBPMYHIWELGI-PXNSSMCTSA-N 2 0 372.557 4.042 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257635 1102682781 /nfs/dbraw/zinc/68/27/81/1102682781.db2.gz OTGXORYLWXCAKO-DNVJHFABSA-N 2 0 364.533 4.243 20 0 FIADRP COc1ccc(CC(C)(C)C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167977419 1102720031 /nfs/dbraw/zinc/72/00/31/1102720031.db2.gz CETPBWCWUVVQRI-SEJPIABJSA-N 2 0 356.554 4.259 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC1 ZINC001167977795 1102733481 /nfs/dbraw/zinc/73/34/81/1102733481.db2.gz FHLKOAMRZBIIBG-LEKVTHMOSA-N 3 0 359.602 4.154 20 0 FIADRP C[C@H](CCN[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000551034750 1102823692 /nfs/dbraw/zinc/82/36/92/1102823692.db2.gz ONDWSQHSIROEJV-FGCOXFRFSA-N 2 0 365.565 4.322 20 0 FIADRP Cc1ccc(-c2cccc(C[N@H+]3CCO[C@@H]4C[C@H]([NH+](C)C)CC[C@H]43)c2)cc1 ZINC000537692745 1102872529 /nfs/dbraw/zinc/87/25/29/1102872529.db2.gz MGKFADMEAGMBQX-WXFUMESZSA-N 2 0 364.533 4.346 20 0 FIADRP CC1(C)CCC[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550271811 1102904896 /nfs/dbraw/zinc/90/48/96/1102904896.db2.gz XIMBYRNLJCAVDM-FGZHOGPDSA-N 2 0 370.581 4.474 20 0 FIADRP CO[C@H](C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cccc(Cl)c1 ZINC000551087731 1102905726 /nfs/dbraw/zinc/90/57/26/1102905726.db2.gz ZIVADIBLRLFMAF-NJDAHSKKSA-N 2 0 358.913 4.453 20 0 FIADRP Cc1ccc2nc(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cn2c1 ZINC000551246038 1103000516 /nfs/dbraw/zinc/00/05/16/1103000516.db2.gz PUUSGNMGPZUZDC-TZIWHRDSSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1ccc2nc(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cn2c1 ZINC000551246037 1103001562 /nfs/dbraw/zinc/00/15/62/1103001562.db2.gz PUUSGNMGPZUZDC-PZJWPPBQSA-N 2 0 362.521 4.033 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)ccn1 ZINC000551270092 1103031497 /nfs/dbraw/zinc/03/14/97/1103031497.db2.gz KTORZXXQLMZOPE-QRVBRYPASA-N 2 0 367.537 4.419 20 0 FIADRP [NH3+]CCc1cn(-c2cc[nH+]c3ccc(C(F)(F)F)cc32)c2ccc(O)cc12 ZINC001167985144 1103272827 /nfs/dbraw/zinc/27/28/27/1103272827.db2.gz AFYOVKJZTAXFTK-UHFFFAOYSA-N 2 0 371.362 4.404 20 0 FIADRP COc1ncc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1Cl ZINC000551532402 1103328977 /nfs/dbraw/zinc/32/89/77/1103328977.db2.gz BRIUJYDBPWVRHU-FAEJEUNOSA-N 2 0 365.949 4.437 20 0 FIADRP COc1ncc([C@H](C)NC2CC[NH+](C3CCCCC3)CC2)cc1Cl ZINC000551533211 1103330824 /nfs/dbraw/zinc/33/08/24/1103330824.db2.gz LSFNZAOVGYPZBK-AWEZNQCLSA-N 2 0 351.922 4.191 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000507441138 1103374405 /nfs/dbraw/zinc/37/44/05/1103374405.db2.gz KGUTUKHDOKIQHX-QGZVFWFLSA-N 2 0 351.332 4.222 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000440813257 1103973699 /nfs/dbraw/zinc/97/36/99/1103973699.db2.gz ANPPLZAXEAAJHQ-CQSZACIVSA-N 2 0 366.431 4.093 20 0 FIADRP CC[N@H+](CCC1CCN(Cc2nc(C3CCCC3)no2)CC1)CC1CC1 ZINC000537849885 1103984242 /nfs/dbraw/zinc/98/42/42/1103984242.db2.gz XUTHARZTLHAESY-UHFFFAOYSA-N 2 0 360.546 4.061 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc2ccccc2s1 ZINC000188244041 1104091521 /nfs/dbraw/zinc/09/15/21/1104091521.db2.gz PBGLPAFLCDRNNL-IPELMVKDSA-N 2 0 358.551 4.320 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000520203313 1104171163 /nfs/dbraw/zinc/17/11/63/1104171163.db2.gz XCSBFXJNZTXZOZ-HDICACEKSA-N 2 0 362.521 4.331 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCC(=O)N(C)c2ccccc2)CC1 ZINC000441180992 1104188032 /nfs/dbraw/zinc/18/80/32/1104188032.db2.gz WZOGKIQAEDDMGP-FQEVSTJZSA-N 2 0 371.569 4.016 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000112524941 1104374560 /nfs/dbraw/zinc/37/45/60/1104374560.db2.gz GGTKMPVJGFPPMH-BBWFWOEESA-N 2 0 374.475 4.425 20 0 FIADRP c1ccc(OCC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995571 1104518171 /nfs/dbraw/zinc/51/81/71/1104518171.db2.gz JJAUVSBPEVMSLA-CBQGHPETSA-N 2 0 354.538 4.183 20 0 FIADRP c1ccc2cc(OCC[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441425121 1104563527 /nfs/dbraw/zinc/56/35/27/1104563527.db2.gz WOHDMGVPPHCSHQ-NFBKMPQASA-N 2 0 350.506 4.167 20 0 FIADRP CCCc1cc(NC2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccccc2[nH+]1 ZINC000125296132 1104647333 /nfs/dbraw/zinc/64/73/33/1104647333.db2.gz VTNXGWKADMOBBI-KRWDZBQOSA-N 2 0 353.510 4.100 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2c(Cl)oc3ccccc32)C[C@H](C)O1 ZINC000536413734 1104916547 /nfs/dbraw/zinc/91/65/47/1104916547.db2.gz DJXIPGRQWQXMMC-GASCZTMLSA-N 2 0 350.890 4.065 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000221982636 1104987747 /nfs/dbraw/zinc/98/77/47/1104987747.db2.gz VHBOYJAZPFNYGJ-KRWDZBQOSA-N 2 0 351.332 4.289 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(OCc2ccccc2)c1 ZINC000152366585 1105035579 /nfs/dbraw/zinc/03/55/79/1105035579.db2.gz ATLUSEQOOUXYDE-AZUAARDMSA-N 2 0 350.506 4.401 20 0 FIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000474010374 1105149894 /nfs/dbraw/zinc/14/98/94/1105149894.db2.gz BXCBFMXNFGWQHZ-HXUWFJFHSA-N 2 0 372.940 4.149 20 0 FIADRP COCc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000536487706 1105168225 /nfs/dbraw/zinc/16/82/25/1105168225.db2.gz GTOZUJIOABIWKK-UHFFFAOYSA-N 2 0 364.533 4.321 20 0 FIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3-c3ccnn3C)C2)CC1 ZINC000507834269 1105240661 /nfs/dbraw/zinc/24/06/61/1105240661.db2.gz SIBUYRQZOQMPDJ-HXUWFJFHSA-N 2 0 366.553 4.031 20 0 FIADRP CCSc1cc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)ccn1 ZINC000427868044 1105303347 /nfs/dbraw/zinc/30/33/47/1105303347.db2.gz VUAFITZFRVBWOS-NJDAHSKKSA-N 2 0 367.562 4.194 20 0 FIADRP Cc1cc(N2CCC([NH2+]CCOc3ccccc3)CC2)c2ccccc2[nH+]1 ZINC000301530424 1107060375 /nfs/dbraw/zinc/06/03/75/1107060375.db2.gz JNNUPKRPFVPNOT-UHFFFAOYSA-N 2 0 361.489 4.181 20 0 FIADRP Cc1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)ccc1F ZINC000530664377 1107219404 /nfs/dbraw/zinc/21/94/04/1107219404.db2.gz ISFLLEGBUFIVOL-UHFFFAOYSA-N 2 0 370.512 4.295 20 0 FIADRP Cc1cc(F)ccc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000530664632 1107220663 /nfs/dbraw/zinc/22/06/63/1107220663.db2.gz PUUNUVFJGIBMFW-UHFFFAOYSA-N 2 0 370.512 4.295 20 0 FIADRP CCOC[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000531691763 1108054114 /nfs/dbraw/zinc/05/41/14/1108054114.db2.gz ULPWCGNYOPXRAZ-IBGZPJMESA-N 2 0 352.522 4.464 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531688706 1108056411 /nfs/dbraw/zinc/05/64/11/1108056411.db2.gz ALAPZIXHCZCULP-QGZVFWFLSA-N 2 0 363.505 4.018 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1C ZINC000531710494 1108090004 /nfs/dbraw/zinc/09/00/04/1108090004.db2.gz SHZNBABAHPUCFR-ZJSXRUAMSA-N 2 0 365.565 4.251 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@@H](C)CCCc2cccnc2)CC1 ZINC000453056482 1108133622 /nfs/dbraw/zinc/13/36/22/1108133622.db2.gz CGELWLXFEDDBJR-FQEVSTJZSA-N 2 0 351.538 4.355 20 0 FIADRP Clc1ccc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCC2)cc1 ZINC000453112607 1108180265 /nfs/dbraw/zinc/18/02/65/1108180265.db2.gz QYPTWSTVPOJNGQ-IIBYNOLFSA-N 2 0 362.945 4.272 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cs1 ZINC000453112918 1108180789 /nfs/dbraw/zinc/18/07/89/1108180789.db2.gz UASKXSPRAPCOIM-JKSUJKDBSA-N 2 0 361.530 4.359 20 0 FIADRP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000523440566 1108225306 /nfs/dbraw/zinc/22/53/06/1108225306.db2.gz PDYHRSZWKDEDKU-VWKPWSFCSA-N 2 0 366.496 4.237 20 0 FIADRP c1[nH]c2ncccc2c1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453169872 1108244546 /nfs/dbraw/zinc/24/45/46/1108244546.db2.gz KRMCEKXEQBNLFW-RJGXRXQPSA-N 2 0 374.532 4.138 20 0 FIADRP CCC1(C[NH2+][C@H]2C[C@H](C)n3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000453186676 1108256300 /nfs/dbraw/zinc/25/63/00/1108256300.db2.gz WZMBFWNAUUPWLN-ICSRJNTNSA-N 2 0 352.526 4.171 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(-c2ccccc2)nn1C ZINC000453208584 1108278212 /nfs/dbraw/zinc/27/82/12/1108278212.db2.gz CHGGIICGGLSGCJ-PZJWPPBQSA-N 2 0 374.532 4.260 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H](NC3CC([NH+]4CCCCC4)C3)[C@@H]3CCC[C@H]32)cc1 ZINC000453220881 1108291952 /nfs/dbraw/zinc/29/19/52/1108291952.db2.gz PKMMWUFFTDZDES-NSABXRQASA-N 2 0 367.581 4.036 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453224703 1108296790 /nfs/dbraw/zinc/29/67/90/1108296790.db2.gz UZERQUUTKPOIMZ-FUHWJXTLSA-N 2 0 356.535 4.167 20 0 FIADRP Cc1ccc(C2(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@H]3C)CC2)c(C)c1 ZINC000453238693 1108315761 /nfs/dbraw/zinc/31/57/61/1108315761.db2.gz AGCHDRNOALSXDQ-NFBKMPQASA-N 2 0 363.549 4.230 20 0 FIADRP CC[C@@H](COCC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453265153 1108338837 /nfs/dbraw/zinc/33/88/37/1108338837.db2.gz XHKSGOWZOVSTHT-CADBVGFASA-N 2 0 370.459 4.129 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944983 1108388987 /nfs/dbraw/zinc/38/89/87/1108388987.db2.gz PDXVSOGYFUOHMB-KRWDZBQOSA-N 2 0 368.525 4.129 20 0 FIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2cccnc21 ZINC000531941917 1108420634 /nfs/dbraw/zinc/42/06/34/1108420634.db2.gz UDABSPUSPICMEQ-CVDCTZTESA-N 2 0 359.517 4.278 20 0 FIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C)cc1 ZINC000531965333 1108460692 /nfs/dbraw/zinc/46/06/92/1108460692.db2.gz XGXSXDYIYLLBRF-DHIUTWEWSA-N 2 0 351.538 4.024 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCc2c1cc(Br)cc2F)C1CC1 ZINC000453386199 1108472416 /nfs/dbraw/zinc/47/24/16/1108472416.db2.gz AHAPFNIWLAKDGN-KRWDZBQOSA-N 2 0 355.295 4.040 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)ccc1OC ZINC000453388510 1108473601 /nfs/dbraw/zinc/47/36/01/1108473601.db2.gz WOFFGNZOKRUJKD-AVRDEDQJSA-N 2 0 360.542 4.101 20 0 FIADRP C[N@@H+]1CCC[C@@H](C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)C1 ZINC000531970627 1108478879 /nfs/dbraw/zinc/47/88/79/1108478879.db2.gz YSALLGHHCLDMPB-KRWDZBQOSA-N 2 0 358.476 4.050 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453601098 1108652091 /nfs/dbraw/zinc/65/20/91/1108652091.db2.gz UNGXQUJPPFYWIK-UHFFFAOYSA-N 2 0 357.361 4.135 20 0 FIADRP CN(c1ccccc1C[NH2+]CC(C)(C)c1cccs1)C1CC[NH+](C)CC1 ZINC000532358667 1108770001 /nfs/dbraw/zinc/77/00/01/1108770001.db2.gz ULHQUABSZFADHD-UHFFFAOYSA-N 2 0 371.594 4.346 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@H](C)c3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000524750884 1109137601 /nfs/dbraw/zinc/13/76/01/1109137601.db2.gz DVTPMUZUUMXOTN-DENIHFKCSA-N 2 0 357.586 4.145 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000524759267 1109145509 /nfs/dbraw/zinc/14/55/09/1109145509.db2.gz BTWVPDLBLHYNID-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000524792321 1109154889 /nfs/dbraw/zinc/15/48/89/1109154889.db2.gz PFJCULQIADOIHT-UHFFFAOYSA-N 2 0 358.448 4.028 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428451635 1109313313 /nfs/dbraw/zinc/31/33/13/1109313313.db2.gz DBPXCDOFHYGIPL-YFNKSVMNSA-N 2 0 369.597 4.140 20 0 FIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446884636 1109382603 /nfs/dbraw/zinc/38/26/03/1109382603.db2.gz PTIZRVZDUISCJU-OAHLLOKOSA-N 2 0 354.460 4.491 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447551339 1109567668 /nfs/dbraw/zinc/56/76/68/1109567668.db2.gz KGPBZHLVXOVDIQ-KRWDZBQOSA-N 2 0 372.557 4.085 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)c(F)c1 ZINC000447570923 1109577040 /nfs/dbraw/zinc/57/70/40/1109577040.db2.gz WHNXRLJPWKIXFU-GFCCVEGCSA-N 2 0 355.295 4.113 20 0 FIADRP Brc1cccc2c1CCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447571383 1109578140 /nfs/dbraw/zinc/57/81/40/1109578140.db2.gz XXTWHLWPMPGRGV-LJQANCHMSA-N 2 0 363.343 4.291 20 0 FIADRP COC(=O)c1coc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000447587042 1109588352 /nfs/dbraw/zinc/58/83/52/1109588352.db2.gz PYENBPMAUKTDRD-JENIJYKNSA-N 2 0 370.493 4.018 20 0 FIADRP C[C@@H]([NH2+]CCOCC[NH+](C)C)c1ccc(-c2ccccc2Cl)s1 ZINC000447593453 1109590364 /nfs/dbraw/zinc/59/03/64/1109590364.db2.gz SAWOWMRTCFBJQF-CQSZACIVSA-N 2 0 352.931 4.297 20 0 FIADRP Fc1cccc2c1OCC[C@H]2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447596717 1109590814 /nfs/dbraw/zinc/59/08/14/1109590814.db2.gz CLBLVHIHZKNWGO-NXWNEQKCSA-N 2 0 366.480 4.435 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc21 ZINC000447609739 1109602068 /nfs/dbraw/zinc/60/20/68/1109602068.db2.gz YYLYZDCQRNIAQI-OYDLWJJNSA-N 2 0 364.533 4.227 20 0 FIADRP CC[N@H+](Cc1ccc(-c2nc(-c3ccn4c[nH+]cc4c3)no2)cc1)C(C)C ZINC000447956951 1109687132 /nfs/dbraw/zinc/68/71/32/1109687132.db2.gz XKCXCZVLWSLNDO-UHFFFAOYSA-N 2 0 361.449 4.282 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)C2CCCC2)cc1 ZINC000527360637 1109749800 /nfs/dbraw/zinc/74/98/00/1109749800.db2.gz PRFPTYZFOJGQAL-HSZRJFAPSA-N 2 0 367.537 4.352 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CCC[C@@H](c4ccccc4)CC3)CC2)CC1 ZINC000527651181 1109796165 /nfs/dbraw/zinc/79/61/65/1109796165.db2.gz UBARSTHTNWSPSS-YADHBBJMSA-N 2 0 369.597 4.251 20 0 FIADRP Fc1ccc(F)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1Cl ZINC000527681526 1109809889 /nfs/dbraw/zinc/80/98/89/1109809889.db2.gz BDUFCCVBOBTKJK-UHFFFAOYSA-N 2 0 351.828 4.019 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(F)c(Br)cc1F ZINC000527908074 1109860160 /nfs/dbraw/zinc/86/01/60/1109860160.db2.gz CLZFGPRCADPFCI-UNXYVOJBSA-N 2 0 361.274 4.251 20 0 FIADRP Brc1ccc(/C=C\CC[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000527930453 1109869881 /nfs/dbraw/zinc/86/98/81/1109869881.db2.gz JUTSTDATLSYVIL-IWQZZHSRSA-N 2 0 363.343 4.316 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC/C=C/c1ccc(Br)cc1 ZINC000527932582 1109870534 /nfs/dbraw/zinc/87/05/34/1109870534.db2.gz NKZPDANFWUYYQR-GOHPNSGQSA-N 2 0 351.332 4.171 20 0 FIADRP c1c2cccnc2oc1CN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000449049220 1109967780 /nfs/dbraw/zinc/96/77/80/1109967780.db2.gz RGZIZRMOFDSENN-IFMALSPDSA-N 2 0 361.489 4.314 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000449051028 1109968338 /nfs/dbraw/zinc/96/83/38/1109968338.db2.gz WLVIAJMRSKFMEG-MGPUTAFESA-N 2 0 371.525 4.398 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000449084106 1109970222 /nfs/dbraw/zinc/97/02/22/1109970222.db2.gz WOAVNHSDEOZESG-FCHUYYIVSA-N 3 0 371.613 4.184 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000449084107 1109970457 /nfs/dbraw/zinc/97/04/57/1109970457.db2.gz WOAVNHSDEOZESG-FGZHOGPDSA-N 3 0 371.613 4.184 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000449079167 1109974297 /nfs/dbraw/zinc/97/42/97/1109974297.db2.gz XLMTXQQFXCJFJX-DEOSSOPVSA-N 2 0 365.565 4.024 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc3ccoc32)C[C@H](C)O1 ZINC000449108968 1109977253 /nfs/dbraw/zinc/97/72/53/1109977253.db2.gz UNUJXVJHTJLUHA-HDICACEKSA-N 2 0 364.489 4.332 20 0 FIADRP COc1cccc2c(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)cccc12 ZINC000449089101 1109977802 /nfs/dbraw/zinc/97/78/02/1109977802.db2.gz JEDKLAOVTHDROX-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3c(OC)c2)[C@H](C)C1 ZINC000449137133 1109979934 /nfs/dbraw/zinc/97/99/34/1109979934.db2.gz DQZYBVBTHXBGSA-GCJKJVERSA-N 2 0 370.537 4.075 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc3c(OC)cccc23)[C@@H](C)C1 ZINC000449137081 1109983825 /nfs/dbraw/zinc/98/38/25/1109983825.db2.gz DJJXNOLKXCRUQB-AVRDEDQJSA-N 2 0 370.537 4.075 20 0 FIADRP CC(C)[NH+]1CCC(O)(C[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449196617 1109992560 /nfs/dbraw/zinc/99/25/60/1109992560.db2.gz YMJCOVUUAWLDJB-FQEVSTJZSA-N 2 0 362.945 4.101 20 0 FIADRP COCC[C@@H](NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccc(C)o1 ZINC000449226699 1110002694 /nfs/dbraw/zinc/00/26/94/1110002694.db2.gz NLIXZXZXHGLDLQ-XMSQKQJNSA-N 2 0 370.537 4.351 20 0 FIADRP Fc1cccc(F)c1-c1ncc(C[NH2+]CC2CC[NH+](C3CC3)CC2)s1 ZINC000449286866 1110017261 /nfs/dbraw/zinc/01/72/61/1110017261.db2.gz IZOOUFFOFLJYBP-UHFFFAOYSA-N 2 0 363.477 4.052 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC23CCOCC3)CC1 ZINC000449308252 1110023305 /nfs/dbraw/zinc/02/33/05/1110023305.db2.gz VSYOKUFCYZIZHF-SIKLNZKXSA-N 2 0 356.554 4.021 20 0 FIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CC1 ZINC000449293930 1110025824 /nfs/dbraw/zinc/02/58/24/1110025824.db2.gz JVFCFQAAZLLAIJ-BVVFMGSASA-N 2 0 358.570 4.267 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(C(F)(F)F)CCC2)CC1 ZINC000449320858 1110033153 /nfs/dbraw/zinc/03/31/53/1110033153.db2.gz KIGBPQQGLVJONO-INIZCTEOSA-N 2 0 354.460 4.404 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCCCC1(F)F)C1CC[NH+](C)CC1 ZINC000449377311 1110051539 /nfs/dbraw/zinc/05/15/39/1110051539.db2.gz OQKHTAFNOXOGIW-SFHVURJKSA-N 2 0 365.512 4.132 20 0 FIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000449527471 1110100189 /nfs/dbraw/zinc/10/01/89/1110100189.db2.gz IPCMBUSVSMWFBA-UHFFFAOYSA-N 2 0 368.447 4.101 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449562042 1110110791 /nfs/dbraw/zinc/11/07/91/1110110791.db2.gz ZNTIHVYOVDNNJE-MVCQKVDPSA-N 2 0 365.359 4.375 20 0 FIADRP COc1ccccc1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000538724429 1111263465 /nfs/dbraw/zinc/26/34/65/1111263465.db2.gz JJSSMFWYPUGJHE-UHFFFAOYSA-N 2 0 350.506 4.183 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000538733506 1111269267 /nfs/dbraw/zinc/26/92/67/1111269267.db2.gz YODXIXGUJCREMX-QHCPKHFHSA-N 2 0 360.505 4.051 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1sc(CCOC)nc1C ZINC000538869206 1111328332 /nfs/dbraw/zinc/32/83/32/1111328332.db2.gz IMVOTAZWICYZTF-BPQIPLTHSA-N 2 0 367.603 4.192 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000539056874 1111403755 /nfs/dbraw/zinc/40/37/55/1111403755.db2.gz DDVKZOODWLPXMP-CDNPAEQRSA-N 2 0 374.569 4.140 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1cccc(-c2ccccc2)c1 ZINC000539062253 1111408200 /nfs/dbraw/zinc/40/82/00/1111408200.db2.gz VQBMQUPHQBNXLY-GKVQRAMASA-N 2 0 364.533 4.382 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1csc(C(C)(C)C)n1 ZINC000539045030 1111410100 /nfs/dbraw/zinc/41/01/00/1111410100.db2.gz ZAVNLMPCWNDJNH-YLJYHZDGSA-N 2 0 371.594 4.483 20 0 FIADRP Cc1cc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)ccc1F ZINC000539163599 1111457379 /nfs/dbraw/zinc/45/73/79/1111457379.db2.gz IQPUMTLFRAKDGS-QFIPXVFZSA-N 2 0 356.485 4.315 20 0 FIADRP CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000462115123 1111502588 /nfs/dbraw/zinc/50/25/88/1111502588.db2.gz CTYPBONWJOSNPA-FQEVSTJZSA-N 2 0 366.977 4.122 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1O2 ZINC000539368385 1111533005 /nfs/dbraw/zinc/53/30/05/1111533005.db2.gz QBZQDNYTBOAVAJ-FQEVSTJZSA-N 2 0 370.924 4.460 20 0 FIADRP Cc1nn(C)c(C)c1CCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552061817 1111562487 /nfs/dbraw/zinc/56/24/87/1111562487.db2.gz BDYOBDFVCZOGGG-UHFFFAOYSA-N 2 0 368.569 4.002 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@H]4CCOC5(CCC5)C4)[C@@H]3C2)cc1 ZINC000552062592 1111562833 /nfs/dbraw/zinc/56/28/33/1111562833.db2.gz AGTKBNUBJBPMJL-GPJHCHHRSA-N 2 0 368.565 4.369 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]2CCC[C@@H]21 ZINC000552259550 1111639082 /nfs/dbraw/zinc/63/90/82/1111639082.db2.gz KSQCGVLKMKLHLB-SQNIBIBYSA-N 2 0 361.942 4.426 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CC2(C[NH+](C)C)CCCC2)cc1 ZINC000552285144 1111647981 /nfs/dbraw/zinc/64/79/81/1111647981.db2.gz DQOSWCBRMWQVPT-QFIPXVFZSA-N 2 0 367.537 4.086 20 0 FIADRP CC(C)(C)n1cc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cn1 ZINC000552274011 1111654301 /nfs/dbraw/zinc/65/43/01/1111654301.db2.gz ZGTAVNDUPKHBNM-UHFFFAOYSA-N 2 0 366.553 4.126 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000552325640 1111670240 /nfs/dbraw/zinc/67/02/40/1111670240.db2.gz XVSMJLLTFXMPCQ-QQTQMKHKSA-N 2 0 352.950 4.169 20 0 FIADRP COc1ccc2oc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)cc2c1 ZINC000478349197 1111757106 /nfs/dbraw/zinc/75/71/06/1111757106.db2.gz ZVICMSIWUHUNJO-UHFFFAOYSA-N 2 0 364.489 4.443 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc(F)ccc1F ZINC000479055242 1111937880 /nfs/dbraw/zinc/93/78/80/1111937880.db2.gz GXTOKFXUXLOGOY-JXXFODFXSA-N 2 0 354.485 4.141 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3c(cc(C)cc3C)[nH]2)[C@H](C)C1 ZINC000479396183 1112011833 /nfs/dbraw/zinc/01/18/33/1112011833.db2.gz PBFROJQNLJEMFB-WIYYLYMNSA-N 2 0 357.542 4.011 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000479463556 1112033367 /nfs/dbraw/zinc/03/33/67/1112033367.db2.gz IPRVUYDLNSKAJR-MJGOQNOKSA-N 2 0 355.501 4.064 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(F)cc3)C2)[C@H](C)C1 ZINC000479492965 1112045663 /nfs/dbraw/zinc/04/56/63/1112045663.db2.gz XVPMDDDAEUZGEF-IYERYRBDSA-N 2 0 362.533 4.188 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@@H](C)C1 ZINC000479535722 1112060392 /nfs/dbraw/zinc/06/03/92/1112060392.db2.gz IUBNQSUBOMGGHZ-GIUOSPMZSA-N 2 0 364.961 4.313 20 0 FIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)cc2c(C)c1 ZINC000479544422 1112063912 /nfs/dbraw/zinc/06/39/12/1112063912.db2.gz PZJOXOSYRAIPQS-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000479604260 1112084513 /nfs/dbraw/zinc/08/45/13/1112084513.db2.gz VHPHCWOHEIXFFU-UHFFFAOYSA-N 2 0 368.525 4.403 20 0 FIADRP Cc1c([C@H](C)NCCC[NH+](C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000479877351 1112174326 /nfs/dbraw/zinc/17/43/26/1112174326.db2.gz XFCZJRGKONEURM-LBPRGKRZSA-N 2 0 355.313 4.090 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCO[C@@H](C(F)(F)F)C2)CC1 ZINC000554049188 1112176068 /nfs/dbraw/zinc/17/60/68/1112176068.db2.gz LXHUQNRWZUUEPR-RTBURBONSA-N 2 0 370.459 4.118 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000479899247 1112180734 /nfs/dbraw/zinc/18/07/34/1112180734.db2.gz ILOSLDXVNNFBSI-MOPGFXCFSA-N 2 0 374.573 4.475 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccccc1CN1CCOCC1)c1ccccc1 ZINC000479899756 1112181240 /nfs/dbraw/zinc/18/12/40/1112181240.db2.gz ROGZYQFXTHAWAC-QHCPKHFHSA-N 2 0 352.522 4.396 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H](CO)c3ccccc3Cl)CC2)C1 ZINC000554087888 1112198173 /nfs/dbraw/zinc/19/81/73/1112198173.db2.gz DSQFTVXWMQUISE-AOIWGVFYSA-N 2 0 364.961 4.049 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc(F)ccc2C)CC1 ZINC000480025837 1112243875 /nfs/dbraw/zinc/24/38/75/1112243875.db2.gz YNNWEWPOUWXTBD-KRWDZBQOSA-N 2 0 373.491 4.266 20 0 FIADRP CC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000480165686 1112313219 /nfs/dbraw/zinc/31/32/19/1112313219.db2.gz IDXVZCAZBHVVPZ-QHCPKHFHSA-N 2 0 367.537 4.157 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000554369453 1112320382 /nfs/dbraw/zinc/32/03/82/1112320382.db2.gz GYHBPDIQENWHAC-ZIFCJYIRSA-N 2 0 371.500 4.181 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(Cl)cn1 ZINC000480339173 1112387818 /nfs/dbraw/zinc/38/78/18/1112387818.db2.gz WCMYNHHRCYILLO-BRWVUGGUSA-N 2 0 373.928 4.195 20 0 FIADRP CO[C@@H](C)[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000480538332 1112466925 /nfs/dbraw/zinc/46/69/25/1112466925.db2.gz IHXGZOWKHICHEI-OALUTQOASA-N 2 0 352.522 4.462 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000554811624 1112507503 /nfs/dbraw/zinc/50/75/03/1112507503.db2.gz MHKKEPPCVNEBHA-KIZRIRGWSA-N 2 0 356.554 4.224 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCc4sccc43)cc2)CC1 ZINC000480720862 1112562473 /nfs/dbraw/zinc/56/24/73/1112562473.db2.gz LJZIZTSMPWMALQ-OAQYLSRUSA-N 2 0 369.578 4.053 20 0 FIADRP C[N@H+](Cc1ccccc1)[C@@H](CNC1CC[NH+](C2CCCCC2)CC1)C1CC1 ZINC000480709820 1112564107 /nfs/dbraw/zinc/56/41/07/1112564107.db2.gz OAGZZOLOXKKVSM-DEOSSOPVSA-N 2 0 369.597 4.284 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000480724590 1112572534 /nfs/dbraw/zinc/57/25/34/1112572534.db2.gz CPSQHLAMQBGISK-JOCHJYFZSA-N 2 0 356.485 4.323 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480763950 1112592801 /nfs/dbraw/zinc/59/28/01/1112592801.db2.gz WYYFHPOWPHGXCY-HXUWFJFHSA-N 2 0 351.966 4.044 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000480779414 1112593970 /nfs/dbraw/zinc/59/39/70/1112593970.db2.gz KMOBGTBTWLPHQO-FQEVSTJZSA-N 2 0 371.594 4.286 20 0 FIADRP FC(F)(F)c1ccccc1OCCCC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000554972301 1112599815 /nfs/dbraw/zinc/59/98/15/1112599815.db2.gz JCJRYGSLLDEXEN-KRWDZBQOSA-N 2 0 370.459 4.282 20 0 FIADRP CSC1(C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)CC[NH+](C)CC1 ZINC000555003373 1112613342 /nfs/dbraw/zinc/61/33/42/1112613342.db2.gz VTFNIESVAJOOQP-AWEZNQCLSA-N 2 0 360.489 4.053 20 0 FIADRP CCOCc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000480810377 1112615962 /nfs/dbraw/zinc/61/59/62/1112615962.db2.gz DYVQUYMOWXFHPL-CVDCTZTESA-N 2 0 352.522 4.223 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C[C@H](C)O1 ZINC000480832545 1112631880 /nfs/dbraw/zinc/63/18/80/1112631880.db2.gz KDTYQFKZPXUHBQ-SELNLUPBSA-N 2 0 370.512 4.394 20 0 FIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000162867358 1112844244 /nfs/dbraw/zinc/84/42/44/1112844244.db2.gz VQXRRNULMZRFQQ-OAGGEKHMSA-N 2 0 367.603 4.289 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000481297559 1112865952 /nfs/dbraw/zinc/86/59/52/1112865952.db2.gz DZLDFOICQUZNPE-GOSISDBHSA-N 2 0 366.505 4.081 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(C)cc4)sc32)C1 ZINC000481302052 1112886819 /nfs/dbraw/zinc/88/68/19/1112886819.db2.gz BYJKTPLNOAJDCV-SJLPKXTDSA-N 2 0 355.551 4.427 20 0 FIADRP CC[NH+](CC)[C@@H]1CCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877304 1113040843 /nfs/dbraw/zinc/04/08/43/1113040843.db2.gz RFMAHQRSNYGDOQ-CYBMUJFWSA-N 2 0 353.388 4.054 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000481720338 1113060953 /nfs/dbraw/zinc/06/09/53/1113060953.db2.gz FJJYABIYXBYBFN-YVHKJVDXSA-N 2 0 350.506 4.107 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H]2CCSc3ccc(Br)cc32)CC1 ZINC000482351463 1113229542 /nfs/dbraw/zinc/22/95/42/1113229542.db2.gz YEIBVFXDDCHITD-INIZCTEOSA-N 2 0 369.372 4.308 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3c2cc(Br)cc3F)C1 ZINC000482345930 1113230802 /nfs/dbraw/zinc/23/08/02/1113230802.db2.gz SURIJBXDBAMLFI-UGSOOPFHSA-N 2 0 369.322 4.286 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000482370478 1113235204 /nfs/dbraw/zinc/23/52/04/1113235204.db2.gz QQYBJWHJPVKHAK-GOSISDBHSA-N 2 0 354.542 4.180 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)CN1CC[NH+](C)CC1 ZINC000482447719 1113259813 /nfs/dbraw/zinc/25/98/13/1113259813.db2.gz MKRNHAHOKNXQOM-PMACEKPBSA-N 2 0 357.586 4.268 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CCCO2 ZINC000482439003 1113260009 /nfs/dbraw/zinc/26/00/09/1113260009.db2.gz NWLQIUWJEUXNBY-JTHBVZDNSA-N 2 0 364.533 4.363 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OC)cc1 ZINC000482451275 1113263488 /nfs/dbraw/zinc/26/34/88/1113263488.db2.gz RXCFWQDHBBSMNC-NFBKMPQASA-N 2 0 352.522 4.301 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482514667 1113284860 /nfs/dbraw/zinc/28/48/60/1113284860.db2.gz ZVLIWTUODPERRR-KXBFYZLASA-N 2 0 372.384 4.308 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(C(C)(C)C)cs1 ZINC000482541185 1113288482 /nfs/dbraw/zinc/28/84/82/1113288482.db2.gz DZXPGHMBLOFKOT-PKOBYXMFSA-N 2 0 371.594 4.483 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2CC[NH+](C)CC2)CCC3)cc1 ZINC000482553997 1113298065 /nfs/dbraw/zinc/29/80/65/1113298065.db2.gz HMPJTUOUWSAANS-SFHVURJKSA-N 2 0 355.551 4.427 20 0 FIADRP C[C@@H]([NH2+]CCCc1c[nH]c2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000482644191 1113318813 /nfs/dbraw/zinc/31/88/13/1113318813.db2.gz SGNAAQFCEAXMFS-GOSISDBHSA-N 2 0 365.521 4.392 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc2cc(OC)ccc2c1 ZINC000482867869 1113382059 /nfs/dbraw/zinc/38/20/59/1113382059.db2.gz PBFAQYQXUBVXSR-GMAHTHKFSA-N 2 0 370.537 4.126 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(-c2ccccc2)cc1 ZINC000482875427 1113386807 /nfs/dbraw/zinc/38/68/07/1113386807.db2.gz LWLGAGSLTNHIFF-CVDCTZTESA-N 2 0 352.522 4.241 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)ccc1OC(F)F ZINC000483185970 1113463054 /nfs/dbraw/zinc/46/30/54/1113463054.db2.gz OGTGHPFEAMPIJY-SUMWQHHRSA-N 2 0 358.473 4.314 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486487856 1113579857 /nfs/dbraw/zinc/57/98/57/1113579857.db2.gz KNNYKMKWXKOREK-APWZRJJASA-N 2 0 360.448 4.288 20 0 FIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000486521727 1113590241 /nfs/dbraw/zinc/59/02/41/1113590241.db2.gz XAIMUVYCQQSQBA-XLIONFOSSA-N 2 0 370.562 4.417 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000488445348 1113933180 /nfs/dbraw/zinc/93/31/80/1113933180.db2.gz FRQKCBYZDFIVPS-IZBOUPIGSA-N 2 0 358.570 4.439 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Br)c(F)c2)C1 ZINC000489524340 1114124435 /nfs/dbraw/zinc/12/44/35/1114124435.db2.gz VCLGGPAQBCGLGD-UONOGXRCSA-N 2 0 357.311 4.359 20 0 FIADRP O=C1CCCCN1c1ccc(CNC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000151039798 1114280917 /nfs/dbraw/zinc/28/09/17/1114280917.db2.gz WXLDTXJMKZFDBT-UHFFFAOYSA-N 2 0 369.553 4.090 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491005427 1114358858 /nfs/dbraw/zinc/35/88/58/1114358858.db2.gz KSABTPAKMTYMLL-HXUWFJFHSA-N 2 0 373.338 4.470 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](CN[C@H](c3ccccc3)c3ccccn3)C2)cc1 ZINC000491019706 1114361943 /nfs/dbraw/zinc/36/19/43/1114361943.db2.gz LGESSCDMXFYBPT-WIOPSUGQSA-N 2 0 371.528 4.325 20 0 FIADRP COc1ccc([C@H](NC[C@H]2CCC[N@@H+](C(C)C)C2)c2ccccc2)cc1 ZINC000491043182 1114366980 /nfs/dbraw/zinc/36/69/80/1114366980.db2.gz ZTBFAGWHSWHYLD-AUSIDOKSSA-N 2 0 352.522 4.495 20 0 FIADRP OCC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000491056978 1114368114 /nfs/dbraw/zinc/36/81/14/1114368114.db2.gz VQSKMUKYWWGRHI-VWLOTQADSA-N 2 0 374.528 4.223 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccn1 ZINC000571466596 1114466134 /nfs/dbraw/zinc/46/61/34/1114466134.db2.gz BTYAFUDKVIUIDA-QZTJIDSGSA-N 2 0 353.510 4.315 20 0 FIADRP C[N@H+](Cc1ccc(-n2cnc3ccccc32)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000571602530 1114483081 /nfs/dbraw/zinc/48/30/81/1114483081.db2.gz HNVHOZBRDOATLI-WCRBZPEASA-N 2 0 360.505 4.083 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000646053786 1114491013 /nfs/dbraw/zinc/49/10/13/1114491013.db2.gz YSYOIWBJXPMLQI-UHFFFAOYSA-N 2 0 366.553 4.175 20 0 FIADRP CCOC(=O)CC(C)(C)CC[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000588204761 1114555338 /nfs/dbraw/zinc/55/53/38/1114555338.db2.gz JFZOWBDTEBTYQO-OALUTQOASA-N 2 0 374.569 4.102 20 0 FIADRP C[C@@H](c1ccccc1Cl)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000588710761 1114601736 /nfs/dbraw/zinc/60/17/36/1114601736.db2.gz LARARRYYLMKYRW-ZACQAIPSSA-N 2 0 350.934 4.222 20 0 FIADRP c1ccc(C2=CCC[NH+](CCCC[N@@H+]3CCC=C(c4ccccn4)C3)C2)nc1 ZINC000572254384 1114619709 /nfs/dbraw/zinc/61/97/09/1114619709.db2.gz MVJXCCONESDMCW-UHFFFAOYSA-N 2 0 374.532 4.135 20 0 FIADRP C[NH+]1CCC2(CC1)CN([C@H](c1ccccc1)c1ccc(Cl)cc1)CCO2 ZINC000646103475 1114967889 /nfs/dbraw/zinc/96/78/89/1114967889.db2.gz VMRQDHQZKWCAEF-OAQYLSRUSA-N 2 0 370.924 4.226 20 0 FIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)o2)cc1 ZINC000590787241 1114974446 /nfs/dbraw/zinc/97/44/46/1114974446.db2.gz WIUXBWLLLIZGDT-KRWDZBQOSA-N 2 0 356.514 4.158 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000593689356 1115342235 /nfs/dbraw/zinc/34/22/35/1115342235.db2.gz HVKNVIYGIWOJJL-WOJBJXKFSA-N 2 0 358.526 4.019 20 0 FIADRP COc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000669613144 1115664672 /nfs/dbraw/zinc/66/46/72/1115664672.db2.gz PZILLZPCWFNGTK-QFIPXVFZSA-N 2 0 350.506 4.458 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)s2)c1 ZINC000598956212 1115773503 /nfs/dbraw/zinc/77/35/03/1115773503.db2.gz SQGMFMGZQSNWMB-UHFFFAOYSA-N 2 0 360.523 4.055 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1F ZINC000669679727 1115774421 /nfs/dbraw/zinc/77/44/21/1115774421.db2.gz NTGZFPYPDHEKAU-KRWDZBQOSA-N 2 0 356.485 4.356 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3F)CC1)C2 ZINC001168414625 1115777827 /nfs/dbraw/zinc/77/78/27/1115777827.db2.gz HKDVBRRYMMRYLP-JOCHJYFZSA-N 2 0 370.487 4.324 20 0 FIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1F ZINC000669683862 1115782614 /nfs/dbraw/zinc/78/26/14/1115782614.db2.gz YTDFSULSLHMRBH-IEBWSBKVSA-N 2 0 356.485 4.225 20 0 FIADRP FC(F)(F)c1cccc(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000606447762 1115944837 /nfs/dbraw/zinc/94/48/37/1115944837.db2.gz IJOXBKDYXUZOOT-GOSISDBHSA-N 2 0 370.459 4.425 20 0 FIADRP CC(C)CCn1cccc1C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000606469829 1115947887 /nfs/dbraw/zinc/94/78/87/1115947887.db2.gz PZBFDACXLHNKGN-QFIPXVFZSA-N 2 0 353.554 4.188 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000608061245 1116079899 /nfs/dbraw/zinc/07/98/99/1116079899.db2.gz JBWNQVXVKUBLBM-UGKGYDQZSA-N 2 0 374.532 4.420 20 0 FIADRP Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000608065168 1116080368 /nfs/dbraw/zinc/08/03/68/1116080368.db2.gz YHYQVGANAGMBAI-GOSISDBHSA-N 2 0 356.510 4.174 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)Sc1ccccc1 ZINC000608067112 1116080740 /nfs/dbraw/zinc/08/07/40/1116080740.db2.gz WNNJNWYZPHBLIP-IBGZPJMESA-N 2 0 370.562 4.432 20 0 FIADRP Cc1cc(C)c(C[NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)c(C)c1 ZINC000608070243 1116080764 /nfs/dbraw/zinc/08/07/64/1116080764.db2.gz BIAJMTXZQGGRDZ-UHFFFAOYSA-N 2 0 371.956 4.307 20 0 FIADRP FC(F)Sc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000173956444 1116101569 /nfs/dbraw/zinc/10/15/69/1116101569.db2.gz UOENRLFTDKAVIE-UHFFFAOYSA-N 2 0 370.509 4.078 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)c1 ZINC000535416003 1116305761 /nfs/dbraw/zinc/30/57/61/1116305761.db2.gz YASJSIRKQWWTGL-JOCHJYFZSA-N 2 0 365.521 4.050 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2ccccc2o1 ZINC000539559773 1116343916 /nfs/dbraw/zinc/34/39/16/1116343916.db2.gz BZYWQXRUURTQBS-QFIPXVFZSA-N 2 0 367.493 4.255 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311514034 1116356819 /nfs/dbraw/zinc/35/68/19/1116356819.db2.gz OEUDNMIWEYKUFT-QUCCMNQESA-N 2 0 350.506 4.184 20 0 FIADRP Cc1ccc(CC[C@@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000539690844 1116366416 /nfs/dbraw/zinc/36/64/16/1116366416.db2.gz WVZYRALKKJOCCL-LJQANCHMSA-N 2 0 366.553 4.354 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000504900427 1116371431 /nfs/dbraw/zinc/37/14/31/1116371431.db2.gz XUJYDDZBNVXPAC-TZIWHRDSSA-N 2 0 355.570 4.083 20 0 FIADRP CC(C)(C)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)s1 ZINC000539822000 1116386250 /nfs/dbraw/zinc/38/62/50/1116386250.db2.gz WEGGUOUTGUSJHL-UHFFFAOYSA-N 2 0 350.572 4.122 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)[C@@H](C)C1 ZINC000539835155 1116388784 /nfs/dbraw/zinc/38/87/84/1116388784.db2.gz HSUCKNYYWSUSRN-BTYIYWSLSA-N 2 0 374.960 4.305 20 0 FIADRP C[NH+](C)CC1CC[NH+]([C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000539842364 1116389700 /nfs/dbraw/zinc/38/97/00/1116389700.db2.gz UGVKUCSOXBJYQG-GOSISDBHSA-N 2 0 351.332 4.100 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000539898427 1117740382 /nfs/dbraw/zinc/74/03/82/1117740382.db2.gz QTBJBCQNBOVJRK-GGAORHGYSA-N 2 0 369.597 4.093 20 0 FIADRP Cc1n[nH]cc1C[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462799137 1117769443 /nfs/dbraw/zinc/76/94/43/1117769443.db2.gz RGFGEUVKFQGCDT-NRFANRHFSA-N 2 0 358.505 4.200 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000462796930 1117778554 /nfs/dbraw/zinc/77/85/54/1117778554.db2.gz ZLSLNYLTYCBYBK-UHFFFAOYSA-N 2 0 354.542 4.294 20 0 FIADRP Fc1ccccc1N1CC[C@H](C[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000462801312 1117785260 /nfs/dbraw/zinc/78/52/60/1117785260.db2.gz BYUTYXTZNLYIBP-GOSISDBHSA-N 2 0 359.533 4.039 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1cccnc1 ZINC000539968336 1117786856 /nfs/dbraw/zinc/78/68/56/1117786856.db2.gz TZSOTRFEBHHXMD-FQEVSTJZSA-N 2 0 351.538 4.467 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H]2CCC[C@@H]21 ZINC000462820289 1117796073 /nfs/dbraw/zinc/79/60/73/1117796073.db2.gz VCATYQCAXUEJJG-DBDQLMEASA-N 2 0 363.343 4.158 20 0 FIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2C)CC1)CC1CC1 ZINC000540046172 1117827564 /nfs/dbraw/zinc/82/75/64/1117827564.db2.gz DDOSMURMEBCMGU-IBGZPJMESA-N 2 0 371.569 4.156 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000540144546 1117895784 /nfs/dbraw/zinc/89/57/84/1117895784.db2.gz ZMFBSSMJKAGGSS-DYXWJJEUSA-N 2 0 354.542 4.415 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CCC2)[C@H](C)C1 ZINC000540159628 1117903654 /nfs/dbraw/zinc/90/36/54/1117903654.db2.gz BFEDEZYJKKXGHY-IFMALSPDSA-N 2 0 358.570 4.126 20 0 FIADRP C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000540161428 1117904275 /nfs/dbraw/zinc/90/42/75/1117904275.db2.gz UENCKHVRIRFLAG-KUHUBIRLSA-N 2 0 360.885 4.065 20 0 FIADRP C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000540161429 1117904533 /nfs/dbraw/zinc/90/45/33/1117904533.db2.gz UENCKHVRIRFLAG-LIRRHRJNSA-N 2 0 360.885 4.065 20 0 FIADRP CC(C)O[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1(C)C ZINC000463023064 1117927709 /nfs/dbraw/zinc/92/77/09/1117927709.db2.gz GKSXCCGLTZTMBH-RTBURBONSA-N 2 0 350.572 4.142 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000463090663 1117962514 /nfs/dbraw/zinc/96/25/14/1117962514.db2.gz SSDMLFZBIBJDQL-OAQYLSRUSA-N 2 0 368.569 4.465 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)[C@@H](C)C1 ZINC000463108971 1117968705 /nfs/dbraw/zinc/96/87/05/1117968705.db2.gz IIXRUQSWZLMBDT-GHTZIAJQSA-N 2 0 356.558 4.177 20 0 FIADRP Fc1ccc(CCN2CCC([NH2+]C[C@@H]3CCc4ccccc43)CC2)cc1 ZINC000463168283 1118002181 /nfs/dbraw/zinc/00/21/81/1118002181.db2.gz YHGQYDRUGXMYSW-FQEVSTJZSA-N 2 0 352.497 4.152 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+]C2CCN(CCc3ccccc3)CC2)CC1 ZINC000463194732 1118010510 /nfs/dbraw/zinc/01/05/10/1118010510.db2.gz ZJQIUBQHTQSYRG-UHFFFAOYSA-N 2 0 371.613 4.041 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000540418059 1118044493 /nfs/dbraw/zinc/04/44/93/1118044493.db2.gz TXQDGDQRDZSYSU-SJKOYZFVSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Oc1ccccc1 ZINC000540493480 1118091525 /nfs/dbraw/zinc/09/15/25/1118091525.db2.gz BAMTVGHIAHMYNP-NQIIRXRSSA-N 2 0 366.505 4.032 20 0 FIADRP Cn1cc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c(C(C)(C)C)n1 ZINC000540495716 1118092592 /nfs/dbraw/zinc/09/25/92/1118092592.db2.gz GCYIFLXOCWNGQX-UHFFFAOYSA-N 2 0 368.569 4.062 20 0 FIADRP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1 ZINC000540593955 1118138304 /nfs/dbraw/zinc/13/83/04/1118138304.db2.gz CBFUHKSHYDOUOI-MOPGFXCFSA-N 2 0 371.569 4.228 20 0 FIADRP C[C@@H](C[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000540595035 1118139336 /nfs/dbraw/zinc/13/93/36/1118139336.db2.gz SLFRICRCRKOGHY-QFBILLFUSA-N 2 0 351.966 4.043 20 0 FIADRP CSC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000540986441 1118338848 /nfs/dbraw/zinc/33/88/48/1118338848.db2.gz GYXKRXWRNZDTBW-QGZVFWFLSA-N 2 0 360.489 4.431 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)CC2)cc1 ZINC000464070101 1118429965 /nfs/dbraw/zinc/42/99/65/1118429965.db2.gz ITBNTGCXWDMDHU-RJGXRXQPSA-N 2 0 356.554 4.084 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCc3c(Cl)cccc32)cc1 ZINC000541746149 1118624786 /nfs/dbraw/zinc/62/47/86/1118624786.db2.gz FPGFIAXYADFUNB-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000541738765 1118627477 /nfs/dbraw/zinc/62/74/77/1118627477.db2.gz OYIGZMXYUSVTNM-RZXSNQJFSA-N 2 0 369.578 4.445 20 0 FIADRP CO[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000541902211 1118699705 /nfs/dbraw/zinc/69/97/05/1118699705.db2.gz LUZMOXQVOQNDDB-HXUWFJFHSA-N 2 0 350.934 4.414 20 0 FIADRP CO[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000541902210 1118700041 /nfs/dbraw/zinc/70/00/41/1118700041.db2.gz LUZMOXQVOQNDDB-FQEVSTJZSA-N 2 0 350.934 4.414 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2ccc(C)cc2C)CC1 ZINC000542017179 1118748085 /nfs/dbraw/zinc/74/80/85/1118748085.db2.gz KBRWRMUQVXIWOY-UHFFFAOYSA-N 2 0 359.558 4.076 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1OC ZINC000173351266 1119035254 /nfs/dbraw/zinc/03/52/54/1119035254.db2.gz NAEBCAZYZSHKRJ-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173949791 1119082072 /nfs/dbraw/zinc/08/20/72/1119082072.db2.gz NDCDIRHHSGOXJQ-INIZCTEOSA-N 2 0 370.459 4.343 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(OC(C)(C)C)C1 ZINC000493204659 1119339752 /nfs/dbraw/zinc/33/97/52/1119339752.db2.gz LKFQYTGSBJXCJG-UHFFFAOYSA-N 2 0 356.510 4.347 20 0 FIADRP CC(C)(C)OC(=O)CCCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000178119406 1119372570 /nfs/dbraw/zinc/37/25/70/1119372570.db2.gz IGCZDFMFCYUYOK-UHFFFAOYSA-N 2 0 352.563 4.275 20 0 FIADRP CCC1(C[NH2+]Cc2cccc(O)c2OC)CC[NH+](Cc2ccccc2)CC1 ZINC000493764153 1119492152 /nfs/dbraw/zinc/49/21/52/1119492152.db2.gz JGKUQBCEYXYRQX-UHFFFAOYSA-N 2 0 368.521 4.183 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000493904514 1119504397 /nfs/dbraw/zinc/50/43/97/1119504397.db2.gz DGVFWSRMWCNVRP-UTKZUKDTSA-N 2 0 358.551 4.326 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)CC1 ZINC000542475362 1119548736 /nfs/dbraw/zinc/54/87/36/1119548736.db2.gz WJZKQFSNTWAPNG-NRFANRHFSA-N 2 0 359.464 4.161 20 0 FIADRP CCCc1csc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000494177101 1119551530 /nfs/dbraw/zinc/55/15/30/1119551530.db2.gz UNCODCHYXALAQJ-HKUYNNGSSA-N 2 0 357.567 4.486 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000186138707 1119708276 /nfs/dbraw/zinc/70/82/76/1119708276.db2.gz SVPKXYIRYBSYEE-AWEZNQCLSA-N 2 0 350.553 4.381 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000186283481 1119718703 /nfs/dbraw/zinc/71/87/03/1119718703.db2.gz WEGMYFODEBMBJZ-GMAHTHKFSA-N 2 0 364.533 4.037 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000153004604 1119821511 /nfs/dbraw/zinc/82/15/11/1119821511.db2.gz GMRCDNODSCMQDA-JOCHJYFZSA-N 2 0 368.521 4.193 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000189257405 1119877394 /nfs/dbraw/zinc/87/73/94/1119877394.db2.gz WQNGHFOKUFLRJR-BUNPMSMLSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3F)CC2)C1 ZINC000542484737 1119904361 /nfs/dbraw/zinc/90/43/61/1119904361.db2.gz RXKFHUZGCULSHU-RHSMWYFYSA-N 2 0 354.460 4.279 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccccc1Cl ZINC000192788076 1120083544 /nfs/dbraw/zinc/08/35/44/1120083544.db2.gz IWAUUDVFSRHCTL-FQEVSTJZSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(Cc2ccccc2)c1 ZINC000195136401 1120120803 /nfs/dbraw/zinc/12/08/03/1120120803.db2.gz SVKGHSHVDXGSST-REWPJTCUSA-N 2 0 374.532 4.104 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494926303 1120382109 /nfs/dbraw/zinc/38/21/09/1120382109.db2.gz XEMCPGJZTQZQHF-LMVRJCEZSA-N 2 0 362.533 4.251 20 0 FIADRP Fc1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000495077986 1120462169 /nfs/dbraw/zinc/46/21/69/1120462169.db2.gz HAXPCPGZTMLTIU-HTAPYJJXSA-N 2 0 360.517 4.290 20 0 FIADRP Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000495077989 1120462785 /nfs/dbraw/zinc/46/27/85/1120462785.db2.gz HAXPCPGZTMLTIU-VGSWGCGISA-N 2 0 360.517 4.290 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)C1CCCC1 ZINC000495080586 1120464367 /nfs/dbraw/zinc/46/43/67/1120464367.db2.gz RBSXKADDWUCJLT-YTFSRNRJSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000495434252 1120809881 /nfs/dbraw/zinc/80/98/81/1120809881.db2.gz REDPQJITYKWERW-SXWKCWPCSA-N 2 0 374.532 4.434 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000236808302 1120970070 /nfs/dbraw/zinc/97/00/70/1120970070.db2.gz YOIBNIGILXBQGL-NRFANRHFSA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cccc(C)c2)CC1 ZINC000236982607 1120972164 /nfs/dbraw/zinc/97/21/64/1120972164.db2.gz UNHGPENMSDVHKK-GOSISDBHSA-N 2 0 355.501 4.127 20 0 FIADRP Cn1ccnc1[C@@H]1CCCN(c2ccnc3cc(Br)ccc32)C1 ZINC000443969152 1121035220 /nfs/dbraw/zinc/03/52/20/1121035220.db2.gz GHOPHQRGXJSTJO-CYBMUJFWSA-N 2 0 371.282 4.115 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)C1CC[NH+](C)CC1 ZINC000155089495 1121180555 /nfs/dbraw/zinc/18/05/55/1121180555.db2.gz PWAPMOVJOOGSOZ-AWEZNQCLSA-N 2 0 355.507 4.376 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@@H]1CC[NH+]2CCC[C@@H]2C1)C1CCCCC1 ZINC000166255481 1121452694 /nfs/dbraw/zinc/45/26/94/1121452694.db2.gz PHMAQJBTOWQZSJ-FYYLOGMGSA-N 3 0 355.570 4.168 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2coc(-c3c(F)cccc3F)n2)CC1 ZINC000123524917 1121611042 /nfs/dbraw/zinc/61/10/42/1121611042.db2.gz RXJMVWDKBOQNEA-UHFFFAOYSA-N 2 0 363.452 4.174 20 0 FIADRP CC(C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123548825 1121613626 /nfs/dbraw/zinc/61/36/26/1121613626.db2.gz XASVPRROWZZCMB-GOSISDBHSA-N 2 0 359.558 4.191 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1OC(F)(F)F ZINC000123604638 1121617619 /nfs/dbraw/zinc/61/76/19/1121617619.db2.gz SROMJUQOKIUYPF-AWEZNQCLSA-N 2 0 352.400 4.498 20 0 FIADRP C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671752426 1121734530 /nfs/dbraw/zinc/73/45/30/1121734530.db2.gz XOZUJGLQHINZPU-OIULLBJASA-N 2 0 366.549 4.184 20 0 FIADRP C[C@@H](c1ccccc1)[C@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671752425 1121734740 /nfs/dbraw/zinc/73/47/40/1121734740.db2.gz XOZUJGLQHINZPU-LTKAXEJJSA-N 2 0 366.549 4.184 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000125614676 1121797397 /nfs/dbraw/zinc/79/73/97/1121797397.db2.gz AQNVUVGRPVRVIY-HOTGVXAUSA-N 2 0 358.555 4.286 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)s1 ZINC000671764912 1121815675 /nfs/dbraw/zinc/81/56/75/1121815675.db2.gz UYKYVFXNUGVICK-KGLIPLIRSA-N 2 0 369.372 4.149 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125730269 1121819210 /nfs/dbraw/zinc/81/92/10/1121819210.db2.gz YLZNBVBGADXAEW-MOPGFXCFSA-N 2 0 374.573 4.331 20 0 FIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765780616 1121991806 /nfs/dbraw/zinc/99/18/06/1121991806.db2.gz RKKBPHPQUGNVBP-JTSKRJEESA-N 2 0 367.512 4.224 20 0 FIADRP CC(C)N(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(C)C ZINC000497275608 1121992810 /nfs/dbraw/zinc/99/28/10/1121992810.db2.gz KTLNMHFBIJBZSF-FQEVSTJZSA-N 2 0 373.585 4.186 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc(F)c(F)c2)cc1 ZINC000917008860 1121995323 /nfs/dbraw/zinc/99/53/23/1121995323.db2.gz SXGUFALSCXEEIA-ZHRRBRCNSA-N 2 0 374.475 4.162 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001168611642 1122009181 /nfs/dbraw/zinc/00/91/81/1122009181.db2.gz WJOYKVYUNLVRHQ-PXNSSMCTSA-N 2 0 360.542 4.156 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168613676 1122020255 /nfs/dbraw/zinc/02/02/55/1122020255.db2.gz JYCIXDXMBLTLHU-CTNGQTDRSA-N 2 0 360.542 4.015 20 0 FIADRP CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)CCC2 ZINC000765813151 1122102508 /nfs/dbraw/zinc/10/25/08/1122102508.db2.gz BOLNXNPLWJIMPG-UWJYYQICSA-N 2 0 370.541 4.133 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168616158 1122103711 /nfs/dbraw/zinc/10/37/11/1122103711.db2.gz LOCDVNJJSBKPGN-UTYWTXRGSA-N 2 0 358.526 4.040 20 0 FIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616199 1122108260 /nfs/dbraw/zinc/10/82/60/1122108260.db2.gz QPIRGRHMCAWEOK-OFNKIYASSA-N 2 0 374.569 4.406 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000066960832 1122115875 /nfs/dbraw/zinc/11/58/75/1122115875.db2.gz RUAKTPNBOHTJSF-FQEVSTJZSA-N 2 0 373.585 4.383 20 0 FIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542693570 1122289387 /nfs/dbraw/zinc/28/93/87/1122289387.db2.gz JVPIFISCNOFNHN-OWQUAZCHSA-N 2 0 356.460 4.478 20 0 FIADRP COc1cccc(N2CCC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000128745083 1122395530 /nfs/dbraw/zinc/39/55/30/1122395530.db2.gz TYEYEKJAKTVWIT-FQEVSTJZSA-N 2 0 371.569 4.051 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000497821521 1122427479 /nfs/dbraw/zinc/42/74/79/1122427479.db2.gz SYWMDXIIMVHCIL-JOCHJYFZSA-N 2 0 355.501 4.420 20 0 FIADRP C[C@H]([NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000556094865 1122648316 /nfs/dbraw/zinc/64/83/16/1122648316.db2.gz ZGQPJHHNVKJTNG-HARLFGEKSA-N 2 0 360.505 4.358 20 0 FIADRP C[C@@H]1C[C@H](N[C@@H]2CC[NH+](C)[C@H](c3ccccc3)C2)C[N@@H+]1Cc1ccccc1 ZINC000556104970 1122656289 /nfs/dbraw/zinc/65/62/89/1122656289.db2.gz OANNHPYKNHDELQ-JFTIXFDTSA-N 2 0 363.549 4.075 20 0 FIADRP CC(C)CC[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231519 1122749023 /nfs/dbraw/zinc/74/90/23/1122749023.db2.gz WFPYVTVTSFAHED-UNMCSNQZSA-N 2 0 358.570 4.330 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCCC[NH+]2CCCC2)C3)cc1 ZINC000556232900 1122749636 /nfs/dbraw/zinc/74/96/36/1122749636.db2.gz LOMLTGBMQLYOGX-WBDAEOGXSA-N 3 0 355.570 4.038 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3cc(C(F)(F)F)ccn3)CC2)C1 ZINC000556232753 1122749747 /nfs/dbraw/zinc/74/97/47/1122749747.db2.gz IKJVKUBWHWFKNB-KXBFYZLASA-N 2 0 369.475 4.276 20 0 FIADRP Cc1cc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)ccc1F ZINC000556233978 1122750745 /nfs/dbraw/zinc/75/07/45/1122750745.db2.gz UBGCQQGPRXVPEA-JOCHJYFZSA-N 2 0 355.501 4.474 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000556233988 1122750823 /nfs/dbraw/zinc/75/08/23/1122750823.db2.gz UJYVMEQNCIFCKZ-SIKLNZKXSA-N 2 0 356.554 4.084 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)ccn1 ZINC000556248442 1122762052 /nfs/dbraw/zinc/76/20/52/1122762052.db2.gz ZXGOCMOZMQYKIR-SFHVURJKSA-N 2 0 353.510 4.173 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000130165619 1122767767 /nfs/dbraw/zinc/76/77/67/1122767767.db2.gz GEKYWHCESGIEIE-TZIWHRDSSA-N 2 0 372.553 4.040 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1c2ccccc2-c2ccccc21 ZINC000498411062 1122780008 /nfs/dbraw/zinc/78/00/08/1122780008.db2.gz SZRLERYHBWZRFK-UHFFFAOYSA-N 2 0 358.485 4.487 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(OC2CCCC2)cc1 ZINC000556403213 1122872947 /nfs/dbraw/zinc/87/29/47/1122872947.db2.gz DUPKVMKLWGDCOV-UHFFFAOYSA-N 2 0 362.477 4.187 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556609712 1123003058 /nfs/dbraw/zinc/00/30/58/1123003058.db2.gz RKOXRIKBKCFKAB-QGZVFWFLSA-N 2 0 356.485 4.020 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000131308701 1123032551 /nfs/dbraw/zinc/03/25/51/1123032551.db2.gz LNMIXXUMBVPHKL-HZPDHXFCSA-N 2 0 363.937 4.082 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cncn2)cc1Cl ZINC000131308306 1123032670 /nfs/dbraw/zinc/03/26/70/1123032670.db2.gz LNMIXXUMBVPHKL-CVEARBPZSA-N 2 0 363.937 4.082 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCc4ccccn4)[C@H]3C2)cc1 ZINC000556887499 1123164065 /nfs/dbraw/zinc/16/40/65/1123164065.db2.gz YKBVIFKIDPXNGC-XWGVYQGASA-N 2 0 363.549 4.295 20 0 FIADRP CC(C)CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccoc1 ZINC000556889925 1123177533 /nfs/dbraw/zinc/17/75/33/1123177533.db2.gz KVFYDOCECGMMFE-VXKWHMMOSA-N 2 0 356.510 4.113 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)CC[N@@H+]1C ZINC000556914519 1123223255 /nfs/dbraw/zinc/22/32/55/1123223255.db2.gz JILBKYHSFUCFQH-OLZOCXBDSA-N 2 0 357.361 4.005 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000132427052 1123255711 /nfs/dbraw/zinc/25/57/11/1123255711.db2.gz JQVQAJMRHDVLLO-SFHVURJKSA-N 2 0 363.427 4.329 20 0 FIADRP Cc1ccccc1OCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499139679 1123283011 /nfs/dbraw/zinc/28/30/11/1123283011.db2.gz QTDSXKUCRNHHMU-DKUWSORSSA-N 2 0 350.506 4.159 20 0 FIADRP CCC(CC)[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)C ZINC000499146317 1123288197 /nfs/dbraw/zinc/28/81/97/1123288197.db2.gz KUOQYSVYUBGFKU-BJESRGMDSA-N 2 0 357.586 4.138 20 0 FIADRP Fc1cc(F)cc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499156467 1123289480 /nfs/dbraw/zinc/28/94/80/1123289480.db2.gz MAHICXZFWGMUIY-DKUWSORSSA-N 2 0 356.460 4.293 20 0 FIADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499158122 1123298062 /nfs/dbraw/zinc/29/80/62/1123298062.db2.gz RSQKKRXQADZBKE-FXILAVBZSA-N 2 0 356.554 4.367 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1 ZINC000499232150 1123340783 /nfs/dbraw/zinc/34/07/83/1123340783.db2.gz GOWJZYVXIDNGMG-JKLQHZFJSA-N 2 0 350.506 4.239 20 0 FIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccc(F)cc1 ZINC000499250185 1123358055 /nfs/dbraw/zinc/35/80/55/1123358055.db2.gz LTXODGDYFUCAJX-MVWVFHAYSA-N 2 0 368.496 4.378 20 0 FIADRP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H](N[C@H]2CC[N@@H+](CC4CCCC4)C2)C3)cc1 ZINC000499256252 1123367057 /nfs/dbraw/zinc/36/70/57/1123367057.db2.gz PAJBZMAPPSKBJU-XQUALCHDSA-N 2 0 367.581 4.036 20 0 FIADRP Cc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000133461570 1123489836 /nfs/dbraw/zinc/48/98/36/1123489836.db2.gz SCXVFWFGXWDNSZ-UHFFFAOYSA-N 2 0 372.944 4.269 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000133525025 1123495956 /nfs/dbraw/zinc/49/59/56/1123495956.db2.gz PGIAEJVMFWCENG-UWJYYQICSA-N 2 0 354.494 4.192 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000133524792 1123496166 /nfs/dbraw/zinc/49/61/66/1123496166.db2.gz PGIAEJVMFWCENG-DYESRHJHSA-N 2 0 354.494 4.192 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(CC)s2)CC1 ZINC000236802417 1123567570 /nfs/dbraw/zinc/56/75/70/1123567570.db2.gz RJAHBHSNMGUHFV-UHFFFAOYSA-N 2 0 357.567 4.132 20 0 FIADRP C[C@H](NCc1ccc(C[NH+]2CCCCC2)cc1)c1nc2c(s1)CCC2 ZINC000134696651 1123662708 /nfs/dbraw/zinc/66/27/08/1123662708.db2.gz SPGRKKURXBCAHH-INIZCTEOSA-N 2 0 355.551 4.469 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(SC)cc2)[C@H](C)C1 ZINC000245463962 1124042418 /nfs/dbraw/zinc/04/24/18/1124042418.db2.gz PCBORRLRTYOSJR-HLIPFELVSA-N 2 0 350.572 4.196 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ncc(Br)s1 ZINC000245653351 1124169371 /nfs/dbraw/zinc/16/93/71/1124169371.db2.gz KNWKIAUXKVSKDR-CHWSQXEVSA-N 2 0 360.365 4.068 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ncc(Br)s1 ZINC000245701780 1124210299 /nfs/dbraw/zinc/21/02/99/1124210299.db2.gz WSWKTZBCSMSABE-CHWSQXEVSA-N 2 0 360.365 4.211 20 0 FIADRP c1nc2ccccc2n1CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245710246 1124215695 /nfs/dbraw/zinc/21/56/95/1124215695.db2.gz NBPCMSIEKZBIEJ-DKUWSORSSA-N 2 0 374.532 4.212 20 0 FIADRP CO[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245733524 1124227495 /nfs/dbraw/zinc/22/74/95/1124227495.db2.gz QOBJSBLGUCDSKF-KAOXLYBCSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1COc2ccccc21 ZINC000245738536 1124231250 /nfs/dbraw/zinc/23/12/50/1124231250.db2.gz RCPYBGDKNOFTEY-QOPOCTTISA-N 2 0 362.517 4.336 20 0 FIADRP Cc1nc2ccccc2n1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245738850 1124231446 /nfs/dbraw/zinc/23/14/46/1124231446.db2.gz REKWBRWEKQTSBJ-KOUNCHBCSA-N 2 0 374.532 4.130 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245756736 1124241889 /nfs/dbraw/zinc/24/18/89/1124241889.db2.gz UXRRVHFVQYUEJX-YCAMKHIRSA-N 2 0 369.597 4.140 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)c1 ZINC000642622017 1124338798 /nfs/dbraw/zinc/33/87/98/1124338798.db2.gz BQCHEOBPDZRQAL-KDURUIRLSA-N 2 0 352.522 4.463 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1C ZINC000542852113 1124465462 /nfs/dbraw/zinc/46/54/62/1124465462.db2.gz QPCMNONXZYERAX-OFNKIYASSA-N 2 0 366.549 4.419 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCCO1)c1ccc(OCC[NH+](C)C)cc1 ZINC000246993444 1124579906 /nfs/dbraw/zinc/57/99/06/1124579906.db2.gz KYLRQJPRYWOAEC-NMNUPHIUSA-N 2 0 368.521 4.198 20 0 FIADRP Cc1nc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)oc1-c1ccc(Cl)cc1 ZINC000248171648 1124748634 /nfs/dbraw/zinc/74/86/34/1124748634.db2.gz UXGQUCMHUYTOIM-WMZOPIPTSA-N 2 0 359.901 4.220 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000248457629 1124772287 /nfs/dbraw/zinc/77/22/87/1124772287.db2.gz TVMGNQQGTZXBND-UNMCSNQZSA-N 2 0 370.924 4.074 20 0 FIADRP CCc1ccc(-c2ccc(-c3noc([C@@](C)([NH3+])CCCC[NH3+])n3)cc2)cc1 ZINC001212335518 1124841790 /nfs/dbraw/zinc/84/17/90/1124841790.db2.gz CNGGQQLYPPUSGV-QFIPXVFZSA-N 2 0 364.493 4.269 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(F)c1 ZINC000249205526 1124851053 /nfs/dbraw/zinc/85/10/53/1124851053.db2.gz VRWZETWYIYLZKB-VXKWHMMOSA-N 2 0 356.485 4.023 20 0 FIADRP COc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@@H]4CCC[C@@H](C)C4)CC3)c21 ZINC000181331825 1124862768 /nfs/dbraw/zinc/86/27/68/1124862768.db2.gz GCZGWFQZEAUQIE-YLJYHZDGSA-N 2 0 369.553 4.352 20 0 FIADRP CC(C)Oc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063551481 1124928298 /nfs/dbraw/zinc/92/82/98/1124928298.db2.gz VILNQIQIHDQPBX-UHFFFAOYSA-N 2 0 352.522 4.476 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(N2CCCC2=O)cc1 ZINC000765953145 1124975969 /nfs/dbraw/zinc/97/59/69/1124975969.db2.gz AVCFESALOOUPRM-IBGZPJMESA-N 2 0 357.542 4.120 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCCc3nc4ccccc4n3C)CC2)C1 ZINC000090050960 1124979061 /nfs/dbraw/zinc/97/90/61/1124979061.db2.gz XPRAXXFPNWDNRM-ICSRJNTNSA-N 2 0 368.569 4.139 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000090775329 1125019693 /nfs/dbraw/zinc/01/96/93/1125019693.db2.gz YXYIDIOMQNZEHJ-FEPNQTLGSA-N 2 0 357.542 4.339 20 0 FIADRP Fc1ccc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000091343528 1125067565 /nfs/dbraw/zinc/06/75/65/1125067565.db2.gz GPQFBWPNINIGDL-VGOFRKELSA-N 2 0 360.517 4.148 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000499625914 1125362564 /nfs/dbraw/zinc/36/25/64/1125362564.db2.gz OCARCOQPNUAOHM-HROJSSOGSA-N 2 0 359.517 4.481 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnn(Cc3ccccc3)c2)c1 ZINC000065976560 568064043 /nfs/dbraw/zinc/06/40/43/568064043.db2.gz SCILYEPYLCXPTM-UHFFFAOYSA-N 2 0 362.521 4.061 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)ccc1OCc1ccccc1 ZINC000067507222 568076390 /nfs/dbraw/zinc/07/63/90/568076390.db2.gz RRGYTBIPYGUMIN-OAQYLSRUSA-N 2 0 368.521 4.094 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)c1ccsc1 ZINC000563119848 568224567 /nfs/dbraw/zinc/22/45/67/568224567.db2.gz JPUMPQLUMXKNFC-RTWAWAEBSA-N 2 0 369.578 4.138 20 0 FIADRP CCOc1cc2[nH+]ccc(NC[C@H](c3ccco3)[NH+](C)C)c2cc1OCC ZINC000303250747 568262938 /nfs/dbraw/zinc/26/29/38/568262938.db2.gz FOUCSHZYJYJQAR-GOSISDBHSA-N 2 0 369.465 4.340 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CSCCS2)ccc1OC ZINC000183093622 1125750087 /nfs/dbraw/zinc/75/00/87/1125750087.db2.gz WXNKWBOJXIGAMH-MAUKXSAKSA-N 2 0 368.612 4.036 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)ccc1OC ZINC000183129356 1125754599 /nfs/dbraw/zinc/75/45/99/1125754599.db2.gz MAMIWUIXBCKVFS-AQZFEABFSA-N 2 0 360.542 4.145 20 0 FIADRP Brc1ccccc1[C@@H]([NH2+]CCCn1ccnc1)c1ccccc1 ZINC000179963868 1080389770 /nfs/dbraw/zinc/38/97/70/1080389770.db2.gz SECZXUMDRMQPIK-IBGZPJMESA-N 2 0 370.294 4.415 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000180094133 1080440622 /nfs/dbraw/zinc/44/06/22/1080440622.db2.gz DUQIIYWMMSKEQM-ROUUACIJSA-N 2 0 356.485 4.033 20 0 FIADRP COc1cccc([C@@H]([NH2+]CC2CC[NH+](C)CC2)c2ccccc2Cl)c1 ZINC000180459994 1080502159 /nfs/dbraw/zinc/50/21/59/1080502159.db2.gz JGZUOSASKKYYIM-OAQYLSRUSA-N 2 0 358.913 4.369 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)cc1 ZINC000160278365 1080782547 /nfs/dbraw/zinc/78/25/47/1080782547.db2.gz PEKALXNEOVAJAY-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP CC1CC[NH+](C[C@H]2CCC[N@@H+](C3CC(OCc4ccccc4)C3)C2)CC1 ZINC001167256521 1080915687 /nfs/dbraw/zinc/91/56/87/1080915687.db2.gz YWUZJTIZVTVYDB-DDRJZQQSSA-N 2 0 356.554 4.178 20 0 FIADRP C[C@H]([NH2+]CCc1cc(F)c(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830574 1080944403 /nfs/dbraw/zinc/94/44/03/1080944403.db2.gz POBKGUAXAYGCOT-YJBOKZPZSA-N 2 0 362.439 4.147 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCc3c2cc(F)cc3F)cc1 ZINC000121263251 1080946843 /nfs/dbraw/zinc/94/68/43/1080946843.db2.gz LQYWAVOOYIJKPM-NRFANRHFSA-N 2 0 360.448 4.072 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(-c2ccnn2C)c1 ZINC001648810961 1081123651 /nfs/dbraw/zinc/12/36/51/1081123651.db2.gz AKXLYAARWDRJOI-WOJBJXKFSA-N 2 0 368.569 4.243 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCCn3ccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000655738884 1081157201 /nfs/dbraw/zinc/15/72/01/1081157201.db2.gz ZAOBNUOOCJXJNY-HXUWFJFHSA-N 2 0 352.526 4.000 20 0 FIADRP Cc1cc(N2CCCC[C@H]2C)ccc1NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655751866 1081170015 /nfs/dbraw/zinc/17/00/15/1081170015.db2.gz KVNJRRMHTIBUAE-NQIIRXRSSA-N 2 0 357.542 4.039 20 0 FIADRP Cc1nn(-c2ccc(C)cc2)cc1CN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000655758098 1081174106 /nfs/dbraw/zinc/17/41/06/1081174106.db2.gz QKGQYRIWJLSBCE-UYAOXDASSA-N 2 0 366.553 4.232 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805896 1081214850 /nfs/dbraw/zinc/21/48/50/1081214850.db2.gz UKZOYIJOQMTMQH-PIPMEXSNSA-N 2 0 356.485 4.048 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+][C@@H]2CCCN3CCCC[C@@H]23)cc1 ZINC000655848505 1081257202 /nfs/dbraw/zinc/25/72/02/1081257202.db2.gz GFYYRULWEBSGFA-WMQCIHAUSA-N 2 0 372.557 4.228 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC000655851244 1081260215 /nfs/dbraw/zinc/26/02/15/1081260215.db2.gz CPDTVCHVGUKXQV-KNQAVFIVSA-N 2 0 356.554 4.163 20 0 FIADRP CC(C)(C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1 ZINC001648832775 1081272074 /nfs/dbraw/zinc/27/20/74/1081272074.db2.gz LUCBEUXMKXZZFB-UHFFFAOYSA-N 2 0 365.565 4.156 20 0 FIADRP CC(C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000683692950 1081392123 /nfs/dbraw/zinc/39/21/23/1081392123.db2.gz YHWZRBVNUUCJJM-LRSLUSHPSA-N 2 0 356.554 4.367 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(OC)cc3c2C1 ZINC000122998499 1081419416 /nfs/dbraw/zinc/41/94/16/1081419416.db2.gz FWELKIOZHBFWNZ-DLBZAZTESA-N 2 0 357.542 4.134 20 0 FIADRP Cn1ccnc1C[C@@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1 ZINC000683772644 1081534172 /nfs/dbraw/zinc/53/41/72/1081534172.db2.gz NVMPEOVUDDCFMT-QGZVFWFLSA-N 2 0 364.474 4.210 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)Sc1ccc(Br)cc1 ZINC000089582482 1081934777 /nfs/dbraw/zinc/93/47/77/1081934777.db2.gz VILQQVNWSVQOFL-FVQBIDKESA-N 2 0 369.372 4.146 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cc(C(=O)OC)cs1 ZINC000580415258 1081939586 /nfs/dbraw/zinc/93/95/86/1081939586.db2.gz PSEABTPRWPFMTN-HNNXBMFYSA-N 2 0 360.523 4.227 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccc5ccccc5n4)C[C@H]3C2)cc1 ZINC000312889947 1081993909 /nfs/dbraw/zinc/99/39/09/1081993909.db2.gz HZIJYRRZICEWCR-FGZHOGPDSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)COCc1ccccc1 ZINC000580587183 1082027875 /nfs/dbraw/zinc/02/78/75/1082027875.db2.gz XDXILIXRXFESQP-UEVCKROQSA-N 2 0 352.522 4.264 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000580713694 1082096039 /nfs/dbraw/zinc/09/60/39/1082096039.db2.gz GAAHQOUXKRZCEZ-HNNXBMFYSA-N 2 0 371.912 4.152 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(CCC[NH+](C)C)CC2)c(C)c1 ZINC000123380412 1082269875 /nfs/dbraw/zinc/26/98/75/1082269875.db2.gz IVDLSTOLPOCHBG-UHFFFAOYSA-N 2 0 373.585 4.384 20 0 FIADRP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[N@H+](CCCC3CCOCC3)C2)cc1 ZINC000656401794 1082333230 /nfs/dbraw/zinc/33/32/30/1082333230.db2.gz JBKMPKFAUYAPGF-ZJZGAYNASA-N 2 0 368.565 4.036 20 0 FIADRP c1ccc(Oc2cc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)ccn2)cc1 ZINC000656475928 1082460903 /nfs/dbraw/zinc/46/09/03/1082460903.db2.gz RDYJSHXZFJIZDX-UHFFFAOYSA-N 2 0 360.461 4.028 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)Oc1ccccc1C(F)(F)F ZINC000090230986 1082690712 /nfs/dbraw/zinc/69/07/12/1082690712.db2.gz VXFXMAJQRIKRGT-ARFHVFGLSA-N 2 0 356.432 4.079 20 0 FIADRP CO[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000684378131 1082793899 /nfs/dbraw/zinc/79/38/99/1082793899.db2.gz ZBNCPVHJRHBYKW-MOPGFXCFSA-N 2 0 350.934 4.099 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccccc2OC(F)F)CC1 ZINC000471764512 1082960988 /nfs/dbraw/zinc/96/09/88/1082960988.db2.gz YHJOXLNJVLOMIF-QFBILLFUSA-N 2 0 366.496 4.463 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000581973058 1083120206 /nfs/dbraw/zinc/12/02/06/1083120206.db2.gz VVVHOVOPPBZOAK-ABPVARSCSA-N 2 0 352.469 4.401 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@@H]3CCCF)CC2)cc1 ZINC000510662906 1083228873 /nfs/dbraw/zinc/22/88/73/1083228873.db2.gz ILCZTTLQFFNEFY-IRLDBZIGSA-N 2 0 362.533 4.415 20 0 FIADRP Cn1cc(C[C@@H]2CCC[C@H]2[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000658236086 1083375878 /nfs/dbraw/zinc/37/58/78/1083375878.db2.gz SYIMPHRUPLXRRE-PZJWPPBQSA-N 2 0 374.617 4.400 20 0 FIADRP C[C@H](CCc1ccc(Br)cc1)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000132527613 1083436472 /nfs/dbraw/zinc/43/64/72/1083436472.db2.gz XXWXOEUGSKVUJS-HUUCEWRRSA-N 2 0 353.348 4.090 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(-c2cnn(C)c2)c1 ZINC000548984372 1084328196 /nfs/dbraw/zinc/32/81/96/1084328196.db2.gz LBNCMPGYIFPILZ-LJQANCHMSA-N 2 0 354.542 4.140 20 0 FIADRP Cn1ncc(C2CC2)c1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000657302275 1084332826 /nfs/dbraw/zinc/33/28/26/1084332826.db2.gz CFBOJRYRYCDUSO-UHFFFAOYSA-N 2 0 374.532 4.316 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000537973231 1084593530 /nfs/dbraw/zinc/59/35/30/1084593530.db2.gz ANVBWTFFZIKJQH-XHSDSOJGSA-N 2 0 358.448 4.245 20 0 FIADRP c1ccc(Oc2ccccc2C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1 ZINC000613440836 1084741290 /nfs/dbraw/zinc/74/12/90/1084741290.db2.gz XLAYWRLHKTYRFY-UHFFFAOYSA-N 2 0 366.505 4.023 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cnn1-c1cccc(Cl)c1 ZINC000414202363 1084799124 /nfs/dbraw/zinc/79/91/24/1084799124.db2.gz ZCDNGXYTROYBRL-RDJZCZTQSA-N 2 0 360.933 4.217 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccc(F)cc3)o2)CC1 ZINC000613491350 1084819348 /nfs/dbraw/zinc/81/93/48/1084819348.db2.gz OVUUDAVSYFILAY-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3sccc3Cl)CC2)CC1 ZINC000549041100 1084884946 /nfs/dbraw/zinc/88/49/46/1084884946.db2.gz WIEQHONOFVVZQY-UHFFFAOYSA-N 2 0 370.006 4.030 20 0 FIADRP CSC1(C[NH2+]Cc2cnc(-c3ccc(C)cc3)s2)CC[NH+](C)CC1 ZINC000582352963 1084899909 /nfs/dbraw/zinc/89/99/09/1084899909.db2.gz HPJKVOISIVMZTL-UHFFFAOYSA-N 2 0 361.580 4.036 20 0 FIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657430779 1085009662 /nfs/dbraw/zinc/00/96/62/1085009662.db2.gz RABNLSMRQXXRIA-AWEZNQCLSA-N 2 0 360.383 4.007 20 0 FIADRP CCc1ccc([C@@H]2CCCCC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000472584594 1085047718 /nfs/dbraw/zinc/04/77/18/1085047718.db2.gz VLJUMWKWDZFUDS-NRFANRHFSA-N 2 0 361.574 4.175 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC(C)(C)c2cccnc2)CC1 ZINC000414334175 1085077163 /nfs/dbraw/zinc/07/71/63/1085077163.db2.gz MZXKZSKLCQMQFW-LJQANCHMSA-N 2 0 351.538 4.044 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(C)CC[NH+](C)C2CCCCC2)cc1)C1CC1 ZINC000511861401 1085186442 /nfs/dbraw/zinc/18/64/42/1085186442.db2.gz BLMMYCFHORLZDJ-UHFFFAOYSA-N 2 0 371.569 4.007 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N(C)CC[NH+](C)C2CCCCC2)cc1 ZINC000511865381 1085208322 /nfs/dbraw/zinc/20/83/22/1085208322.db2.gz OKZWICOVXFHVML-UHFFFAOYSA-N 2 0 373.585 4.255 20 0 FIADRP C[N@@H+](Cc1ccc(F)c2cccnc12)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110187 1085553841 /nfs/dbraw/zinc/55/38/41/1085553841.db2.gz DBNBQKJUWYSTOD-IBGZPJMESA-N 2 0 363.480 4.328 20 0 FIADRP CC[N@H+](CCC[NH2+]C1CCN(C(=O)CC(C)(C)C)CC1)C1CCCCC1 ZINC000651910346 1085632172 /nfs/dbraw/zinc/63/21/72/1085632172.db2.gz QABWLXHNQPFONT-UHFFFAOYSA-N 2 0 365.606 4.048 20 0 FIADRP Clc1oc2ccccc2c1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657612963 1085691572 /nfs/dbraw/zinc/69/15/72/1085691572.db2.gz GZTYQRWYWMXNHM-UHFFFAOYSA-N 2 0 369.896 4.483 20 0 FIADRP C[C@@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(Cl)c1 ZINC000657612678 1085697435 /nfs/dbraw/zinc/69/74/35/1085697435.db2.gz CIGQHTYPODBEEO-KRWDZBQOSA-N 2 0 357.929 4.340 20 0 FIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000657613757 1085700199 /nfs/dbraw/zinc/70/01/99/1085700199.db2.gz QXYMURGGOSPTDM-FQEVSTJZSA-N 2 0 369.940 4.094 20 0 FIADRP CC1(C)C[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2cc(F)ccc2O1 ZINC000651949438 1085707767 /nfs/dbraw/zinc/70/77/67/1085707767.db2.gz LJEVUCCQRLMXNU-LJQANCHMSA-N 2 0 355.457 4.082 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000236874906 1085864237 /nfs/dbraw/zinc/86/42/37/1085864237.db2.gz YEBKHIULEYUOSL-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP CC(C)OC1CCC([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)CC1 ZINC000090771403 1085885478 /nfs/dbraw/zinc/88/54/78/1085885478.db2.gz LTSFGQJNYUHXAY-UHFFFAOYSA-N 2 0 362.533 4.158 20 0 FIADRP CN(CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1)c1ccccc1 ZINC001167646579 1086010580 /nfs/dbraw/zinc/01/05/80/1086010580.db2.gz FKJDLBKNWSNSFQ-LADGPHEKSA-N 2 0 363.549 4.109 20 0 FIADRP C[C@H](CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000249053746 1086182585 /nfs/dbraw/zinc/18/25/85/1086182585.db2.gz YCEMTOUNKUBYPY-ADHNFCLRSA-N 2 0 355.570 4.036 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1cc2c(s1)CC[NH2+]C2 ZINC000662417165 1086432735 /nfs/dbraw/zinc/43/27/35/1086432735.db2.gz NLYAYFCQJQNDHM-UHFFFAOYSA-N 2 0 369.534 4.022 20 0 FIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511989775 1086583417 /nfs/dbraw/zinc/58/34/17/1086583417.db2.gz MEOUPPNUBBRVBC-DQHWKFJXSA-N 2 0 356.460 4.478 20 0 FIADRP CC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000150959970 1086641361 /nfs/dbraw/zinc/64/13/61/1086641361.db2.gz WJAJMCHBMBBUGJ-SFHVURJKSA-N 2 0 358.357 4.060 20 0 FIADRP Fc1ccc([C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2cnc3ccccc3c2)cc1 ZINC000643536989 1086648810 /nfs/dbraw/zinc/64/88/10/1086648810.db2.gz XUDOVRQUSCAYMV-FCHUYYIVSA-N 2 0 361.464 4.195 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167833373 1086665092 /nfs/dbraw/zinc/66/50/92/1086665092.db2.gz AMOSSNKZFOOGFR-MOPGFXCFSA-N 2 0 369.594 4.218 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000236824206 1086702244 /nfs/dbraw/zinc/70/22/44/1086702244.db2.gz YAIFOUYMDDKSED-KRWDZBQOSA-N 2 0 371.912 4.024 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C ZINC001167840007 1086719136 /nfs/dbraw/zinc/71/91/36/1086719136.db2.gz DGITWYTUBMDYIA-GBESFXJTSA-N 2 0 369.594 4.265 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(COc2ccccc2OC)CC1 ZINC001167840360 1086722787 /nfs/dbraw/zinc/72/27/87/1086722787.db2.gz FKGBHIUWWJZKKI-IBGZPJMESA-N 2 0 362.558 4.297 20 0 FIADRP COc1ccc([C@H](CC(C)C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000647294547 1086723983 /nfs/dbraw/zinc/72/39/83/1086723983.db2.gz GNXKAUSKIRJREU-YTFSRNRJSA-N 2 0 374.569 4.140 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CCCO1 ZINC000432427660 1086757830 /nfs/dbraw/zinc/75/78/30/1086757830.db2.gz DEAAFLUMQFXEHA-XXBNENTESA-N 2 0 370.512 4.200 20 0 FIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)cn1 ZINC000512096773 1086763118 /nfs/dbraw/zinc/76/31/18/1086763118.db2.gz AKRNAUYWJYSNQC-OALUTQOASA-N 2 0 351.538 4.412 20 0 FIADRP C[C@H](C[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1)c1ccc(C(F)(F)F)cc1 ZINC000650708783 1086767136 /nfs/dbraw/zinc/76/71/36/1086767136.db2.gz MHIOKPBKNUIRMF-IWKCEXAMSA-N 2 0 370.459 4.027 20 0 FIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncc(F)c1 ZINC000657773403 1086834026 /nfs/dbraw/zinc/83/40/26/1086834026.db2.gz RIDPVZYOPUJODQ-PXNSSMCTSA-N 2 0 353.485 4.174 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657773413 1086834265 /nfs/dbraw/zinc/83/42/65/1086834265.db2.gz RMLHAPMZEVZWDJ-JOCHJYFZSA-N 2 0 366.553 4.164 20 0 FIADRP C[C@H](C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1)c1ccc(C(F)(F)F)cc1 ZINC000650724479 1086837145 /nfs/dbraw/zinc/83/71/45/1086837145.db2.gz HAVLNZVUDXXYLF-UTRMSSBJSA-N 2 0 370.459 4.170 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)c(F)c1 ZINC000650754653 1086962584 /nfs/dbraw/zinc/96/25/84/1086962584.db2.gz NVBHROSSOVBBOQ-OAQYLSRUSA-N 2 0 354.469 4.167 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000650756474 1086968436 /nfs/dbraw/zinc/96/84/36/1086968436.db2.gz BPMXCBQJGFRZJV-IBGZPJMESA-N 2 0 359.311 4.409 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000650758308 1086973415 /nfs/dbraw/zinc/97/34/15/1086973415.db2.gz MZOXXPBAOFQIBY-CQSZACIVSA-N 2 0 352.400 4.198 20 0 FIADRP COc1ccc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(C)c1OC ZINC000583835053 1086985015 /nfs/dbraw/zinc/98/50/15/1086985015.db2.gz MTXYDIVOCRSPMR-UHFFFAOYSA-N 2 0 360.542 4.145 20 0 FIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Br)cn1 ZINC000584028464 1087121507 /nfs/dbraw/zinc/12/15/07/1087121507.db2.gz YGSNXZXLZUNDMF-OAHLLOKOSA-N 2 0 354.336 4.151 20 0 FIADRP COCCCCC[NH+]1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000536205598 1087146358 /nfs/dbraw/zinc/14/63/58/1087146358.db2.gz WLMYCJKFHLKICR-UHFFFAOYSA-N 2 0 372.475 4.418 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2cc1OC ZINC000657839563 1087266523 /nfs/dbraw/zinc/26/65/23/1087266523.db2.gz CEOWKLFVPGAGOZ-BEVDRBHNSA-N 2 0 354.494 4.134 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](c3cccnc3)C(C)C)CC2)cc1 ZINC000091312619 1087427781 /nfs/dbraw/zinc/42/77/81/1087427781.db2.gz UAHUHYGZNRQFAS-QHCPKHFHSA-N 2 0 367.537 4.289 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cc(C)cc(C[NH+](C)C)c2)cc1)C1CC1 ZINC000536215354 1087467930 /nfs/dbraw/zinc/46/79/30/1087467930.db2.gz PVAIGBKJQBXMCN-UHFFFAOYSA-N 2 0 365.521 4.293 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657870369 1087475247 /nfs/dbraw/zinc/47/52/47/1087475247.db2.gz CXHRDNZMRYKDGC-MRXNPFEDSA-N 2 0 369.534 4.130 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1F)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000468384707 1087525599 /nfs/dbraw/zinc/52/55/99/1087525599.db2.gz RSYLRCBNVRMADC-CYBMUJFWSA-N 2 0 369.322 4.126 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccncc3s2)[C@H](C)C1 ZINC000657884435 1087529034 /nfs/dbraw/zinc/52/90/34/1087529034.db2.gz UHSJMKHDBXGXON-NUJGCVRESA-N 2 0 361.555 4.084 20 0 FIADRP CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000685470126 1087578545 /nfs/dbraw/zinc/57/85/45/1087578545.db2.gz ZEYLIQHGSNNQOK-JOCHJYFZSA-N 2 0 353.510 4.139 20 0 FIADRP CC[N@H+](Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@H](C)c1cccnc1 ZINC000685469911 1087578555 /nfs/dbraw/zinc/57/85/55/1087578555.db2.gz NIIOGWZGQLMVGN-LJQANCHMSA-N 2 0 353.510 4.139 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685661499 1087665776 /nfs/dbraw/zinc/66/57/76/1087665776.db2.gz UOPUZMXIEIOQDU-QVGHQYEOSA-N 2 0 364.533 4.407 20 0 FIADRP C[C@H]([NH2+]C[C@]1(C)OCCc2sccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685662042 1087666786 /nfs/dbraw/zinc/66/67/86/1087666786.db2.gz YZFGSYGQLKQZHW-JLMWRMLUSA-N 2 0 370.562 4.036 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)cc2cc1OC ZINC000657993956 1087694399 /nfs/dbraw/zinc/69/43/99/1087694399.db2.gz OOKKNEHKCYTJOR-INIZCTEOSA-N 2 0 368.521 4.382 20 0 FIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066502 1087710005 /nfs/dbraw/zinc/71/00/05/1087710005.db2.gz BEDFWCMKNIJOQO-HNNXBMFYSA-N 2 0 370.990 4.203 20 0 FIADRP CC(C)COc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068673 1087710379 /nfs/dbraw/zinc/71/03/79/1087710379.db2.gz HILQTQWRHKYZCF-IBGZPJMESA-N 2 0 374.569 4.263 20 0 FIADRP Cc1ccc2cc([C@H](C)[NH2+]CC3CC[NH+](C4CCOCC4)CC3)oc2c1 ZINC000658070793 1087710924 /nfs/dbraw/zinc/71/09/24/1087710924.db2.gz QRJGNFOEZDKDIS-KRWDZBQOSA-N 2 0 356.510 4.283 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658070839 1087711084 /nfs/dbraw/zinc/71/10/84/1087711084.db2.gz RUWWWDSOFKOGBW-GOTSBHOMSA-N 2 0 356.554 4.352 20 0 FIADRP CSc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CCOCC3)CC1)CCC2 ZINC000658070509 1087711206 /nfs/dbraw/zinc/71/12/06/1087711206.db2.gz PPYADVVTIWSAHC-JOCHJYFZSA-N 2 0 374.594 4.267 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(Cl)c1 ZINC000658144498 1087736784 /nfs/dbraw/zinc/73/67/84/1087736784.db2.gz MHNLDRQTEAYSBZ-NHCUHLMSSA-N 2 0 358.913 4.148 20 0 FIADRP Cc1cc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)ccc1Oc1cccnc1 ZINC000414772268 1087749306 /nfs/dbraw/zinc/74/93/06/1087749306.db2.gz BOPVSHIKQGYFLG-WOJBJXKFSA-N 2 0 351.494 4.004 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccncc1 ZINC000658162840 1087758100 /nfs/dbraw/zinc/75/81/00/1087758100.db2.gz GOZKPQFRWYMDCL-QFIPXVFZSA-N 2 0 352.526 4.066 20 0 FIADRP CCC[C@@H](Cc1ccccc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165703 1087759455 /nfs/dbraw/zinc/75/94/55/1087759455.db2.gz KOGDTNOYEFABAN-QHCPKHFHSA-N 2 0 351.538 4.295 20 0 FIADRP Cc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658164484 1087759609 /nfs/dbraw/zinc/75/96/09/1087759609.db2.gz DSEXDFWISXSLRH-HXUWFJFHSA-N 2 0 351.538 4.213 20 0 FIADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658166198 1087763169 /nfs/dbraw/zinc/76/31/69/1087763169.db2.gz MYVFEBDZDWJWJE-QHCPKHFHSA-N 2 0 351.538 4.213 20 0 FIADRP C[C@@H](CCc1ccccc1F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165308 1087763324 /nfs/dbraw/zinc/76/33/24/1087763324.db2.gz IJCQZIOFOPWZEV-SFHVURJKSA-N 2 0 355.501 4.044 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658206281 1087794413 /nfs/dbraw/zinc/79/44/13/1087794413.db2.gz IJJUEBKCPZCTPM-HCUBDLJJSA-N 2 0 364.533 4.059 20 0 FIADRP COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000414342934 1087909621 /nfs/dbraw/zinc/90/96/21/1087909621.db2.gz PUYMWSBCMPBUMS-CKLTXHEASA-N 2 0 364.533 4.299 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000414787660 1087986901 /nfs/dbraw/zinc/98/69/01/1087986901.db2.gz VSFQMCXWUGXRRC-NHCUHLMSSA-N 2 0 350.506 4.184 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414808319 1088180321 /nfs/dbraw/zinc/18/03/21/1088180321.db2.gz FCKWSMJRYJLFDF-LSDHHAIUSA-N 2 0 359.901 4.175 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Cl)c(Br)c2)cc1 ZINC000414811670 1088193331 /nfs/dbraw/zinc/19/33/31/1088193331.db2.gz QGLNYFAHENMGSF-LLVKDONJSA-N 2 0 353.691 4.412 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OCC(C)C ZINC000414813837 1088215905 /nfs/dbraw/zinc/21/59/05/1088215905.db2.gz UQNCIQVQIPCZCG-KRWDZBQOSA-N 2 0 356.510 4.430 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@H]2[NH2+]Cc3ccccc32)cc1 ZINC000659285868 1088415337 /nfs/dbraw/zinc/41/53/37/1088415337.db2.gz SMEXWIPTMJZDDG-VGOFRKELSA-N 2 0 363.505 4.234 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3c2cccc3F)C[C@@H](C)O1 ZINC000513867229 1088494477 /nfs/dbraw/zinc/49/44/77/1088494477.db2.gz CZLWHLRIIOQLIO-QZMQVMSPSA-N 2 0 368.496 4.212 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000311479528 1088690424 /nfs/dbraw/zinc/69/04/24/1088690424.db2.gz HIKCDFFXZWUVLC-VGSWGCGISA-N 2 0 356.485 4.397 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)[C@H]2CCC[C@@H]21 ZINC000514095657 1088714294 /nfs/dbraw/zinc/71/42/94/1088714294.db2.gz SFAOXJNFKAJOOO-HWHRFOGPSA-N 3 0 355.570 4.023 20 0 FIADRP COc1ccc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000514106376 1088751776 /nfs/dbraw/zinc/75/17/76/1088751776.db2.gz XXCWKSGCYCIWOP-UHFFFAOYSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2ccccc2s1 ZINC000188286564 1088921358 /nfs/dbraw/zinc/92/13/58/1088921358.db2.gz RPDPKJGSKOKQBH-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)C1 ZINC000415029203 1089058903 /nfs/dbraw/zinc/05/89/03/1089058903.db2.gz DOMJLBCFQQEVLV-JQWIXIFHSA-N 2 0 356.322 4.334 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415045263 1089090201 /nfs/dbraw/zinc/09/02/01/1089090201.db2.gz BHXGZRPZGYRQID-QFBILLFUSA-N 2 0 373.928 4.435 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415046354 1089091365 /nfs/dbraw/zinc/09/13/65/1089091365.db2.gz VACKBGXOHKJGQP-WFASDCNBSA-N 2 0 357.361 4.167 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415046351 1089091770 /nfs/dbraw/zinc/09/17/70/1089091770.db2.gz VACKBGXOHKJGQP-DOMZBBRYSA-N 2 0 357.361 4.167 20 0 FIADRP COc1sc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415057256 1089102385 /nfs/dbraw/zinc/10/23/85/1089102385.db2.gz RONJDIAHSXNFEC-OAHLLOKOSA-N 2 0 369.328 4.089 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)CCN1Cc1ccccc1 ZINC000415062073 1089113674 /nfs/dbraw/zinc/11/36/74/1089113674.db2.gz ZNXKLBFGBYEXTJ-PTUXOGIPSA-N 2 0 351.538 4.109 20 0 FIADRP c1ccc(-c2ccccc2OCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000415079094 1089134055 /nfs/dbraw/zinc/13/40/55/1089134055.db2.gz HFUKDONYDNWVRZ-BHDDXSALSA-N 2 0 350.506 4.243 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000415083142 1089140002 /nfs/dbraw/zinc/14/00/02/1089140002.db2.gz MZCTZVFJFWZNLJ-AEFFLSMTSA-N 2 0 358.555 4.038 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C)C[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000415113008 1089173486 /nfs/dbraw/zinc/17/34/86/1089173486.db2.gz SECQYNBGRKEYIH-ZQIUZPCESA-N 2 0 359.539 4.308 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000415120968 1089182866 /nfs/dbraw/zinc/18/28/66/1089182866.db2.gz GWZRKDRRTQUJEA-PZJWPPBQSA-N 2 0 374.525 4.273 20 0 FIADRP Cc1cc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c2cc(OC(F)F)ccc2[nH+]1 ZINC000549192962 1089184813 /nfs/dbraw/zinc/18/48/13/1089184813.db2.gz OOFBYRVOPCBCHC-FQEVSTJZSA-N 2 0 361.436 4.067 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CC2)c1 ZINC000415121681 1089185416 /nfs/dbraw/zinc/18/54/16/1089185416.db2.gz ZEOYVVFPGXQXSM-OKZBNKHCSA-N 2 0 352.444 4.247 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000415130369 1089195852 /nfs/dbraw/zinc/19/58/52/1089195852.db2.gz QSEPIWWVGYYSDW-FPOVZHCZSA-N 2 0 374.525 4.273 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc3c2OCC[C@H]3[NH+](C)C)C1 ZINC000435041292 1089218117 /nfs/dbraw/zinc/21/81/17/1089218117.db2.gz IPQWDEMQFGRQMK-ZWCUEREDSA-N 2 0 365.521 4.319 20 0 FIADRP C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccnn1C ZINC000549235817 1089314629 /nfs/dbraw/zinc/31/46/29/1089314629.db2.gz OSSBBAZTZNPMJD-FQCOAQKJSA-N 2 0 372.944 4.338 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC000514888116 1089576294 /nfs/dbraw/zinc/57/62/94/1089576294.db2.gz RPPQZTBONAGBCS-UHFFFAOYSA-N 2 0 373.928 4.101 20 0 FIADRP COc1cc(Cl)c(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000514971769 1089696809 /nfs/dbraw/zinc/69/68/09/1089696809.db2.gz DLVSQUMSACXGJA-CQSZACIVSA-N 2 0 357.325 4.166 20 0 FIADRP C[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311980290 1089727449 /nfs/dbraw/zinc/72/74/49/1089727449.db2.gz MQDDGMXLLGFDIG-FDDCHVKYSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)CCO2 ZINC000311980297 1089735970 /nfs/dbraw/zinc/73/59/70/1089735970.db2.gz MQDDGMXLLGFDIG-WZONZLPQSA-N 2 0 350.506 4.184 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cn1 ZINC000435775878 1089930420 /nfs/dbraw/zinc/93/04/20/1089930420.db2.gz AMRVFMCBMYWULT-UHFFFAOYSA-N 2 0 360.505 4.201 20 0 FIADRP CC[NH2+]Cc1cccc(NC(=O)N2CCC(CCC[NH+](CC)CC)CC2)c1 ZINC000415918849 1090000199 /nfs/dbraw/zinc/00/01/99/1090000199.db2.gz LYWPXWBENLRKQZ-UHFFFAOYSA-N 2 0 374.573 4.162 20 0 FIADRP CC[NH+](CC)[C@H](CNC(=O)Nc1ccc(C[NH3+])cc1)c1ccccc1Cl ZINC000415964918 1090041341 /nfs/dbraw/zinc/04/13/41/1090041341.db2.gz WZHQTNNDHLDUSQ-LJQANCHMSA-N 2 0 374.916 4.003 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc(COC2CC[NH2+]CC2)cc1 ZINC001167732755 1090249132 /nfs/dbraw/zinc/24/91/32/1090249132.db2.gz FGAAJKZTIQDRJY-UHFFFAOYSA-N 2 0 361.574 4.269 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc([C@@]23CC[NH2+][C@H]2COCC3)cc1 ZINC001167733393 1090255714 /nfs/dbraw/zinc/25/57/14/1090255714.db2.gz SNABOYHSMXNNNV-GOTSBHOMSA-N 2 0 373.585 4.021 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(NC(C)=O)cc1 ZINC000181924347 1090317550 /nfs/dbraw/zinc/31/75/50/1090317550.db2.gz SRYPAKBBTMUHRT-KRWDZBQOSA-N 2 0 353.510 4.338 20 0 FIADRP COc1ccc(-c2nc(C[NH2+]C3CCC(C)([NH+](C)C)CC3)cs2)cc1 ZINC001203414980 1090322635 /nfs/dbraw/zinc/32/26/35/1090322635.db2.gz NLQCIOBXVOYSLU-UHFFFAOYSA-N 2 0 359.539 4.171 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H](O)c2ccccc2F)ccc1OC ZINC000182536885 1090359275 /nfs/dbraw/zinc/35/92/75/1090359275.db2.gz YTOVHCOMRKNPDW-KKSFZXQISA-N 2 0 374.500 4.060 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCCCSC)cc1C[NH+]1CCCCC1 ZINC000182994567 1090385088 /nfs/dbraw/zinc/38/50/88/1090385088.db2.gz UYNOECYNMAMJOO-QGZVFWFLSA-N 2 0 350.572 4.475 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC(C)(C)C[C@H](C)O)cc1C[NH+]1CCCCC1 ZINC000183301029 1090403261 /nfs/dbraw/zinc/40/32/61/1090403261.db2.gz NJPVCSXWOHGGII-ZWKOTPCHSA-N 2 0 362.558 4.129 20 0 FIADRP CC(C)[NH+]1CCC(N2CC[NH+](C[C@@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000660107893 1090552600 /nfs/dbraw/zinc/55/26/00/1090552600.db2.gz RZIKQCAVLVFODD-FYYLOGMGSA-N 2 0 369.597 4.061 20 0 FIADRP CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000500086767 1091029417 /nfs/dbraw/zinc/02/94/17/1091029417.db2.gz DQTKVMDTCRIDQP-CTNGQTDRSA-N 2 0 361.574 4.031 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2c(F)ccc(O)c2F)C[N@@H+]1Cc1ccccc1 ZINC000511778323 1091668297 /nfs/dbraw/zinc/66/82/97/1091668297.db2.gz ZIZDGZGORDPEGW-WBVHZDCISA-N 2 0 360.448 4.061 20 0 FIADRP Clc1ccc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000320277324 1092175185 /nfs/dbraw/zinc/17/51/85/1092175185.db2.gz GLRDKUBIOQDOFJ-UHFFFAOYSA-N 2 0 350.293 4.190 20 0 FIADRP CC1CC[NH+](CCCNC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168011801 1092228925 /nfs/dbraw/zinc/22/89/25/1092228925.db2.gz SOLNAINOZJSUCL-SFTDATJTSA-N 2 0 357.586 4.140 20 0 FIADRP COc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(Cl)c1OC ZINC000500564078 1092232418 /nfs/dbraw/zinc/23/24/18/1092232418.db2.gz YVZFTFVVJJYUSY-IYBDPMFKSA-N 2 0 368.949 4.205 20 0 FIADRP CCC[NH+]1CCC(N[C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428233110 1092272948 /nfs/dbraw/zinc/27/29/48/1092272948.db2.gz XUCPJZLBVDKYIN-GMKZXUHWSA-N 2 0 369.597 4.141 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccoc1 ZINC000428229870 1092283330 /nfs/dbraw/zinc/28/33/30/1092283330.db2.gz XXNUTJMKJHHJQM-JOCHJYFZSA-N 2 0 356.510 4.379 20 0 FIADRP C[C@@H]1CC([NH2+]CCOc2ccccc2F)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012041 1092331915 /nfs/dbraw/zinc/33/19/15/1092331915.db2.gz VEEQKGGUFFDLGM-QZTJIDSGSA-N 2 0 356.485 4.236 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(Br)cc2F)C1 ZINC000520949870 1092375220 /nfs/dbraw/zinc/37/52/20/1092375220.db2.gz UGAFKSHMMVTFBB-AWEZNQCLSA-N 2 0 357.311 4.190 20 0 FIADRP Clc1oc2ccccc2c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000512457539 1092397766 /nfs/dbraw/zinc/39/77/66/1092397766.db2.gz UEPAIZDYKAPPGR-UHFFFAOYSA-N 2 0 362.901 4.021 20 0 FIADRP [NH3+][C@@H]1C[C@H](NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c2ccccc21 ZINC000665277184 1092504722 /nfs/dbraw/zinc/50/47/22/1092504722.db2.gz WEYUNZGNTFYORR-PTUXOGIPSA-N 2 0 361.533 4.023 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCC2 ZINC000447565081 1092662845 /nfs/dbraw/zinc/66/28/45/1092662845.db2.gz IPLGFFIKKODLMG-LJQANCHMSA-N 2 0 363.343 4.291 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(-c2noc([C@@H]3C[C@H]4CCCC[C@H]4[NH2+]3)n2)c1 ZINC000442756193 1092756346 /nfs/dbraw/zinc/75/63/46/1092756346.db2.gz YVHTZGDZQIDNFS-RLLQIKCJSA-N 2 0 366.509 4.316 20 0 FIADRP FC(F)C1CCC([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000442786118 1092761314 /nfs/dbraw/zinc/76/13/14/1092761314.db2.gz VAGWOPCBJHKJQG-UHFFFAOYSA-N 2 0 352.469 4.075 20 0 FIADRP c1cc2cc(CC[NH2+][C@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)ccc2[nH]1 ZINC000442820262 1092789371 /nfs/dbraw/zinc/78/93/71/1092789371.db2.gz KFBODLBSQYMZQM-ZDXQCDESSA-N 2 0 359.517 4.211 20 0 FIADRP COCCC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(F)cc1 ZINC000442871569 1092820045 /nfs/dbraw/zinc/82/00/45/1092820045.db2.gz LYWVWDPOGFOEFT-NQIIRXRSSA-N 2 0 350.522 4.251 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CC(C)(C)c3cc(OC)ccc32)[C@@H](C)C1 ZINC000474039332 1092841356 /nfs/dbraw/zinc/84/13/56/1092841356.db2.gz SUHTWKDLPUXYCF-HSQYWUDLSA-N 2 0 374.569 4.144 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000521817455 1092935964 /nfs/dbraw/zinc/93/59/64/1092935964.db2.gz BVINXIUYOIMVBE-QZTJIDSGSA-N 2 0 362.521 4.331 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000512614122 1092993000 /nfs/dbraw/zinc/99/30/00/1092993000.db2.gz UXGIGPGNHMPXGI-PWRODBHTSA-N 2 0 369.578 4.193 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000474042930 1093037828 /nfs/dbraw/zinc/03/78/28/1093037828.db2.gz FJEJFZDGEYSNBS-DNVJHFABSA-N 2 0 356.554 4.357 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653311 1093079562 /nfs/dbraw/zinc/07/95/62/1093079562.db2.gz DOQNHDSYJJHESN-GNADVCDUSA-N 2 0 370.581 4.208 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000191211459 1093116405 /nfs/dbraw/zinc/11/64/05/1093116405.db2.gz YOLVRZIDISFKOM-NRFANRHFSA-N 2 0 357.567 4.127 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2c(Br)ccc3ccccc32)CC1 ZINC001141717833 1093157271 /nfs/dbraw/zinc/15/72/71/1093157271.db2.gz AARJCDXQOZQVDS-UHFFFAOYSA-N 2 0 361.327 4.376 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCC34CCCC4)CC2)cc1 ZINC000474054915 1093160484 /nfs/dbraw/zinc/16/04/84/1093160484.db2.gz IVAZSEPLYZXIHS-JOCHJYFZSA-N 2 0 356.554 4.370 20 0 FIADRP Cc1cccc2nc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)cn21 ZINC000433054797 1093166675 /nfs/dbraw/zinc/16/66/75/1093166675.db2.gz VZSVDMSLADNXCR-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)cc1 ZINC000474060938 1093168057 /nfs/dbraw/zinc/16/80/57/1093168057.db2.gz SKSIIRDIKCEQST-ACIOBRDBSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000433091041 1093227796 /nfs/dbraw/zinc/22/77/96/1093227796.db2.gz MTPKFBMWMZWHJD-CYBMUJFWSA-N 2 0 368.855 4.409 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC3(CO)CC(c4ccccc4)C3)CC2)C1 ZINC000433094078 1093241077 /nfs/dbraw/zinc/24/10/77/1093241077.db2.gz TXUPQOAJYVMKOG-VCERZCPPSA-N 2 0 370.581 4.175 20 0 FIADRP CCOC(=O)CCCCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168021512 1093241244 /nfs/dbraw/zinc/24/12/44/1093241244.db2.gz PFQULMFBUMJQAZ-OALUTQOASA-N 2 0 360.542 4.141 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000113336324 1093282621 /nfs/dbraw/zinc/28/26/21/1093282621.db2.gz RHQPLGGENBQNSQ-UHFFFAOYSA-N 2 0 369.456 4.260 20 0 FIADRP Cc1cc(C2CC[NH+](Cc3cccc(C[NH+]4CCCCC4)c3)CC2)[nH]n1 ZINC000411440436 1093310285 /nfs/dbraw/zinc/31/02/85/1093310285.db2.gz HLOZOKNEHONXTB-UHFFFAOYSA-N 2 0 352.526 4.084 20 0 FIADRP C[C@H](c1nc(-c2ccccc2)no1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443601333 1093317675 /nfs/dbraw/zinc/31/76/75/1093317675.db2.gz NORTVOUXXCVSSI-GOSISDBHSA-N 2 0 368.525 4.386 20 0 FIADRP Cc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1C ZINC000443609081 1093324679 /nfs/dbraw/zinc/32/46/79/1093324679.db2.gz UMRLWTAMMNBBFI-HXUWFJFHSA-N 2 0 371.569 4.218 20 0 FIADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC000648416172 1093341443 /nfs/dbraw/zinc/34/14/43/1093341443.db2.gz ZAPAOMSNCMALDR-VXKWHMMOSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000389082512 1093347849 /nfs/dbraw/zinc/34/78/49/1093347849.db2.gz DMSRXISUTXJOCV-KNQAVFIVSA-N 2 0 352.522 4.215 20 0 FIADRP C[C@@H]1CC(N[C@@H]2COc3ccc(F)cc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023365 1093355854 /nfs/dbraw/zinc/35/58/54/1093355854.db2.gz VTZOWBMSYLXUOO-WHSLLNHNSA-N 2 0 354.469 4.290 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1)c1ccccc1 ZINC000474149743 1093466079 /nfs/dbraw/zinc/46/60/79/1093466079.db2.gz JREQVDQYHCEHOT-AOHZBQACSA-N 2 0 371.613 4.307 20 0 FIADRP Cc1ccc(NC(=O)[C@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc2)cc1 ZINC000419300262 1093503830 /nfs/dbraw/zinc/50/38/30/1093503830.db2.gz LQMBSGBJVIYHPY-JOCHJYFZSA-N 2 0 365.521 4.139 20 0 FIADRP C[C@H](COc1ccccc1)[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168026946 1093507363 /nfs/dbraw/zinc/50/73/63/1093507363.db2.gz MMIFLQIAURYSOH-AABGKKOBSA-N 2 0 352.522 4.485 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4cc[nH]n4)o3)cc2)C1 ZINC000433314821 1093570263 /nfs/dbraw/zinc/57/02/63/1093570263.db2.gz BWGAIHWYDLTGLJ-QGZVFWFLSA-N 2 0 364.493 4.191 20 0 FIADRP C[C@@H]1CC(NCc2cncnc2C(C)(C)F)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168030466 1093580358 /nfs/dbraw/zinc/58/03/58/1093580358.db2.gz VWPYPZRPPYEAMO-IAGOWNOFSA-N 2 0 370.516 4.212 20 0 FIADRP CC(C)Sc1cccc(Cl)c1C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000474278151 1093647729 /nfs/dbraw/zinc/64/77/29/1093647729.db2.gz OKLHDYYJRQSLAE-UHFFFAOYSA-N 2 0 370.990 4.383 20 0 FIADRP C[C@H]1CC([NH2+]C(C)(C)Cc2ccncc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031739 1093654952 /nfs/dbraw/zinc/65/49/52/1093654952.db2.gz DSOXRJBOHYDKNL-OALUTQOASA-N 2 0 351.538 4.434 20 0 FIADRP C[C@H]1CC([NH2+]CC(C)(C)C(=O)OC(C)(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168034196 1093742148 /nfs/dbraw/zinc/74/21/48/1093742148.db2.gz OMMNQCSQNOHQOV-ROUUACIJSA-N 2 0 374.569 4.386 20 0 FIADRP CCOC(=O)[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168034640 1093759984 /nfs/dbraw/zinc/75/99/84/1093759984.db2.gz QHZIRVNGORJXNB-XRYRHKQGSA-N 2 0 372.553 4.140 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1F ZINC000513080903 1093782485 /nfs/dbraw/zinc/78/24/85/1093782485.db2.gz GNDZLEVDRDSSFH-YLJYHZDGSA-N 2 0 356.485 4.020 20 0 FIADRP CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C1 ZINC000474469304 1093806759 /nfs/dbraw/zinc/80/67/59/1093806759.db2.gz CFKAJFIALSXAPM-FGZHOGPDSA-N 2 0 358.570 4.338 20 0 FIADRP COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)[C@H]1C ZINC000474466928 1093813113 /nfs/dbraw/zinc/81/31/13/1093813113.db2.gz BKXVWPBLHUPFNT-OZIGNCPNSA-N 2 0 372.553 4.128 20 0 FIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC(F)F ZINC000513365677 1094082585 /nfs/dbraw/zinc/08/25/85/1094082585.db2.gz RRCGKMQESSSOFY-ZBFHGGJFSA-N 2 0 368.468 4.039 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(Br)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000513407688 1094105552 /nfs/dbraw/zinc/10/55/52/1094105552.db2.gz HFWFWQWIHNUXPR-GDBMZVCRSA-N 2 0 351.332 4.192 20 0 FIADRP Cc1cccn2c(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cnc12 ZINC000513494989 1094162326 /nfs/dbraw/zinc/16/23/26/1094162326.db2.gz LCXVTFDYKCMLMS-CTNGQTDRSA-N 2 0 362.521 4.033 20 0 FIADRP COCc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513498947 1094171417 /nfs/dbraw/zinc/17/14/17/1094171417.db2.gz CTWRQCDPIKBCIH-WMZHIEFXSA-N 2 0 352.522 4.223 20 0 FIADRP COCc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513498946 1094171903 /nfs/dbraw/zinc/17/19/03/1094171903.db2.gz CTWRQCDPIKBCIH-CVDCTZTESA-N 2 0 352.522 4.223 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000513545951 1094206452 /nfs/dbraw/zinc/20/64/52/1094206452.db2.gz UIFPMNYCMGPIBR-MMCLUGKTSA-N 2 0 362.945 4.101 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000513667394 1094262948 /nfs/dbraw/zinc/26/29/48/1094262948.db2.gz RGQUCOJHSLSMDZ-SJSRKZJXSA-N 2 0 370.581 4.470 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000513667391 1094263157 /nfs/dbraw/zinc/26/31/57/1094263157.db2.gz RGQUCOJHSLSMDZ-LSDVVMKASA-N 2 0 370.581 4.470 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000513667392 1094263312 /nfs/dbraw/zinc/26/33/12/1094263312.db2.gz RGQUCOJHSLSMDZ-QOXFPCGXSA-N 2 0 370.581 4.470 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)c(OC(F)F)c1 ZINC000513698100 1094360913 /nfs/dbraw/zinc/36/09/13/1094360913.db2.gz WMFWQPFZIYRRRB-KZNAEPCWSA-N 2 0 368.468 4.039 20 0 FIADRP CC(C)c1noc(CCC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)n1 ZINC000513696882 1094363175 /nfs/dbraw/zinc/36/31/75/1094363175.db2.gz FUHYPOZNEYSIMB-UHFFFAOYSA-N 2 0 370.541 4.158 20 0 FIADRP CC(C)c1ccc([C@@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000500992778 1094408848 /nfs/dbraw/zinc/40/88/48/1094408848.db2.gz PKUWLVHVORXHED-QHCPKHFHSA-N 2 0 357.586 4.363 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000501006087 1094417108 /nfs/dbraw/zinc/41/71/08/1094417108.db2.gz FJOVEDQTCDCDMJ-JOCHJYFZSA-N 2 0 361.549 4.063 20 0 FIADRP CC(C)CC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000501038762 1094464909 /nfs/dbraw/zinc/46/49/09/1094464909.db2.gz SQYUSBVZXHHXDX-FQEVSTJZSA-N 2 0 351.966 4.044 20 0 FIADRP C[N@@H+](Cc1cc(F)cc2cccnc21)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501060370 1094471906 /nfs/dbraw/zinc/47/19/06/1094471906.db2.gz AYNTVWJNFUKYTR-UHFFFAOYSA-N 2 0 364.468 4.117 20 0 FIADRP C[C@@H]1CC([NH2+]CC2(C(=O)OC(C)(C)C)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040478 1094513438 /nfs/dbraw/zinc/51/34/38/1094513438.db2.gz NHNQEXXWRYRELC-QZTJIDSGSA-N 2 0 372.553 4.140 20 0 FIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000474794427 1094609891 /nfs/dbraw/zinc/60/98/91/1094609891.db2.gz JIKBLEAYDUYNTJ-UHFFFAOYSA-N 2 0 370.990 4.165 20 0 FIADRP CC(C)C[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1 ZINC000474797809 1094613126 /nfs/dbraw/zinc/61/31/26/1094613126.db2.gz ABALIQAGEVXYGA-PUHATCMVSA-N 2 0 358.570 4.174 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1OC ZINC000474793554 1094630811 /nfs/dbraw/zinc/63/08/11/1094630811.db2.gz DWCVPUAYNLHXEP-IRXDYDNUSA-N 2 0 360.542 4.192 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](F)C(F)(F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041851 1094634216 /nfs/dbraw/zinc/63/42/16/1094634216.db2.gz WMYXXUDTHZCIJV-GPMSIDNRSA-N 2 0 354.460 4.497 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000474811464 1094635362 /nfs/dbraw/zinc/63/53/62/1094635362.db2.gz ROVAOZNXIRUJQA-TWKWOARYSA-N 2 0 370.459 4.103 20 0 FIADRP C[C@H]1CC(N2CC[NH+](C3CCCCC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042049 1094669013 /nfs/dbraw/zinc/66/90/13/1094669013.db2.gz YHAHYUCOZFHHQK-SFTDATJTSA-N 2 0 369.597 4.378 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000017313537 1094706784 /nfs/dbraw/zinc/70/67/84/1094706784.db2.gz MJSIDWKWHQWFBN-UHFFFAOYSA-N 2 0 360.505 4.113 20 0 FIADRP Clc1ccccc1-c1csc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)n1 ZINC000420325577 1094889595 /nfs/dbraw/zinc/88/95/95/1094889595.db2.gz IVQSLXDWZDTNJP-CABCVRRESA-N 2 0 361.942 4.285 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420379812 1094905406 /nfs/dbraw/zinc/90/54/06/1094905406.db2.gz NPRJBIZRWRHIIU-OCBCSQNSSA-N 2 0 357.325 4.273 20 0 FIADRP Cc1cc(C)n(-c2ccc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cc2)n1 ZINC000501773011 1094914446 /nfs/dbraw/zinc/91/44/46/1094914446.db2.gz YSNWPBCJYVPTHY-UHFFFAOYSA-N 2 0 354.542 4.043 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)[C@H](C)[C@H]([NH3+])c3ccccc3)c2C1 ZINC000166934824 1095012798 /nfs/dbraw/zinc/01/27/98/1095012798.db2.gz CVNRQIWVVXFVMA-VGSWGCGISA-N 2 0 365.521 4.323 20 0 FIADRP COC[C@@]12CCC[C@@H]1C[N@@H+](C1C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001168046225 1095112272 /nfs/dbraw/zinc/11/22/72/1095112272.db2.gz MSVARUMGOWVZHR-ZNTQHIFFSA-N 2 0 356.554 4.177 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)C1 ZINC000502278022 1095295788 /nfs/dbraw/zinc/29/57/88/1095295788.db2.gz SSTOXVIQWUTIBB-SIKLNZKXSA-N 2 0 356.554 4.357 20 0 FIADRP CCCOc1ccc(Br)cc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000513741469 1095331825 /nfs/dbraw/zinc/33/18/25/1095331825.db2.gz NRDDGCQBFHHWBQ-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000421327374 1095525021 /nfs/dbraw/zinc/52/50/21/1095525021.db2.gz JGAODHWMMRPDRT-UHFFFAOYSA-N 2 0 366.553 4.439 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]C[C@@H]4CC45CCSCC5)[C@@H]3C2)cc1 ZINC000421384111 1095586975 /nfs/dbraw/zinc/58/69/75/1095586975.db2.gz OWHBYWHNGQTVFA-BURNTYAHSA-N 2 0 356.579 4.020 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051055 1095771523 /nfs/dbraw/zinc/77/15/23/1095771523.db2.gz FRJBCFMRNTWGPJ-QWFCFKBJSA-N 2 0 372.553 4.092 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421829271 1095941044 /nfs/dbraw/zinc/94/10/44/1095941044.db2.gz HIDLVAVPGSBLND-OAQYLSRUSA-N 2 0 360.448 4.276 20 0 FIADRP COc1cc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc(OC)c1 ZINC000513760798 1095968441 /nfs/dbraw/zinc/96/84/41/1095968441.db2.gz LACIEBLKFGWCTG-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000421887516 1095976662 /nfs/dbraw/zinc/97/66/62/1095976662.db2.gz VYSLELCLUGDJFI-XVAXZDLZSA-N 2 0 357.929 4.481 20 0 FIADRP COCC[C@@H](c1ccccc1)[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503428740 1096395752 /nfs/dbraw/zinc/39/57/52/1096395752.db2.gz HWXRJOBXUYDVNE-FPOVZHCZSA-N 2 0 353.510 4.177 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422735381 1096466548 /nfs/dbraw/zinc/46/65/48/1096466548.db2.gz UPBVDRAGUMNLTP-KXBFYZLASA-N 2 0 370.368 4.065 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCCSc1ccccc1Br ZINC000422759089 1096474803 /nfs/dbraw/zinc/47/48/03/1096474803.db2.gz OVAJGZATPZWIQC-ZFWWWQNUSA-N 2 0 357.361 4.038 20 0 FIADRP COc1cccc(-c2ccc(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)cc2)c1 ZINC000422793838 1096492138 /nfs/dbraw/zinc/49/21/38/1096492138.db2.gz SYINHLWZNGEVCO-MRXNPFEDSA-N 2 0 361.489 4.375 20 0 FIADRP FC(F)(F)COCc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422805126 1096495160 /nfs/dbraw/zinc/49/51/60/1096495160.db2.gz GIGGAULDEYSCEZ-CEXWTWQISA-N 2 0 370.459 4.166 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@H](Cc2ccccc2)[C@H](C)[NH3+])cc1 ZINC000422811063 1096497441 /nfs/dbraw/zinc/49/74/41/1096497441.db2.gz TVCCZBYVVBXRFI-MKWLTTDUSA-N 2 0 352.522 4.011 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422789658 1096498052 /nfs/dbraw/zinc/49/80/52/1096498052.db2.gz OSNIGGZHYWPMTB-GOEBONIOSA-N 2 0 365.399 4.110 20 0 FIADRP Cc1cc(Br)cc(C)c1C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422823156 1096499635 /nfs/dbraw/zinc/49/96/35/1096499635.db2.gz LIDNIUISEDWJFS-CYBMUJFWSA-N 2 0 362.315 4.079 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000422830015 1096500884 /nfs/dbraw/zinc/50/08/84/1096500884.db2.gz QMLLAJQLUXZKOP-SFHVURJKSA-N 3 0 366.553 4.076 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422837274 1096502941 /nfs/dbraw/zinc/50/29/41/1096502941.db2.gz LTHQNIJTJFIRCT-RPRCKKEOSA-N 2 0 366.480 4.295 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cn2)c1 ZINC000422848833 1096504948 /nfs/dbraw/zinc/50/49/48/1096504948.db2.gz UIVHHFZYXRNXSJ-QHAWAJNXSA-N 2 0 369.484 4.413 20 0 FIADRP COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)c(C)c2c1 ZINC000422855007 1096506112 /nfs/dbraw/zinc/50/61/12/1096506112.db2.gz BRVHELWRBWOSQM-ZFWWWQNUSA-N 2 0 353.466 4.324 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@@H](Cc2ccccc2)[C@H](C)[NH3+])C1 ZINC000422878249 1096509925 /nfs/dbraw/zinc/50/99/25/1096509925.db2.gz JVBNQGNJZOOVCT-DSKINZAPSA-N 2 0 371.956 4.023 20 0 FIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422879455 1096510866 /nfs/dbraw/zinc/51/08/66/1096510866.db2.gz KNIWLESRRUCGLG-AMHTUMDSSA-N 2 0 366.505 4.380 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000422884257 1096511885 /nfs/dbraw/zinc/51/18/85/1096511885.db2.gz WPYNXNRTNRDHQM-LRDDRELGSA-N 2 0 367.946 4.176 20 0 FIADRP Cc1c2cc(F)ccc2oc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422897790 1096518216 /nfs/dbraw/zinc/51/82/16/1096518216.db2.gz CVHSUWPUTMVOFH-GCJKJVERSA-N 2 0 366.436 4.226 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422901573 1096519137 /nfs/dbraw/zinc/51/91/37/1096519137.db2.gz SEMHKQSDNXMMPU-NJDAHSKKSA-N 2 0 369.484 4.413 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)c1 ZINC000422898425 1096519391 /nfs/dbraw/zinc/51/93/91/1096519391.db2.gz FEMQGSFKDGCCIY-JWTNVVGKSA-N 2 0 352.444 4.390 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)CCCC[NH3+])CCC3)cc1 ZINC000422912911 1096522858 /nfs/dbraw/zinc/52/28/58/1096522858.db2.gz XIQUZKCRVIAFFP-RHSMWYFYSA-N 2 0 359.539 4.303 20 0 FIADRP CC(C)COc1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422894690 1096524742 /nfs/dbraw/zinc/52/47/42/1096524742.db2.gz CVUDGQQNIBORIU-JTHBVZDNSA-N 2 0 366.505 4.067 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCCCN1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414703560 1096525125 /nfs/dbraw/zinc/52/51/25/1096525125.db2.gz CKYXUSSDKBLLED-LAUBAEHRSA-N 2 0 372.557 4.185 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+]C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000422937181 1096529537 /nfs/dbraw/zinc/52/95/37/1096529537.db2.gz NSZQAIXJQSNJHG-GOSISDBHSA-N 2 0 367.320 4.426 20 0 FIADRP CC[C@H](C)C(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422945759 1096535458 /nfs/dbraw/zinc/53/54/58/1096535458.db2.gz NTZAARMZJUWGAE-NASSWSRMSA-N 2 0 357.542 4.072 20 0 FIADRP CC(C)(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422945130 1096535779 /nfs/dbraw/zinc/53/57/79/1096535779.db2.gz MOSZHARRPGHZQR-FDFHNCONSA-N 2 0 370.581 4.153 20 0 FIADRP Clc1cccc(C2([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000422948580 1096536504 /nfs/dbraw/zinc/53/65/04/1096536504.db2.gz SNORQNICOFHRJP-ICSRJNTNSA-N 2 0 354.881 4.175 20 0 FIADRP c1sc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)nc1-c1ccncc1 ZINC000422956888 1096539111 /nfs/dbraw/zinc/53/91/11/1096539111.db2.gz RHGWZVGQSAHWJU-GUDVDZBRSA-N 2 0 370.566 4.038 20 0 FIADRP Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422993768 1096542895 /nfs/dbraw/zinc/54/28/95/1096542895.db2.gz GDYXQTIXXUMNKC-VOQZNFBZSA-N 2 0 353.510 4.198 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NC[C@@H]1CCC[C@H]([NH3+])C1)C1CCCCC1 ZINC000414710536 1096545602 /nfs/dbraw/zinc/54/56/02/1096545602.db2.gz LIYDLFVWBOQGGC-MJGOQNOKSA-N 2 0 372.557 4.090 20 0 FIADRP c1ccc(Sc2ccc(C[NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000423001718 1096547038 /nfs/dbraw/zinc/54/70/38/1096547038.db2.gz XNXMKDUORYIMNP-FDFHNCONSA-N 2 0 368.546 4.085 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423014922 1096549996 /nfs/dbraw/zinc/54/99/96/1096549996.db2.gz QEKSVDYGXWRMDJ-NWDGAFQWSA-N 2 0 352.309 4.437 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)Cc1c(Cl)cccc1Cl ZINC000423014921 1096550250 /nfs/dbraw/zinc/55/02/50/1096550250.db2.gz QEKSVDYGXWRMDJ-NEPJUHHUSA-N 2 0 352.309 4.437 20 0 FIADRP CCCC[C@H](C[NH3+])NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414712178 1096552513 /nfs/dbraw/zinc/55/25/13/1096552513.db2.gz NGWQYDGSHXVBRO-GOSISDBHSA-N 2 0 360.546 4.090 20 0 FIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)OC(C)C ZINC000423047330 1096552669 /nfs/dbraw/zinc/55/26/69/1096552669.db2.gz GCYXKLXWKZRVBT-KMQSCTNJSA-N 2 0 360.542 4.062 20 0 FIADRP Cc1ccccc1O[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422996185 1096553237 /nfs/dbraw/zinc/55/32/37/1096553237.db2.gz LFCSECNWNIJUSM-PIPMEXSNSA-N 2 0 353.510 4.198 20 0 FIADRP Fc1ccc(C2(N[C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)c(F)c1 ZINC000423028195 1096554420 /nfs/dbraw/zinc/55/44/20/1096554420.db2.gz QJUARVSKATVBAF-FPOVZHCZSA-N 2 0 370.443 4.190 20 0 FIADRP Fc1cc(Br)cc([C@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000423065927 1096561776 /nfs/dbraw/zinc/56/17/76/1096561776.db2.gz VQDWYVPNMBLMEH-WFFDWFOESA-N 2 0 367.306 4.302 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000423067340 1096562003 /nfs/dbraw/zinc/56/20/03/1096562003.db2.gz ZBKMXSLROZGUFB-CQSZACIVSA-N 2 0 359.464 4.290 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000414715543 1096564060 /nfs/dbraw/zinc/56/40/60/1096564060.db2.gz RBHQEPCWBPVIQR-ZWKOTPCHSA-N 2 0 372.557 4.042 20 0 FIADRP C[C@@H](CCCC[NH3+])NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414715605 1096564081 /nfs/dbraw/zinc/56/40/81/1096564081.db2.gz REZRSDHMZWEPOT-KRWDZBQOSA-N 2 0 360.546 4.090 20 0 FIADRP c1ccc(COCCC2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000423052836 1096565216 /nfs/dbraw/zinc/56/52/16/1096565216.db2.gz QOLZEYAXYWTQNX-FDFHNCONSA-N 2 0 356.554 4.274 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH+]1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000423052816 1096565481 /nfs/dbraw/zinc/56/54/81/1096565481.db2.gz RHQUYRDAGGQMIG-OAHLLOKOSA-N 2 0 359.464 4.143 20 0 FIADRP CCCN(C)[C@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(Cl)cc1 ZINC000423102713 1096567489 /nfs/dbraw/zinc/56/74/89/1096567489.db2.gz KKTRFOHYODPKFB-YCRPNKLZSA-N 2 0 374.960 4.236 20 0 FIADRP Clc1cc2c(s1)CC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423120327 1096577746 /nfs/dbraw/zinc/57/77/46/1096577746.db2.gz GBUXIFYVJMQHQA-QMTMVMCOSA-N 2 0 360.910 4.234 20 0 FIADRP c1cc2cc(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2s1 ZINC000423120918 1096578940 /nfs/dbraw/zinc/57/89/40/1096578940.db2.gz HVDUCMGSXFNWKE-WIYYLYMNSA-N 2 0 350.487 4.247 20 0 FIADRP FC1(F)CCCC[C@H](C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423123852 1096580353 /nfs/dbraw/zinc/58/03/53/1096580353.db2.gz FITQCVDDDXFRKU-WDYCEAGBSA-N 2 0 350.453 4.048 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1F ZINC000423109746 1096584829 /nfs/dbraw/zinc/58/48/29/1096584829.db2.gz OFQMBGSCGDXUCI-JQWIXIFHSA-N 2 0 366.278 4.162 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112049 1096585829 /nfs/dbraw/zinc/58/58/29/1096585829.db2.gz XGZVPQVDHFNTRE-MFMILTCTSA-N 2 0 354.519 4.315 20 0 FIADRP Clc1cccc(CC2([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000423154811 1096590173 /nfs/dbraw/zinc/59/01/73/1096590173.db2.gz JXFAJDITCNMGTQ-SIKLNZKXSA-N 2 0 368.908 4.261 20 0 FIADRP Cc1ncsc1C[N@H+](C[C@@H](C)CCc1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC000414722869 1096609933 /nfs/dbraw/zinc/60/99/33/1096609933.db2.gz GOEOUVSQBFTHFU-FXAWDEMLSA-N 2 0 357.567 4.132 20 0 FIADRP CSc1cccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cc(F)ccc2F)c1 ZINC000423247066 1096628817 /nfs/dbraw/zinc/62/88/17/1096628817.db2.gz KQMDBYUYLMXUKO-VLIAUNLRSA-N 2 0 362.489 4.365 20 0 FIADRP Brc1ccccc1[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000423254521 1096631764 /nfs/dbraw/zinc/63/17/64/1096631764.db2.gz YHQICKSSCPSHFQ-HNAYVOBHSA-N 2 0 359.311 4.128 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Br ZINC000423290674 1096636221 /nfs/dbraw/zinc/63/62/21/1096636221.db2.gz FAIZLYFBIKPLLU-QWHCGFSZSA-N 2 0 363.299 4.328 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423296624 1096644428 /nfs/dbraw/zinc/64/44/28/1096644428.db2.gz ZOXFTCOLFKJWPL-UONOGXRCSA-N 2 0 352.507 4.384 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423296622 1096644753 /nfs/dbraw/zinc/64/47/53/1096644753.db2.gz ZOXFTCOLFKJWPL-KBPBESRZSA-N 2 0 352.507 4.384 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCc3cc(N)ccc32)CC1 ZINC000423354098 1096654052 /nfs/dbraw/zinc/65/40/52/1096654052.db2.gz CMYVVCQSTDWWMF-UUOWRZLLSA-N 2 0 363.549 4.331 20 0 FIADRP Brc1cccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423356390 1096655049 /nfs/dbraw/zinc/65/50/49/1096655049.db2.gz QNBWUXGXHXFTPJ-LJQANCHMSA-N 2 0 357.295 4.048 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cnn1-c1cc(C)ccc1C ZINC000423406086 1096673731 /nfs/dbraw/zinc/67/37/31/1096673731.db2.gz YLORBAMSFJNCPQ-KRWDZBQOSA-N 2 0 360.505 4.252 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423418290 1096676962 /nfs/dbraw/zinc/67/69/62/1096676962.db2.gz HHTWDIAOQXHLBD-ATZDWAIDSA-N 2 0 357.567 4.458 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423438271 1096686860 /nfs/dbraw/zinc/68/68/60/1096686860.db2.gz MZPRHCIJIUREHH-PZPSRYQVSA-N 2 0 359.514 4.296 20 0 FIADRP COCCC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423459924 1096689551 /nfs/dbraw/zinc/68/95/51/1096689551.db2.gz AJROLRBQIQFMEL-OLMNPRSZSA-N 2 0 369.347 4.024 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423457566 1096689560 /nfs/dbraw/zinc/68/95/60/1096689560.db2.gz IKVFJARXUOBZJL-SRVKXCTJSA-N 2 0 364.383 4.058 20 0 FIADRP CC[C@H]([NH3+])CN[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423463665 1096690819 /nfs/dbraw/zinc/69/08/19/1096690819.db2.gz LMLJZNCQXZXBPE-HZMBPMFUSA-N 2 0 368.344 4.269 20 0 FIADRP CC(C)C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccn1 ZINC000423478695 1096696933 /nfs/dbraw/zinc/69/69/33/1096696933.db2.gz UKEOQWHJFQFHNH-CZTZKLFOSA-N 2 0 355.501 4.291 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccccc2Br)C1 ZINC000423508805 1096702133 /nfs/dbraw/zinc/70/21/33/1096702133.db2.gz OFBODZWTIFUPHH-OGWOLHLISA-N 2 0 359.311 4.256 20 0 FIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000423508329 1096703288 /nfs/dbraw/zinc/70/32/88/1096703288.db2.gz QOLOIPKABFHVOB-IIBYNOLFSA-N 2 0 366.509 4.101 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423535611 1096710905 /nfs/dbraw/zinc/71/09/05/1096710905.db2.gz DOVDNUFDQDUGRN-SFHVURJKSA-N 2 0 353.535 4.395 20 0 FIADRP COCCC[C@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccc(F)cc1 ZINC000423521664 1096711792 /nfs/dbraw/zinc/71/17/92/1096711792.db2.gz GKIATQMWBDMDPW-KFBXJMLISA-N 2 0 360.517 4.037 20 0 FIADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21)c1ccccc1 ZINC000423524476 1096712735 /nfs/dbraw/zinc/71/27/35/1096712735.db2.gz XBBBVLSNVCKOJZ-VXKWHMMOSA-N 2 0 360.505 4.320 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423536471 1096715267 /nfs/dbraw/zinc/71/52/67/1096715267.db2.gz AIDUUHCDPPXTBB-WYFUGZQLSA-N 2 0 369.734 4.068 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423541686 1096716271 /nfs/dbraw/zinc/71/62/71/1096716271.db2.gz LJMZQCVWDVFKHX-ORMQQPANSA-N 2 0 369.734 4.068 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@@H]3C1)CCC2 ZINC000423543576 1096717229 /nfs/dbraw/zinc/71/72/29/1096717229.db2.gz NGGMAFTWCSWMRF-OIPACUDHSA-N 2 0 371.525 4.304 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C2CC2)c1 ZINC000423544599 1096717738 /nfs/dbraw/zinc/71/77/38/1096717738.db2.gz OMWJSYJSADJAHU-LISAXSMJSA-N 2 0 354.416 4.014 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000423550024 1096719250 /nfs/dbraw/zinc/71/92/50/1096719250.db2.gz NRNVHAVLJSVSPG-XJWCYLOLSA-N 2 0 352.444 4.319 20 0 FIADRP CC[NH+](CC)[C@H](c1nc(-c2ccc(C[NH+](C)C)cc2)no1)c1ccccc1 ZINC000504228938 1096721095 /nfs/dbraw/zinc/72/10/95/1096721095.db2.gz BVWYEARVWNGJTJ-FQEVSTJZSA-N 2 0 364.493 4.229 20 0 FIADRP C[NH+](C)CCC1CC[NH+]([C@@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000532926905 1098596672 /nfs/dbraw/zinc/59/66/72/1098596672.db2.gz GGWAQRLTZODRRL-JOCHJYFZSA-N 2 0 365.521 4.030 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCC[C@H](c2ccnn2C)C1 ZINC000515591806 1098758547 /nfs/dbraw/zinc/75/85/47/1098758547.db2.gz AYROVRJGKKNTME-RXVVDRJESA-N 2 0 354.542 4.078 20 0 FIADRP CN1CCC[C@@H](C[NH2+]Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1cccs1 ZINC000436236206 1098859989 /nfs/dbraw/zinc/85/99/89/1098859989.db2.gz DSVLYZMKTLAZRX-IFXJQAMLSA-N 2 0 372.563 4.372 20 0 FIADRP [NH3+]CCC1CC[NH+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000515854146 1098989887 /nfs/dbraw/zinc/98/98/87/1098989887.db2.gz RNTBWTDSNOTJRD-UHFFFAOYSA-N 2 0 369.456 4.390 20 0 FIADRP COc1ccccc1C1(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)CCCC1 ZINC000436469108 1099045362 /nfs/dbraw/zinc/04/53/62/1099045362.db2.gz ZYTMUELQRLQPNH-UHFFFAOYSA-N 2 0 365.521 4.161 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccc(F)cc1 ZINC000508693188 1099824547 /nfs/dbraw/zinc/82/45/47/1099824547.db2.gz AFNKZPUQHSWWJZ-WSTZPKSXSA-N 2 0 356.485 4.093 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000162552498 1099841940 /nfs/dbraw/zinc/84/19/40/1099841940.db2.gz DWIWNOHYXPZIEG-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702683 1099857446 /nfs/dbraw/zinc/85/74/46/1099857446.db2.gz WHKNJEUQZNNMDK-NQIIRXRSSA-N 2 0 367.537 4.259 20 0 FIADRP C[C@H](Nc1ccc(CC[NH+](C)C)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715205 1099884677 /nfs/dbraw/zinc/88/46/77/1099884677.db2.gz XGUFJMUWVPPYFR-UGKGYDQZSA-N 2 0 351.538 4.113 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000508708937 1099888325 /nfs/dbraw/zinc/88/83/25/1099888325.db2.gz FCXQGUBSRIBUKA-CEMLEFRQSA-N 2 0 369.553 4.163 20 0 FIADRP C[C@@H](NC1CC[NH+](CC2CCCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508716213 1099913059 /nfs/dbraw/zinc/91/30/59/1099913059.db2.gz KIZRRCNBGQWJAJ-NFBKMPQASA-N 2 0 369.597 4.141 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)Cc1ccccc1 ZINC000508720923 1099939619 /nfs/dbraw/zinc/93/96/19/1099939619.db2.gz NWSOJSNYWGPJPN-DPLHUUCSSA-N 2 0 365.565 4.007 20 0 FIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC3(SC)CC[NH+](C)CC3)oc21 ZINC000516940237 1099947313 /nfs/dbraw/zinc/94/73/13/1099947313.db2.gz SEERHLNQHOZRSW-OAHLLOKOSA-N 2 0 362.539 4.310 20 0 FIADRP CC[N@H+](Cc1cccc(F)c1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506059522 1099956697 /nfs/dbraw/zinc/95/66/97/1099956697.db2.gz IXQAPDMXWHKTML-UHFFFAOYSA-N 2 0 369.528 4.378 20 0 FIADRP Cc1nn(-c2ccc(F)cc2)c(C)c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000536652096 1100105902 /nfs/dbraw/zinc/10/59/02/1100105902.db2.gz GCSVWQWEXUMZAP-UHFFFAOYSA-N 2 0 372.532 4.180 20 0 FIADRP CC[N@@H+](Cc1ccnc2ccccc12)CC1CCN(c2ccccn2)CC1 ZINC000536663037 1100134395 /nfs/dbraw/zinc/13/43/95/1100134395.db2.gz SBNZUOVGSIVJFN-UHFFFAOYSA-N 2 0 360.505 4.368 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2c(O)cccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000517187774 1100160354 /nfs/dbraw/zinc/16/03/54/1100160354.db2.gz YKJJSRKGZYWFHP-KPLVRAHFSA-N 2 0 350.506 4.270 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000437785057 1100191584 /nfs/dbraw/zinc/19/15/84/1100191584.db2.gz KRIAJSLVLPXBCA-UHFFFAOYSA-N 2 0 360.571 4.472 20 0 FIADRP CCCn1nc(C)c(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1C ZINC000536683159 1100192746 /nfs/dbraw/zinc/19/27/46/1100192746.db2.gz NXYKRWVWJRFYRB-UHFFFAOYSA-N 2 0 368.569 4.254 20 0 FIADRP C[C@H](Cc1cccc(Br)c1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459458733 1100203827 /nfs/dbraw/zinc/20/38/27/1100203827.db2.gz DSMFTDZNFARGAV-OAHLLOKOSA-N 2 0 374.326 4.034 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Br)s1 ZINC000459503161 1100241119 /nfs/dbraw/zinc/24/11/19/1100241119.db2.gz FVTPUOXMCPZFOV-GFCCVEGCSA-N 2 0 366.328 4.225 20 0 FIADRP c1ccc(C[NH+]2CCC([C@H]3CCCCC[N@H+]3C[C@@H]3CCOC3)CC2)cc1 ZINC000459517871 1100256410 /nfs/dbraw/zinc/25/64/10/1100256410.db2.gz GDGSFNVTLKZODY-JTHBVZDNSA-N 2 0 356.554 4.180 20 0 FIADRP CC(C)(C)C1CC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000459583172 1100309103 /nfs/dbraw/zinc/30/91/03/1100309103.db2.gz FMZAEYSWYMYXRU-ORFBVSJDSA-N 2 0 370.581 4.330 20 0 FIADRP FC(F)(F)[C@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Cc1ccccc1 ZINC000459569807 1100317317 /nfs/dbraw/zinc/31/73/17/1100317317.db2.gz ZPTFEQODAHHSMF-KRWDZBQOSA-N 2 0 363.427 4.061 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)C1 ZINC000536831699 1100369204 /nfs/dbraw/zinc/36/92/04/1100369204.db2.gz IWQUORBOCHSAPT-MOPGFXCFSA-N 2 0 374.573 4.235 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccccc1Br ZINC000536831257 1100369587 /nfs/dbraw/zinc/36/95/87/1100369587.db2.gz GVMBOJVPWFZMDZ-CPUCHLNUSA-N 2 0 353.348 4.045 20 0 FIADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000517783747 1100652003 /nfs/dbraw/zinc/65/20/03/1100652003.db2.gz XTIGOAFGUHKDKF-GOSISDBHSA-N 2 0 373.566 4.136 20 0 FIADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccccc3C[N@@H+]3CC[C@H](O)C3)oc2c1 ZINC000426049731 1100716637 /nfs/dbraw/zinc/71/66/37/1100716637.db2.gz JWPSMBGIEFOEFI-UWJYYQICSA-N 2 0 364.489 4.159 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000517936819 1100804522 /nfs/dbraw/zinc/80/45/22/1100804522.db2.gz ZLVATJAOEJHQSI-QAPCUYQASA-N 2 0 371.912 4.152 20 0 FIADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414949306 1100905928 /nfs/dbraw/zinc/90/59/28/1100905928.db2.gz ZTNDRMIEXSMHKI-LRDDRELGSA-N 2 0 365.340 4.265 20 0 FIADRP CC(C)Cn1ccnc1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000438833929 1100953592 /nfs/dbraw/zinc/95/35/92/1100953592.db2.gz YPOTWYVRNYPNIU-UHFFFAOYSA-N 2 0 354.542 4.072 20 0 FIADRP Cc1cnn(-c2cc[nH+]cc2N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000518236807 1101035609 /nfs/dbraw/zinc/03/56/09/1101035609.db2.gz ZSYDPMBQPJPBAP-ICSRJNTNSA-N 2 0 361.493 4.041 20 0 FIADRP Cc1nc(-c2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)cs1 ZINC000518329916 1101098475 /nfs/dbraw/zinc/09/84/75/1101098475.db2.gz KFVQVRNBJRGNFI-UHFFFAOYSA-N 2 0 364.518 4.272 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439143897 1101199122 /nfs/dbraw/zinc/19/91/22/1101199122.db2.gz TUZHBTKWYDFZNP-IOASZLSFSA-N 2 0 357.361 4.424 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000426302859 1101235951 /nfs/dbraw/zinc/23/59/51/1101235951.db2.gz VGKSQWOEOSBDNV-MISYRCLQSA-N 2 0 359.533 4.037 20 0 FIADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)C1 ZINC000261985114 1101278965 /nfs/dbraw/zinc/27/89/65/1101278965.db2.gz RVHILMDHJJQAPF-KRWDZBQOSA-N 2 0 372.472 4.066 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)C1 ZINC000414991877 1101285717 /nfs/dbraw/zinc/28/57/17/1101285717.db2.gz BHBZWQSPAQDPMZ-MFKMUULPSA-N 2 0 365.237 4.075 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)ccc1OCc1cccs1 ZINC000459734879 1101351390 /nfs/dbraw/zinc/35/13/90/1101351390.db2.gz OSYXXMTZBUTOKE-KRWDZBQOSA-N 2 0 374.550 4.157 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)C1 ZINC000537014666 1101396742 /nfs/dbraw/zinc/39/67/42/1101396742.db2.gz WJARBFWHJIKNLO-JXFKEZNVSA-N 2 0 359.514 4.188 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000467384574 1101399970 /nfs/dbraw/zinc/39/99/70/1101399970.db2.gz WYZGDXHKBMZLPU-QFIPXVFZSA-N 2 0 368.496 4.323 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC1 ZINC000537193200 1101528014 /nfs/dbraw/zinc/52/80/14/1101528014.db2.gz VLUGPMJSRORYHB-ZRBLBEILSA-N 2 0 356.554 4.275 20 0 FIADRP C[C@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC000178742024 1101534144 /nfs/dbraw/zinc/53/41/44/1101534144.db2.gz UNQIYDDWPRMEFN-QUCCMNQESA-N 2 0 357.542 4.027 20 0 FIADRP CCc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000518771757 1101535395 /nfs/dbraw/zinc/53/53/95/1101535395.db2.gz YDEZBIFABBEWDX-UHFFFAOYSA-N 2 0 357.567 4.003 20 0 FIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000537355718 1101690440 /nfs/dbraw/zinc/69/04/40/1101690440.db2.gz AXWRGEDXWCASDF-SVFBPWRDSA-N 2 0 352.522 4.130 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168169952 1101876198 /nfs/dbraw/zinc/87/61/98/1101876198.db2.gz YWZAQVARRRCMAQ-NDXORKPFSA-N 2 0 357.929 4.438 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC(COCC[NH+]2CCCC2)CC1 ZINC001168172048 1101922319 /nfs/dbraw/zinc/92/23/19/1101922319.db2.gz ZEQBCSZFLNOJOA-SFHVURJKSA-N 2 0 364.961 4.095 20 0 FIADRP C[C@H]1c2ccsc2CC[N@H+]1Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506736286 1101964907 /nfs/dbraw/zinc/96/49/07/1101964907.db2.gz PJPHSFQLPRHNHB-KRWDZBQOSA-N 2 0 369.578 4.398 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(Cl)c2C)CC1 ZINC000519225059 1102021231 /nfs/dbraw/zinc/02/12/31/1102021231.db2.gz ORIKSCAAHDEPGR-INIZCTEOSA-N 2 0 365.949 4.029 20 0 FIADRP C[N@@H+](Cc1ccccc1)C[C@H](C[NH+]1CC[C@@]2(CCOC2)C1)c1ccccc1 ZINC001168184410 1102106445 /nfs/dbraw/zinc/10/64/45/1102106445.db2.gz PIAJMEMUOIXWFE-DNQXCXABSA-N 2 0 364.533 4.015 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2c(C)cc(C)cc2C)CC1 ZINC000061070332 1102256686 /nfs/dbraw/zinc/25/66/86/1102256686.db2.gz WVCQFOMYZGBTGP-UHFFFAOYSA-N 2 0 365.565 4.039 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CCCS2 ZINC000187706264 1102301350 /nfs/dbraw/zinc/30/13/50/1102301350.db2.gz UNPOEVGASAGOFD-FQEVSTJZSA-N 2 0 356.535 4.474 20 0 FIADRP C[NH+](C)C[C@H](N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000550796792 1102327754 /nfs/dbraw/zinc/32/77/54/1102327754.db2.gz AWLORWWHQVORBF-FSSWDIPSSA-N 2 0 371.956 4.368 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000040622737 1102344320 /nfs/dbraw/zinc/34/43/20/1102344320.db2.gz HJIKOJYBOLZTOF-NXVRBGIVSA-N 2 0 351.332 4.015 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000532448476 1102345888 /nfs/dbraw/zinc/34/58/88/1102345888.db2.gz ZOVMGRKWOGTBQU-QGZVFWFLSA-N 2 0 365.521 4.262 20 0 FIADRP COc1ccc2c(c1)c(CC[NH3+])c(C)n2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167969068 1102346548 /nfs/dbraw/zinc/34/65/48/1102346548.db2.gz ZEEFMFLOYOXKLD-DFNIBXOVSA-N 2 0 367.537 4.037 20 0 FIADRP Fc1ccccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CCOCC1 ZINC001167969386 1102369551 /nfs/dbraw/zinc/36/95/51/1102369551.db2.gz BOOWSMOQPBFLOB-MNRDOXJOSA-N 2 0 372.528 4.288 20 0 FIADRP CCN(C(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccccc1 ZINC000061735335 1102418819 /nfs/dbraw/zinc/41/88/19/1102418819.db2.gz UKXFQWMQMGQJFT-FQEVSTJZSA-N 2 0 371.569 4.016 20 0 FIADRP C[C@H]([NH3+])c1ncc(-c2ccccc2)n1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167971200 1102424456 /nfs/dbraw/zinc/42/44/56/1102424456.db2.gz SFVJFYBKMXTMLS-LATSOQNDSA-N 2 0 350.510 4.148 20 0 FIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000122297703 1102560861 /nfs/dbraw/zinc/56/08/61/1102560861.db2.gz KVYBYJQVWUXPEH-HNNXBMFYSA-N 2 0 361.555 4.366 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Cl ZINC000122312461 1102565617 /nfs/dbraw/zinc/56/56/17/1102565617.db2.gz UJWGQXKOAMCCSU-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cccc(C(F)(F)F)n2)CC1 ZINC000550857309 1102577624 /nfs/dbraw/zinc/57/76/24/1102577624.db2.gz REGLPBHHCNWWOC-QAPCUYQASA-N 2 0 369.475 4.276 20 0 FIADRP CCc1nocc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000550140786 1102597076 /nfs/dbraw/zinc/59/70/76/1102597076.db2.gz ZTSNSNUOIJWUPD-UHFFFAOYSA-N 2 0 355.526 4.062 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001168251916 1102649825 /nfs/dbraw/zinc/64/98/25/1102649825.db2.gz FDUBFEMHMGMYDO-KRWDZBQOSA-N 2 0 352.950 4.471 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1 ZINC000550881682 1102651864 /nfs/dbraw/zinc/65/18/64/1102651864.db2.gz BDYZAMNLLFVBIF-NZQKXSOJSA-N 2 0 364.533 4.266 20 0 FIADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885782 1102657063 /nfs/dbraw/zinc/65/70/63/1102657063.db2.gz JIWFAVASLGRRDV-PABCKOPISA-N 2 0 370.581 4.330 20 0 FIADRP c1ccc(Oc2ccc(CC[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC001168353672 1102736380 /nfs/dbraw/zinc/73/63/80/1102736380.db2.gz PVOZJSXPDUZKGL-UHFFFAOYSA-N 2 0 350.506 4.485 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@@H](c2cccs2)[NH+]2CCCC2)C[C@H]1c1ccccc1 ZINC000550977391 1102738784 /nfs/dbraw/zinc/73/87/84/1102738784.db2.gz SZRQCIVKSMDKPC-ACRUOGEOSA-N 2 0 369.578 4.310 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c(OC(F)F)c2)CC1 ZINC000506864501 1102917208 /nfs/dbraw/zinc/91/72/08/1102917208.db2.gz BAEKWVPUDSCGEO-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP CCOc1cc(C[NH+]2CCC(C[NH+](CC)CC)CC2)ccc1OC(F)F ZINC000506910154 1102947976 /nfs/dbraw/zinc/94/79/76/1102947976.db2.gz RWBJCQWISDADIJ-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000506943629 1102963722 /nfs/dbraw/zinc/96/37/22/1102963722.db2.gz IRVIUAPCGLICPU-UHFFFAOYSA-N 2 0 355.507 4.330 20 0 FIADRP C[C@H](CC1CCCC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265357 1103024748 /nfs/dbraw/zinc/02/47/48/1103024748.db2.gz UBCBRZOUMSWCAD-OFNKIYASSA-N 2 0 370.581 4.474 20 0 FIADRP COc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1OC ZINC000551267609 1103028114 /nfs/dbraw/zinc/02/81/14/1103028114.db2.gz FYWGNMXNDOWJJB-UHFFFAOYSA-N 2 0 368.521 4.237 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C/c3ccc(F)cc3F)cc2)CC1 ZINC000551272545 1103035035 /nfs/dbraw/zinc/03/50/35/1103035035.db2.gz YIFXHLVVKSZNRL-NSCUHMNNSA-N 2 0 372.459 4.241 20 0 FIADRP CC1(C)Cc2cc(C[NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)ccc2O1 ZINC000729679682 1103043011 /nfs/dbraw/zinc/04/30/11/1103043011.db2.gz OGLYSBWRZSXPRJ-NRFANRHFSA-N 2 0 364.533 4.054 20 0 FIADRP COc1ncc([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC000551539829 1103317465 /nfs/dbraw/zinc/31/74/65/1103317465.db2.gz HBBSMKMJCUFRLK-XHSDSOJGSA-N 2 0 353.938 4.152 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)ccc1OCc1cccs1 ZINC000666996694 1103357339 /nfs/dbraw/zinc/35/73/39/1103357339.db2.gz AGVGKGZGCBLNOK-KRWDZBQOSA-N 2 0 372.534 4.100 20 0 FIADRP CSc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1 ZINC000551570818 1103376705 /nfs/dbraw/zinc/37/67/05/1103376705.db2.gz YVIZGTWPOMXBPJ-UHFFFAOYSA-N 2 0 356.535 4.171 20 0 FIADRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)cc(Br)c1 ZINC000507438112 1103389589 /nfs/dbraw/zinc/38/95/89/1103389589.db2.gz BGMKMQJTUWUDJC-INIZCTEOSA-N 2 0 357.311 4.361 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@@H]1CCC[NH2+]CC1)C1CCCCC1 ZINC000427291207 1103416170 /nfs/dbraw/zinc/41/61/70/1103416170.db2.gz ZERCNRCUMQKXAS-GOSISDBHSA-N 2 0 357.542 4.169 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCSc3ccc(Br)cc32)CC1 ZINC000507489357 1103435853 /nfs/dbraw/zinc/43/58/53/1103435853.db2.gz ZUWNOVXPUVQUCR-OAHLLOKOSA-N 2 0 369.372 4.308 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]CCc4ccc5ccccc5n4)[C@@H]3C2)cc1 ZINC000507519017 1103463194 /nfs/dbraw/zinc/46/31/94/1103463194.db2.gz GQZBXBDWPMVYMT-PWWKTKHKSA-N 2 0 371.528 4.278 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000551790571 1103663158 /nfs/dbraw/zinc/66/31/58/1103663158.db2.gz CQJVYHWXZICHQU-CDNPAEQRSA-N 2 0 374.569 4.284 20 0 FIADRP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1)C1CCCCC1 ZINC000519698804 1103785176 /nfs/dbraw/zinc/78/51/76/1103785176.db2.gz VTQWGJHQORXBEJ-BHDDXSALSA-N 2 0 369.553 4.216 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000477676415 1103788756 /nfs/dbraw/zinc/78/87/56/1103788756.db2.gz CDEOGQHSEUIKRU-UHFFFAOYSA-N 2 0 372.472 4.095 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCC(=O)Nc2cccc3ccccc32)CC1 ZINC000551948277 1103803054 /nfs/dbraw/zinc/80/30/54/1103803054.db2.gz IKCUDFAWMQZHFR-UHFFFAOYSA-N 2 0 367.537 4.221 20 0 FIADRP COc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000520227165 1104199072 /nfs/dbraw/zinc/19/90/72/1104199072.db2.gz IZFVCDOMDVBWHH-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCOC4(CCSCC4)C3)CC2)C1 ZINC000537963317 1104448980 /nfs/dbraw/zinc/44/89/80/1104448980.db2.gz HTBSKINLGKUBDO-MISYRCLQSA-N 2 0 366.615 4.064 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2COc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005192 1105076369 /nfs/dbraw/zinc/07/63/69/1105076369.db2.gz HUDSRRRUDKSMTR-HMFYCAOWSA-N 2 0 350.506 4.021 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000507806308 1105153455 /nfs/dbraw/zinc/15/34/55/1105153455.db2.gz RXOLJQBOIRMKEZ-UHFFFAOYSA-N 2 0 356.485 4.035 20 0 FIADRP CC[C@@H]1C[C@H](C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCO1 ZINC000507809871 1105176162 /nfs/dbraw/zinc/17/61/62/1105176162.db2.gz FQEQHJPFZFDARW-ACESQOTJSA-N 2 0 356.554 4.178 20 0 FIADRP CCSc1cc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)ccn1 ZINC000427868050 1105303553 /nfs/dbraw/zinc/30/35/53/1105303553.db2.gz VUAFITZFRVBWOS-QHAWAJNXSA-N 2 0 367.562 4.194 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000475667308 1106751248 /nfs/dbraw/zinc/75/12/48/1106751248.db2.gz AXXLVZJOTIYOTP-RUCARUNLSA-N 2 0 352.869 4.265 20 0 FIADRP COCCCC[C@@H]([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1ccccc1 ZINC000475358710 1106756460 /nfs/dbraw/zinc/75/64/60/1106756460.db2.gz RANTYNNHBYVIFP-JOCHJYFZSA-N 2 0 364.493 4.223 20 0 FIADRP C[NH+](C)C[C@H](N[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000530227496 1106916314 /nfs/dbraw/zinc/91/63/14/1106916314.db2.gz YIIOKMROTDVRQC-OTWHNJEPSA-N 2 0 364.320 4.331 20 0 FIADRP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@H](C)O1 ZINC000451171863 1106958090 /nfs/dbraw/zinc/95/80/90/1106958090.db2.gz ULFIRVXSCDESCE-SOZYPREZSA-N 2 0 362.945 4.409 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CSCCc4ccccc43)C2)cc1 ZINC000530364371 1106985162 /nfs/dbraw/zinc/98/51/62/1106985162.db2.gz IQRMUUYLMKXDGV-DENIHFKCSA-N 2 0 352.547 4.129 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCS2 ZINC000152441299 1107647530 /nfs/dbraw/zinc/64/75/30/1107647530.db2.gz VWIAIXUZTJBYFR-LRDDRELGSA-N 2 0 367.356 4.060 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152468348 1107775166 /nfs/dbraw/zinc/77/51/66/1107775166.db2.gz YSDKGPANRGLMSL-KSSFIOAISA-N 2 0 371.525 4.401 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccc(Cl)nc2)cc1 ZINC000179106697 1107873479 /nfs/dbraw/zinc/87/34/79/1107873479.db2.gz GDNBFHWUXCPSOH-MRXNPFEDSA-N 2 0 361.917 4.306 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccs2)cc1 ZINC000444667173 1108070100 /nfs/dbraw/zinc/07/01/00/1108070100.db2.gz SDTXGGDYACXNQV-VAMGGRTRSA-N 2 0 356.535 4.099 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccs2)cc1 ZINC000444667167 1108070317 /nfs/dbraw/zinc/07/03/17/1108070317.db2.gz SDTXGGDYACXNQV-AABGKKOBSA-N 2 0 356.535 4.099 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000531692673 1108097355 /nfs/dbraw/zinc/09/73/55/1108097355.db2.gz UYQISVUJHXRHEM-BAGYTPMASA-N 2 0 373.585 4.439 20 0 FIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C)c2)CC1)c1ccncc1 ZINC000453065010 1108144936 /nfs/dbraw/zinc/14/49/36/1108144936.db2.gz HHJVXINUMDRSLH-HSZRJFAPSA-N 2 0 366.553 4.033 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2sccc21 ZINC000453102626 1108170686 /nfs/dbraw/zinc/17/06/86/1108170686.db2.gz QDUANONEQDTSSJ-KKSFZXQISA-N 2 0 370.562 4.433 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c2sccc21 ZINC000453197027 1108266644 /nfs/dbraw/zinc/26/66/44/1108266644.db2.gz MSFCCULGYPBWHB-OZOXKJRCSA-N 2 0 370.562 4.433 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(-c2ccccc2)nn1C ZINC000453197595 1108267546 /nfs/dbraw/zinc/26/75/46/1108267546.db2.gz NLIHLQDPXQGPOW-CMKODMSKSA-N 2 0 366.553 4.391 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000453205611 1108275303 /nfs/dbraw/zinc/27/53/03/1108275303.db2.gz HAJWMPHFCRIWCQ-GPVXHPMSSA-N 2 0 356.554 4.224 20 0 FIADRP FC(F)(F)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000453229983 1108304295 /nfs/dbraw/zinc/30/42/95/1108304295.db2.gz PLUJAIGXIQFFIN-ADXGEFSYSA-N 2 0 352.444 4.360 20 0 FIADRP CCN(CC)C(=O)C[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000531938809 1108413854 /nfs/dbraw/zinc/41/38/54/1108413854.db2.gz DWHOHEHQNTZMOX-IBGZPJMESA-N 2 0 373.585 4.188 20 0 FIADRP CCN(CC)C(=O)C[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000531938816 1108414401 /nfs/dbraw/zinc/41/44/01/1108414401.db2.gz DWHOHEHQNTZMOX-LJQANCHMSA-N 2 0 373.585 4.188 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)CCc3ccco3)CC2)c1 ZINC000531945335 1108415945 /nfs/dbraw/zinc/41/59/45/1108415945.db2.gz FYVDPXVLSMOZGS-NRFANRHFSA-N 2 0 369.553 4.101 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453349128 1108449229 /nfs/dbraw/zinc/44/92/29/1108449229.db2.gz GMLAFCDPMLICKX-PGRDOPGGSA-N 2 0 367.537 4.249 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000531979277 1108496217 /nfs/dbraw/zinc/49/62/17/1108496217.db2.gz MLFUCBSPSFUIKM-JRPNMDOOSA-N 2 0 365.732 4.344 20 0 FIADRP C[N@H+](CCCC[NH2+]C1CC(c2ccc(Br)cc2F)C1)C1CC1 ZINC000453590817 1108647770 /nfs/dbraw/zinc/64/77/70/1108647770.db2.gz BOGRVVRSTFSDTA-UHFFFAOYSA-N 2 0 369.322 4.298 20 0 FIADRP Cn1cncc1C[N@@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000453600688 1108651402 /nfs/dbraw/zinc/65/14/02/1108651402.db2.gz RTFNDASFCZNFOD-QHCPKHFHSA-N 2 0 366.553 4.077 20 0 FIADRP CN(c1ccccc1C[NH2+]CCOC1CCCCCC1)C1CC[NH+](C)CC1 ZINC000532104673 1108660275 /nfs/dbraw/zinc/66/02/75/1108660275.db2.gz SCIWXUADENYJHI-UHFFFAOYSA-N 2 0 373.585 4.046 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000532210185 1108712943 /nfs/dbraw/zinc/71/29/43/1108712943.db2.gz WHMHEZPZUWNPKY-QGZVFWFLSA-N 2 0 372.557 4.085 20 0 FIADRP CN(c1ccccc1C[NH2+]CCCc1cccc(F)c1)C1CC[NH+](C)CC1 ZINC000532359006 1108770206 /nfs/dbraw/zinc/77/02/06/1108770206.db2.gz OZLJBQUHHPHAKB-UHFFFAOYSA-N 2 0 369.528 4.079 20 0 FIADRP FC(F)(F)c1cccc(OCCCC[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000524609607 1109096353 /nfs/dbraw/zinc/09/63/53/1109096353.db2.gz HGBPDISHTXRMLB-KRWDZBQOSA-N 2 0 370.459 4.282 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428451634 1109313507 /nfs/dbraw/zinc/31/35/07/1109313507.db2.gz DBPXCDOFHYGIPL-QPTUXGOLSA-N 2 0 369.597 4.140 20 0 FIADRP Cc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc1Oc1cccnc1 ZINC000446883644 1109382185 /nfs/dbraw/zinc/38/21/85/1109382185.db2.gz IWDCZKUSODBUPR-UHFFFAOYSA-N 2 0 351.494 4.146 20 0 FIADRP Clc1cc(Br)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887456 1109384003 /nfs/dbraw/zinc/38/40/03/1109384003.db2.gz TZKMHDRMJHUWJR-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000428463722 1109407211 /nfs/dbraw/zinc/40/72/11/1109407211.db2.gz PTQNLNLZXMGBPV-WSWWRLHASA-N 2 0 358.570 4.064 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000525869927 1109547132 /nfs/dbraw/zinc/54/71/32/1109547132.db2.gz XCVPVLJGVWQTQO-ZWOKBUDYSA-N 2 0 352.950 4.170 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000447557603 1109580687 /nfs/dbraw/zinc/58/06/87/1109580687.db2.gz MLWPNXUADHIQNQ-SFHVURJKSA-N 2 0 354.416 4.037 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)c1 ZINC000447567237 1109584924 /nfs/dbraw/zinc/58/49/24/1109584924.db2.gz ACDKLORPAVAXOO-XMMPIXPASA-N 2 0 364.533 4.443 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccnn3-c3ccccc3)cc2)C1 ZINC000447931661 1109682135 /nfs/dbraw/zinc/68/21/35/1109682135.db2.gz OVDDYHOFNVIDKZ-FQEVSTJZSA-N 2 0 374.532 4.394 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](C[C@H](C)c2cccc(Cl)c2)CC1 ZINC000527116371 1109698936 /nfs/dbraw/zinc/69/89/36/1109698936.db2.gz RGSWTVVOQPXKHS-KRWDZBQOSA-N 2 0 352.950 4.266 20 0 FIADRP CC(C)(C[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000527292299 1109733812 /nfs/dbraw/zinc/73/38/12/1109733812.db2.gz IISUYDOZAAAUDB-UHFFFAOYSA-N 2 0 354.460 4.447 20 0 FIADRP Cc1cccc([C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C(C)C)c1 ZINC000527857908 1109840686 /nfs/dbraw/zinc/84/06/86/1109840686.db2.gz FJIPERUELSMGKZ-XMMPIXPASA-N 2 0 366.549 4.439 20 0 FIADRP CC[C@H](CCc1ccccc1)[NH2+]C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000527871524 1109845403 /nfs/dbraw/zinc/84/54/03/1109845403.db2.gz PWPJYCSMVBMXLE-HXUWFJFHSA-N 2 0 352.526 4.063 20 0 FIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000527849883 1109847333 /nfs/dbraw/zinc/84/73/33/1109847333.db2.gz MCHSDCNUPFETFS-RBUKOAKNSA-N 2 0 366.553 4.198 20 0 FIADRP CC(C)c1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000527883627 1109849066 /nfs/dbraw/zinc/84/90/66/1109849066.db2.gz DLUFUVQCYJGIPZ-MBSDFSHPSA-N 2 0 352.522 4.227 20 0 FIADRP CCOCc1ccccc1C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449077838 1109974438 /nfs/dbraw/zinc/97/44/38/1109974438.db2.gz ZFIYFSJUKOVGOK-FQEVSTJZSA-N 2 0 366.549 4.408 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3c(OC)c2)[C@@H](C)C1 ZINC000449137132 1109979739 /nfs/dbraw/zinc/97/97/39/1109979739.db2.gz DQZYBVBTHXBGSA-AVRDEDQJSA-N 2 0 370.537 4.075 20 0 FIADRP COCCC[NH+]1CCC([NH2+]Cc2ccccc2-c2ccccc2C)CC1 ZINC000449110898 1109982952 /nfs/dbraw/zinc/98/29/52/1109982952.db2.gz HLSREPUCSRBJRW-UHFFFAOYSA-N 2 0 352.522 4.253 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cnc(-c3ccccc3F)s2)ccc1F ZINC000449157546 1109987117 /nfs/dbraw/zinc/98/71/17/1109987117.db2.gz VSIDYBGYSYVGBZ-UHFFFAOYSA-N 2 0 373.472 4.440 20 0 FIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)CC2)cc1 ZINC000449163439 1109990060 /nfs/dbraw/zinc/99/00/60/1109990060.db2.gz WDUIIGDRHFQHPE-DYESRHJHSA-N 2 0 374.956 4.366 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCO[C@]3(CCSC3)C2)CC1 ZINC000449188021 1109991069 /nfs/dbraw/zinc/99/10/69/1109991069.db2.gz FNRPMCNEUAZUKA-WIYYLYMNSA-N 2 0 368.631 4.310 20 0 FIADRP CC[S@](=O)[C@H]1CCC[C@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449180216 1109992942 /nfs/dbraw/zinc/99/29/42/1109992942.db2.gz YWYCNBRAVGCLHS-MHPIHPPYSA-N 2 0 370.647 4.335 20 0 FIADRP COCC[C@H](NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccco1 ZINC000449229887 1110003675 /nfs/dbraw/zinc/00/36/75/1110003675.db2.gz FTXWZGUJXFTFOP-NQIIRXRSSA-N 2 0 356.510 4.042 20 0 FIADRP Cc1csc([C@H](C)C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)n1 ZINC000449239608 1110008993 /nfs/dbraw/zinc/00/89/93/1110008993.db2.gz WGAQVWMJMMSPBK-AEFFLSMTSA-N 2 0 357.567 4.240 20 0 FIADRP Cc1cnc([C@H](C)C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)s1 ZINC000449240597 1110010108 /nfs/dbraw/zinc/01/01/08/1110010108.db2.gz ZSPBSYHQSKVKMU-IAGOWNOFSA-N 2 0 357.567 4.240 20 0 FIADRP Cc1cccc(CCC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)n1 ZINC000449316002 1110030809 /nfs/dbraw/zinc/03/08/09/1110030809.db2.gz LEXATPPDRQODNP-FQEVSTJZSA-N 2 0 351.538 4.008 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000449342830 1110034555 /nfs/dbraw/zinc/03/45/55/1110034555.db2.gz FPURWCPKRWRPQF-FCHUYYIVSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1cc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cs1 ZINC000449346446 1110036064 /nfs/dbraw/zinc/03/60/64/1110036064.db2.gz ZLAKZPSVIBEGQR-NRFANRHFSA-N 2 0 370.562 4.075 20 0 FIADRP CC1(C)C[N@H+](C[C@@H]2CCCOC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449416288 1110056457 /nfs/dbraw/zinc/05/64/57/1110056457.db2.gz SQPOOKRHOLIBJF-UNMCSNQZSA-N 2 0 356.554 4.036 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449440407 1110079965 /nfs/dbraw/zinc/07/99/65/1110079965.db2.gz ZHJBMHVCMPIKGA-CRAIPNDOSA-N 2 0 363.427 4.101 20 0 FIADRP COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000449619380 1110127315 /nfs/dbraw/zinc/12/73/15/1110127315.db2.gz PGVLMAIIYGCTMK-QGQQZZQASA-N 2 0 364.533 4.441 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449634259 1110135808 /nfs/dbraw/zinc/13/58/08/1110135808.db2.gz ZVPOXAYAMHNDOD-OYNPSCLESA-N 2 0 370.562 4.468 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(Cc2cccc(Cl)c2)CC1 ZINC000449683902 1110145255 /nfs/dbraw/zinc/14/52/55/1110145255.db2.gz ZLZFDSPOWXBRGC-UHFFFAOYSA-N 2 0 352.869 4.094 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000371986038 1110275164 /nfs/dbraw/zinc/27/51/64/1110275164.db2.gz XDRIFJZQDYRYRU-MRXNPFEDSA-N 2 0 355.526 4.019 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)cc1)C(F)(F)F ZINC000450599899 1110318558 /nfs/dbraw/zinc/31/85/58/1110318558.db2.gz LXSCPGWJCAMUJQ-UTRMSSBJSA-N 2 0 370.459 4.036 20 0 FIADRP C[N@H+](CCCC(=O)c1ccc(F)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000450641487 1110321090 /nfs/dbraw/zinc/32/10/90/1110321090.db2.gz NWNQOPGKXTWIEL-UHFFFAOYSA-N 2 0 369.484 4.032 20 0 FIADRP CC(=O)c1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000450653838 1110324913 /nfs/dbraw/zinc/32/49/13/1110324913.db2.gz WGFBTNPCRLCFPJ-UHFFFAOYSA-N 2 0 362.517 4.377 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)C[N@@H+]1Cc1ccccc1 ZINC000538407791 1111128979 /nfs/dbraw/zinc/12/89/79/1111128979.db2.gz KUSCVWRJMRZQJO-SGCGGLILSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)C[C@H](C)O1 ZINC000461385686 1111192839 /nfs/dbraw/zinc/19/28/39/1111192839.db2.gz ICFMQBMQMVQKHP-CALCHBBNSA-N 2 0 366.496 4.336 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccc(Cl)s3)CC2)C[C@@H](C)O1 ZINC000538721581 1111261995 /nfs/dbraw/zinc/26/19/95/1111261995.db2.gz RTMVHTDAPHJZAL-HUUCEWRRSA-N 2 0 356.963 4.113 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000538761969 1111289628 /nfs/dbraw/zinc/28/96/28/1111289628.db2.gz PAHPYYQHMRGBQI-UHFFFAOYSA-N 2 0 367.537 4.071 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1cc(-c2ccccc2)cs1 ZINC000538795878 1111293794 /nfs/dbraw/zinc/29/37/94/1111293794.db2.gz BOOIXUMFJGNSGM-GIVPXCGWSA-N 2 0 356.535 4.099 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccccc2Br)[C@H](C)C1 ZINC000539053395 1111401707 /nfs/dbraw/zinc/40/17/07/1111401707.db2.gz FYAWWTPEQSRAGQ-PBHICJAKSA-N 2 0 353.348 4.047 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1cccc(-c2ccccc2)c1 ZINC000539062264 1111408134 /nfs/dbraw/zinc/40/81/34/1111408134.db2.gz VQBMQUPHQBNXLY-NTUVXCKYSA-N 2 0 364.533 4.382 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@H](c3ccc(F)cc3)C3CC3)CC2)oc1C ZINC000539201624 1111470237 /nfs/dbraw/zinc/47/02/37/1111470237.db2.gz ICMYEXGLTGIBFO-QFIPXVFZSA-N 2 0 371.500 4.383 20 0 FIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000462115733 1111503287 /nfs/dbraw/zinc/50/32/87/1111503287.db2.gz ITNIOULLCDHATL-QGZVFWFLSA-N 2 0 373.368 4.139 20 0 FIADRP Clc1ccc(Br)c(CC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000539296053 1111505865 /nfs/dbraw/zinc/50/58/65/1111505865.db2.gz WTBXAGJRSPMBRZ-UHFFFAOYSA-N 2 0 371.750 4.109 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1F ZINC000539369146 1111532354 /nfs/dbraw/zinc/53/23/54/1111532354.db2.gz CHFZISYVUZZLBY-HXUWFJFHSA-N 2 0 354.469 4.212 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)CC1 ZINC000552048407 1111557678 /nfs/dbraw/zinc/55/76/78/1111557678.db2.gz RITVLYBRTKEXFN-CDQBWFRLSA-N 2 0 356.554 4.223 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477935228 1111606392 /nfs/dbraw/zinc/60/63/92/1111606392.db2.gz WJDXRPJSEZTMPV-QTGUNEKASA-N 2 0 368.521 4.055 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c(Cl)c1 ZINC000477918992 1111609242 /nfs/dbraw/zinc/60/92/42/1111609242.db2.gz QRXUZLRZFFRGDD-MRXNPFEDSA-N 2 0 365.949 4.077 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)CC1 ZINC000477945675 1111617802 /nfs/dbraw/zinc/61/78/02/1111617802.db2.gz YLGWZTLKVIWUEB-WENLIBGGSA-N 2 0 356.554 4.397 20 0 FIADRP CC[C@H]1C[C@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCO1 ZINC000552273262 1111654215 /nfs/dbraw/zinc/65/42/15/1111654215.db2.gz AUWLPDMXIMZCIB-YADHBBJMSA-N 2 0 356.554 4.180 20 0 FIADRP CC[C@H]1C[C@@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCO1 ZINC000552273261 1111654273 /nfs/dbraw/zinc/65/42/73/1111654273.db2.gz AUWLPDMXIMZCIB-VXKWHMMOSA-N 2 0 356.554 4.180 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000479368078 1112002185 /nfs/dbraw/zinc/00/21/85/1112002185.db2.gz XSPXOXKUZUCUEO-KZULUSFZSA-N 2 0 367.306 4.113 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479364414 1112007203 /nfs/dbraw/zinc/00/72/03/1112007203.db2.gz RVYYQXGAYCQUJK-NQIIRXRSSA-N 2 0 354.542 4.350 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4ccc(Cl)cc43)cc2)CC1 ZINC000479581804 1112079493 /nfs/dbraw/zinc/07/94/93/1112079493.db2.gz VAWJTWJMZLDLPU-QFIPXVFZSA-N 2 0 370.924 4.074 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000553875970 1112118328 /nfs/dbraw/zinc/11/83/28/1112118328.db2.gz HPGXWOFIGSWRBY-IEBWSBKVSA-N 2 0 358.555 4.195 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000479889565 1112186919 /nfs/dbraw/zinc/18/69/19/1112186919.db2.gz VRHCHULXRYRVIA-HXOBKFHXSA-N 2 0 368.496 4.071 20 0 FIADRP CC(C)c1nnc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)s1 ZINC000898517548 1112288897 /nfs/dbraw/zinc/28/88/97/1112288897.db2.gz PSPPSVOFHJYOQW-QYZOEREBSA-N 2 0 370.566 4.052 20 0 FIADRP FC(F)c1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cn1 ZINC000898518109 1112289592 /nfs/dbraw/zinc/28/95/92/1112289592.db2.gz YUDOUSIPEFABKK-AABGKKOBSA-N 2 0 371.475 4.410 20 0 FIADRP COc1ccc(C2([NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000480204658 1112331963 /nfs/dbraw/zinc/33/19/63/1112331963.db2.gz ZLXSDZRDIQMDFP-QUCCMNQESA-N 2 0 350.506 4.185 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCc4cc(F)ccc43)cc2)C[C@H](C)O1 ZINC000480236380 1112344568 /nfs/dbraw/zinc/34/45/68/1112344568.db2.gz VCSLKJNQENBJMW-SAHWJRBASA-N 2 0 368.496 4.212 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cn1 ZINC000480339172 1112387573 /nfs/dbraw/zinc/38/75/73/1112387573.db2.gz WCMYNHHRCYILLO-BBWFWOEESA-N 2 0 373.928 4.195 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(-c2cccs2)cc1)N1CC[NH+](C)CC1 ZINC000480548520 1112470487 /nfs/dbraw/zinc/47/04/87/1112470487.db2.gz JONLSYPHQSIMBI-WIYYLYMNSA-N 2 0 371.594 4.338 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000480608968 1112499019 /nfs/dbraw/zinc/49/90/19/1112499019.db2.gz IJQLPHNNTZOJAP-GIWBLDEGSA-N 2 0 357.586 4.141 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000480614268 1112502346 /nfs/dbraw/zinc/50/23/46/1112502346.db2.gz SEHHHYKAUJSEJH-UXHICEINSA-N 2 0 367.537 4.156 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cnn1-c1ccc(F)cc1 ZINC000480617609 1112510271 /nfs/dbraw/zinc/51/02/71/1112510271.db2.gz SDBCUWVJABCGGC-GOSISDBHSA-N 2 0 372.532 4.483 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cnn1-c1ccc(F)cc1 ZINC000480643856 1112518402 /nfs/dbraw/zinc/51/84/02/1112518402.db2.gz SYHKYGRDOOUQCB-ZWKOTPCHSA-N 2 0 372.532 4.483 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc2c(c1)OCO2 ZINC000480635487 1112523809 /nfs/dbraw/zinc/52/38/09/1112523809.db2.gz AIJMLZTYJKSCJK-ROUUACIJSA-N 2 0 366.505 4.498 20 0 FIADRP CC(C)C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521339 1112524232 /nfs/dbraw/zinc/52/42/32/1112524232.db2.gz MVZRHMRMLSROLR-MRXNPFEDSA-N 2 0 359.341 4.048 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cn1 ZINC000480657195 1112533066 /nfs/dbraw/zinc/53/30/66/1112533066.db2.gz DNXPZIPSHIGRGC-LJQANCHMSA-N 2 0 366.553 4.202 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccccc2Cl)CC1 ZINC000480694778 1112557610 /nfs/dbraw/zinc/55/76/10/1112557610.db2.gz PVLXBOICIZPBAJ-GOSISDBHSA-N 2 0 371.956 4.328 20 0 FIADRP CC[NH+](CC)[C@H](CNC(=O)Nc1cccc(C[NH3+])c1)c1ccccc1Cl ZINC000667732518 1112558909 /nfs/dbraw/zinc/55/89/09/1112558909.db2.gz LFOBRQWNPJNOBD-LJQANCHMSA-N 2 0 374.916 4.003 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCCc4sccc43)cc2)CC1 ZINC000480720861 1112562530 /nfs/dbraw/zinc/56/25/30/1112562530.db2.gz LJZIZTSMPWMALQ-NRFANRHFSA-N 2 0 369.578 4.053 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCCCC1 ZINC000480757679 1112589422 /nfs/dbraw/zinc/58/94/22/1112589422.db2.gz LTMRCFMMPGWCGT-IFMALSPDSA-N 2 0 358.570 4.474 20 0 FIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CCCO2 ZINC000481327491 1112901315 /nfs/dbraw/zinc/90/13/15/1112901315.db2.gz INEYAQIJBLOSJP-QFIPXVFZSA-N 2 0 368.521 4.247 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2c(s1)CCCC2 ZINC000481326685 1112901420 /nfs/dbraw/zinc/90/14/20/1112901420.db2.gz YYISMRCEMYDHKO-MRXNPFEDSA-N 2 0 358.551 4.418 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(OC)cc3)CC2)cc1 ZINC000481714228 1113052853 /nfs/dbraw/zinc/05/28/53/1113052853.db2.gz FIQDCUVSNUZCNR-SFHVURJKSA-N 2 0 368.521 4.267 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732137 1113058752 /nfs/dbraw/zinc/05/87/52/1113058752.db2.gz DWZRYNCQVUZFRU-IAGOWNOFSA-N 2 0 355.295 4.113 20 0 FIADRP Cc1ccc2c(CC[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)c[nH]c2c1 ZINC000482136372 1113179173 /nfs/dbraw/zinc/17/91/73/1113179173.db2.gz PJCSYKWYIOKYOT-GOSISDBHSA-N 2 0 365.521 4.310 20 0 FIADRP C[N@H+](CCCc1ccc2c(c1)CCO2)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000482159204 1113187466 /nfs/dbraw/zinc/18/74/66/1113187466.db2.gz WFKUQNTUNHAMNF-JOCHJYFZSA-N 2 0 364.533 4.008 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccccc2Cl)[C@H](C)C1 ZINC000482236615 1113206517 /nfs/dbraw/zinc/20/65/17/1113206517.db2.gz ASMMRCJABMSOPW-XLIONFOSSA-N 2 0 366.977 4.344 20 0 FIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H]1CCCc2cccnc21 ZINC000482280007 1113216108 /nfs/dbraw/zinc/21/61/08/1113216108.db2.gz FZIWRHZTFIHHAL-NRFANRHFSA-N 2 0 361.493 4.260 20 0 FIADRP CC(C)C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@H]1CCCc2cccnc21 ZINC000668003223 1113223584 /nfs/dbraw/zinc/22/35/84/1113223584.db2.gz LKJREJMFGCXUKN-NRFANRHFSA-N 2 0 361.493 4.198 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3cc(Br)ccc32)C1 ZINC000482343613 1113229823 /nfs/dbraw/zinc/22/98/23/1113229823.db2.gz LIAWHCXJUMKDQX-KBXCAEBGSA-N 2 0 351.332 4.146 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)CN1CC[NH+](C)CC1 ZINC000482447720 1113259353 /nfs/dbraw/zinc/25/93/53/1113259353.db2.gz MKRNHAHOKNXQOM-UXHICEINSA-N 2 0 357.586 4.268 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OC)cc1 ZINC000482451277 1113263406 /nfs/dbraw/zinc/26/34/06/1113263406.db2.gz RXCFWQDHBBSMNC-OFNKIYASSA-N 2 0 352.522 4.301 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000482519353 1113282750 /nfs/dbraw/zinc/28/27/50/1113282750.db2.gz NHNAGLWEJVAHSI-KXBFYZLASA-N 2 0 372.384 4.308 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482549822 1113291555 /nfs/dbraw/zinc/29/15/55/1113291555.db2.gz DYCJRWGYKPLHIH-XXBNENTESA-N 2 0 367.537 4.156 20 0 FIADRP CC(C)C[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1cccc(C(F)(F)F)c1 ZINC000482543624 1113293037 /nfs/dbraw/zinc/29/30/37/1113293037.db2.gz NJBJZHHITKMTPT-LJQANCHMSA-N 2 0 372.475 4.087 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)[C@@H](C)C1 ZINC000483151687 1113455323 /nfs/dbraw/zinc/45/53/23/1113455323.db2.gz HHCVUOXTHHWUBR-BJLQDIEVSA-N 2 0 350.522 4.230 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)Cc1cccc(Br)c1 ZINC000483220416 1113467722 /nfs/dbraw/zinc/46/77/22/1113467722.db2.gz WUEXXPPPWAGLJF-VKJFTORMSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486708703 1113627090 /nfs/dbraw/zinc/62/70/90/1113627090.db2.gz KDCLBLUVLKJJPN-LPHOPBHVSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000668713661 1113680727 /nfs/dbraw/zinc/68/07/27/1113680727.db2.gz XAIXGMZKMHSPEF-KNQAVFIVSA-N 2 0 364.533 4.215 20 0 FIADRP CCC[C@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1)c1ccccc1 ZINC000488329252 1113909379 /nfs/dbraw/zinc/90/93/79/1113909379.db2.gz WLQRJODWOCVJRK-UGKGYDQZSA-N 2 0 373.585 4.086 20 0 FIADRP C[C@@H](c1ccccc1Br)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488329924 1113909803 /nfs/dbraw/zinc/90/98/03/1113909803.db2.gz XMFLVIULOZGLJT-HNNXBMFYSA-N 2 0 351.332 4.318 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cc4ccc(F)cc4[nH]3)CC2)C[C@@H](C)O1 ZINC000488349225 1113913197 /nfs/dbraw/zinc/91/31/97/1113913197.db2.gz BXHRHWCMKXUNHX-IAGOWNOFSA-N 2 0 373.516 4.018 20 0 FIADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1Oc1cccnc1 ZINC000489038272 1114034572 /nfs/dbraw/zinc/03/45/72/1114034572.db2.gz RNNZHHTWEFSOCW-GOSISDBHSA-N 2 0 353.510 4.394 20 0 FIADRP COc1c(C)cnc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1C ZINC000491028632 1114363388 /nfs/dbraw/zinc/36/33/88/1114363388.db2.gz OCLZQKFDLDKNGF-UHFFFAOYSA-N 2 0 367.537 4.051 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000570964757 1114418692 /nfs/dbraw/zinc/41/86/92/1114418692.db2.gz ARYQTRIFOHPKHX-UZUQRXQVSA-N 2 0 350.506 4.498 20 0 FIADRP C[C@H](NCCC[N@H+](C)C1CCCCC1)c1cncc(Br)c1 ZINC000571897897 1114544502 /nfs/dbraw/zinc/54/45/02/1114544502.db2.gz YVYLGHCSUPYYOX-AWEZNQCLSA-N 2 0 354.336 4.149 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000588708658 1114601483 /nfs/dbraw/zinc/60/14/83/1114601483.db2.gz BLTINWDAFLDWIS-HOTGVXAUSA-N 2 0 370.459 4.027 20 0 FIADRP C[C@@H](c1ccccc1Cl)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000588710755 1114602006 /nfs/dbraw/zinc/60/20/06/1114602006.db2.gz LARARRYYLMKYRW-BBWFWOEESA-N 2 0 350.934 4.222 20 0 FIADRP COc1ccc(Br)cc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000589836150 1114847090 /nfs/dbraw/zinc/84/70/90/1114847090.db2.gz HLERECGZZDPKQJ-HNNXBMFYSA-N 2 0 369.347 4.059 20 0 FIADRP CCCc1nc(CN2CCC(C[N@H+](C)Cc3ccccc3)CC2)cs1 ZINC000590011789 1114873886 /nfs/dbraw/zinc/87/38/86/1114873886.db2.gz JKWSFLUADCSLME-UHFFFAOYSA-N 2 0 357.567 4.440 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000590787216 1114974128 /nfs/dbraw/zinc/97/41/28/1114974128.db2.gz VHROYIPFSDZJAW-UHFFFAOYSA-N 2 0 366.933 4.054 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590786737 1114974692 /nfs/dbraw/zinc/97/46/92/1114974692.db2.gz KSVSMNXEOJRWAB-LJQANCHMSA-N 2 0 373.585 4.498 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cn(C)nc2C(C)(C)C)cc1 ZINC000093947696 1115026762 /nfs/dbraw/zinc/02/67/62/1115026762.db2.gz JOIGCYFOSDHJET-SFHVURJKSA-N 2 0 368.569 4.382 20 0 FIADRP Cc1ccncc1CCC[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000573725764 1115178089 /nfs/dbraw/zinc/17/80/89/1115178089.db2.gz NTLFNMQDYLDYCM-UNMCSNQZSA-N 2 0 351.538 4.213 20 0 FIADRP CCc1noc(C)c1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000573867864 1115192961 /nfs/dbraw/zinc/19/29/61/1115192961.db2.gz JYQPPULGFZCSFY-IEIRFRATSA-N 2 0 367.537 4.326 20 0 FIADRP CC1(C)Cc2cccc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)c2O1 ZINC000606469669 1115947930 /nfs/dbraw/zinc/94/79/30/1115947930.db2.gz AFHGTVBEOSOQPE-UHFFFAOYSA-N 2 0 370.562 4.463 20 0 FIADRP Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000607143575 1116002845 /nfs/dbraw/zinc/00/28/45/1116002845.db2.gz QVGCPVDQLSVPSY-UHFFFAOYSA-N 2 0 363.452 4.241 20 0 FIADRP Cc1cccc2nc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)cn21 ZINC000534228176 1116173918 /nfs/dbraw/zinc/17/39/18/1116173918.db2.gz GATLKGLKANUDHQ-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CCOCC3)cc2)cc1 ZINC000535232337 1116283617 /nfs/dbraw/zinc/28/36/17/1116283617.db2.gz DEMIWMLGIXJRQR-GOSISDBHSA-N 2 0 370.562 4.482 20 0 FIADRP CCN(Cc1cc(OC)cc(C)n1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000535286136 1116290361 /nfs/dbraw/zinc/29/03/61/1116290361.db2.gz YONXTHZMBJKOJH-RXVVDRJESA-N 2 0 353.510 4.056 20 0 FIADRP CCN(Cc1cc(OC)cc(C)n1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000535286137 1116290469 /nfs/dbraw/zinc/29/04/69/1116290469.db2.gz YONXTHZMBJKOJH-WIYYLYMNSA-N 2 0 353.510 4.056 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000508856452 1116354787 /nfs/dbraw/zinc/35/47/87/1116354787.db2.gz MPYOKIJOSXKYOH-UHFFFAOYSA-N 2 0 366.553 4.175 20 0 FIADRP CCC[NH+]1CCC([NH2+]C2(c3ccc(Br)cc3)CCC2)CC1 ZINC000539626129 1116355768 /nfs/dbraw/zinc/35/57/68/1116355768.db2.gz PKOCKXDWQAAQCJ-UHFFFAOYSA-N 2 0 351.332 4.292 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CCn2ccnc2)c2ccc(F)c(F)c2)c1 ZINC000491281440 1116371319 /nfs/dbraw/zinc/37/13/19/1116371319.db2.gz AXAIKQMPMALFGA-LJQANCHMSA-N 2 0 359.445 4.262 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c(OC)c1 ZINC000539839585 1116386690 /nfs/dbraw/zinc/38/66/90/1116386690.db2.gz SHDQZLOVNSAPFW-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2OCC(F)(F)F)C1 ZINC000462681880 1116390070 /nfs/dbraw/zinc/39/00/70/1116390070.db2.gz WGPBQTXFWGQVIW-IAGOWNOFSA-N 2 0 372.475 4.475 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2=CCCOC2)c2ccc(F)cc2)CC1 ZINC000462803999 1117786423 /nfs/dbraw/zinc/78/64/23/1117786423.db2.gz BVBYDKXYNWGOFR-QFIPXVFZSA-N 2 0 360.517 4.315 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(-c2ccccc2)cc1 ZINC000540158414 1117903343 /nfs/dbraw/zinc/90/33/43/1117903343.db2.gz QUHVESKPOGMCKR-NWVWQQAFSA-N 2 0 364.533 4.382 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3ccccc32)[C@@H](C)C1 ZINC000540169452 1117912079 /nfs/dbraw/zinc/91/20/79/1117912079.db2.gz TUTMNJQGOOOFLU-WMZHIEFXSA-N 2 0 354.538 4.109 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000540170948 1117912200 /nfs/dbraw/zinc/91/22/00/1117912200.db2.gz NGLJQSCSCOHKIM-OWCLPIDISA-N 2 0 374.447 4.125 20 0 FIADRP COc1ccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@@H](C)O[C@H](C)C3)ccc2c1 ZINC000540171555 1117912737 /nfs/dbraw/zinc/91/27/37/1117912737.db2.gz RJOFTMNOKVAVGV-QRVBRYPASA-N 2 0 370.537 4.388 20 0 FIADRP Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540178852 1117923219 /nfs/dbraw/zinc/92/32/19/1117923219.db2.gz HQZIPQCHYAWGRM-DYESRHJHSA-N 2 0 354.494 4.028 20 0 FIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCCCn2c(C)nc3ccccc32)C1 ZINC000463096080 1117963975 /nfs/dbraw/zinc/96/39/75/1117963975.db2.gz GPQJYQDSMDRRMS-FQEVSTJZSA-N 2 0 356.558 4.179 20 0 FIADRP C[NH+](C)CC[C@@H]([NH2+]C1CCN(Cc2ccccc2Cl)CC1)C(C)(C)C ZINC000463124062 1117973559 /nfs/dbraw/zinc/97/35/59/1117973559.db2.gz MJCVMUOKIRLWHK-HXUWFJFHSA-N 2 0 365.993 4.260 20 0 FIADRP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cccc(OCc2ccccn2)c1 ZINC000540354098 1117998351 /nfs/dbraw/zinc/99/83/51/1117998351.db2.gz LETHXBGDORHPLX-NQIIRXRSSA-N 2 0 353.510 4.186 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCC[NH+]2CCCC2)ccc1OCc1ccccc1 ZINC000540354539 1117999012 /nfs/dbraw/zinc/99/90/12/1117999012.db2.gz OHKAYOXFQVKTNJ-LJQANCHMSA-N 2 0 368.521 4.411 20 0 FIADRP CC[C@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)Oc1ccccc1C(F)(F)F ZINC000540361131 1118014348 /nfs/dbraw/zinc/01/43/48/1118014348.db2.gz SVKGIGLYWAUGPA-QGZVFWFLSA-N 2 0 370.459 4.327 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000540418055 1118044858 /nfs/dbraw/zinc/04/48/58/1118044858.db2.gz TXQDGDQRDZSYSU-SJCJKPOMSA-N 2 0 369.372 4.163 20 0 FIADRP C[C@@H](Cc1ccsc1)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475940 1118076732 /nfs/dbraw/zinc/07/67/32/1118076732.db2.gz WOHNZSQBQKPVMS-LPHOPBHVSA-N 2 0 356.535 4.257 20 0 FIADRP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc3c(c2)ncn3C)CCN1Cc1ccccc1 ZINC000540482645 1118082068 /nfs/dbraw/zinc/08/20/68/1118082068.db2.gz AXFIFSDFLDTXFF-RXVVDRJESA-N 2 0 362.521 4.058 20 0 FIADRP C[NH+](C)CC1(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CCCC1 ZINC000463291669 1118087097 /nfs/dbraw/zinc/08/70/97/1118087097.db2.gz XROPDVRNUGJWHB-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP Cc1ccccc1CC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540495260 1118092023 /nfs/dbraw/zinc/09/20/23/1118092023.db2.gz SIZMGKVXARUZRG-NRFANRHFSA-N 2 0 350.506 4.115 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](CC2CCC2)c2ccccc2)C1 ZINC000540988118 1118339997 /nfs/dbraw/zinc/33/99/97/1118339997.db2.gz GKEMNGJJZGSXCX-ZEQRLZLVSA-N 2 0 364.533 4.274 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000540990144 1118340575 /nfs/dbraw/zinc/34/05/75/1118340575.db2.gz DOHYCVOUZAJYIY-CYFREDJKSA-N 2 0 366.549 4.447 20 0 FIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000540992652 1118341803 /nfs/dbraw/zinc/34/18/03/1118341803.db2.gz YIULYTOEUVHGRV-YLJYHZDGSA-N 2 0 370.562 4.216 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cn1 ZINC000491316103 1118479557 /nfs/dbraw/zinc/47/95/57/1118479557.db2.gz KBBKSPDDPMCVBN-FVJLSDCUSA-N 2 0 371.500 4.071 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000541738766 1118627534 /nfs/dbraw/zinc/62/75/34/1118627534.db2.gz OYIGZMXYUSVTNM-UMSONDCASA-N 2 0 369.578 4.445 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)C(C)(C)c1ccccc1 ZINC000541915165 1118706551 /nfs/dbraw/zinc/70/65/51/1118706551.db2.gz BAVGBTAOJLQHMC-AUSIDOKSSA-N 2 0 366.549 4.099 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000541917585 1118707859 /nfs/dbraw/zinc/70/78/59/1118707859.db2.gz AIEXBDGABZVLAC-SFHVURJKSA-N 2 0 365.521 4.482 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCc3c(Br)cccc32)CC1 ZINC000542156460 1118816423 /nfs/dbraw/zinc/81/64/23/1118816423.db2.gz ZBSYIWZYMNXBLY-GOSISDBHSA-N 2 0 351.332 4.291 20 0 FIADRP c1cn(-c2csc(C[NH2+][C@@H]3CCCc4cn(C5CCCC5)nc43)c2)cn1 ZINC000542309030 1118896433 /nfs/dbraw/zinc/89/64/33/1118896433.db2.gz DIHHLIMZGHRDGT-LJQANCHMSA-N 2 0 367.522 4.413 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)CC2 ZINC000492113861 1119027138 /nfs/dbraw/zinc/02/71/38/1119027138.db2.gz ZXSUQMXOUZMJFQ-QGZVFWFLSA-N 2 0 351.332 4.207 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000177306425 1119322740 /nfs/dbraw/zinc/32/27/40/1119322740.db2.gz ADCASENZKDFSTF-QFIPXVFZSA-N 2 0 365.521 4.050 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000311771336 1119388733 /nfs/dbraw/zinc/38/87/33/1119388733.db2.gz GOFACDYYTCHQQF-DHJUGAMNSA-N 2 0 350.506 4.183 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311859754 1119392921 /nfs/dbraw/zinc/39/29/21/1119392921.db2.gz UXICNPXCASZHOC-CNNODRBYSA-N 2 0 352.522 4.126 20 0 FIADRP CC[NH+](CC)[C@@H](CNC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000312097298 1119400128 /nfs/dbraw/zinc/40/01/28/1119400128.db2.gz CLCASANTGZJMEO-DEOSSOPVSA-N 2 0 365.565 4.324 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccsc2)CC1 ZINC000178770724 1119407895 /nfs/dbraw/zinc/40/78/95/1119407895.db2.gz KYNAIGVDSYYJBT-HZPDHXFCSA-N 2 0 361.530 4.441 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000493884487 1119502987 /nfs/dbraw/zinc/50/29/87/1119502987.db2.gz YEJCEYWWTCUQKI-ZHNGQKSSSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 ZINC000493934908 1119511888 /nfs/dbraw/zinc/51/18/88/1119511888.db2.gz GZIBMBSDYPZAJW-KVJIRVJXSA-N 2 0 354.538 4.108 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCOC5(CCCC5)C4)[C@@H]3C2)cc1 ZINC000183154132 1119566927 /nfs/dbraw/zinc/56/69/27/1119566927.db2.gz FSSFORPZGSYMIX-AFXVXQJMSA-N 2 0 368.565 4.369 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000185552978 1119671460 /nfs/dbraw/zinc/67/14/60/1119671460.db2.gz FCOMTCZIEPSXKJ-UHFFFAOYSA-N 2 0 354.425 4.046 20 0 FIADRP CCSc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000185623514 1119677028 /nfs/dbraw/zinc/67/70/28/1119677028.db2.gz DTBZMTNJSQMWCX-NRFANRHFSA-N 2 0 370.562 4.045 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000186564803 1119736271 /nfs/dbraw/zinc/73/62/71/1119736271.db2.gz VDFJUUSZLOPUNV-ROUUACIJSA-N 2 0 357.567 4.092 20 0 FIADRP CC1(C)CC([NH2+][C@H]2CCc3c2cccc3Br)CC(C)(C)[NH2+]1 ZINC000223016826 1119929063 /nfs/dbraw/zinc/92/90/63/1119929063.db2.gz SKYSZEGWPFGMAX-INIZCTEOSA-N 2 0 351.332 4.335 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1csc(Cl)c1 ZINC000191491869 1119979529 /nfs/dbraw/zinc/97/95/29/1119979529.db2.gz AEWWCYJONUAALL-RDTXWAMCSA-N 2 0 364.942 4.209 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000191607343 1119986823 /nfs/dbraw/zinc/98/68/23/1119986823.db2.gz PKSZMTUFDMEZAK-OAHLLOKOSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccccc2F)CC1 ZINC001168467179 1119996349 /nfs/dbraw/zinc/99/63/49/1119996349.db2.gz GRCRQBAFXJOISV-KRWDZBQOSA-N 2 0 358.476 4.398 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(F)c(F)c1F ZINC000542500505 1120227481 /nfs/dbraw/zinc/22/74/81/1120227481.db2.gz ZGFSJQRGLHBWSF-KXBFYZLASA-N 2 0 362.439 4.147 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494891607 1120359184 /nfs/dbraw/zinc/35/91/84/1120359184.db2.gz QLUSPRISNMCVPB-DXIQSLLYSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3sccc3Cl)CC2)C[C@@H](C)O1 ZINC000494985583 1120411639 /nfs/dbraw/zinc/41/16/39/1120411639.db2.gz LGEZONBEELVOLY-HUUCEWRRSA-N 2 0 356.963 4.113 20 0 FIADRP C[C@H]([NH2+]CCc1cccc(OC(F)(F)F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542533265 1120431070 /nfs/dbraw/zinc/43/10/70/1120431070.db2.gz KXLAJIIEBCQYKG-DOTOQJQBSA-N 2 0 370.459 4.370 20 0 FIADRP C[NH+]1CCC(CC[NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000229935845 1120531870 /nfs/dbraw/zinc/53/18/70/1120531870.db2.gz WYUBAWFEGAXDRB-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495380980 1120767921 /nfs/dbraw/zinc/76/79/21/1120767921.db2.gz TXVRJVQADCGNPC-JLMWRMLUSA-N 2 0 350.506 4.183 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)Cc1ccc(Br)cc1 ZINC000233448313 1120865325 /nfs/dbraw/zinc/86/53/25/1120865325.db2.gz NMCUOZCKLJDDPB-HOTGVXAUSA-N 2 0 355.364 4.480 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccccc3F)CC2)cc1 ZINC000495673494 1120926310 /nfs/dbraw/zinc/92/63/10/1120926310.db2.gz ZFMLHSSANJLMCN-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP COc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c(-c2ccccc2)cc1OC ZINC000237422203 1120977323 /nfs/dbraw/zinc/97/73/23/1120977323.db2.gz FMMIMCBJTTWVHE-GOSISDBHSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000542668154 1121163352 /nfs/dbraw/zinc/16/33/52/1121163352.db2.gz FRFQGTOUWIPVOE-SFHVURJKSA-N 2 0 357.567 4.093 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397664192 1121272183 /nfs/dbraw/zinc/27/21/83/1121272183.db2.gz FFFJXXSOHMSICW-GOSISDBHSA-N 2 0 370.562 4.086 20 0 FIADRP C[NH+](C)CCOc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000670272340 1121298915 /nfs/dbraw/zinc/29/89/15/1121298915.db2.gz VIQWGKNOIHFAJF-GOSISDBHSA-N 2 0 370.459 4.182 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000123563876 1121614139 /nfs/dbraw/zinc/61/41/39/1121614139.db2.gz DXGZTJNSBQFSJT-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3[nH]c(=O)oc3c2)c1 ZINC000671744369 1121657736 /nfs/dbraw/zinc/65/77/36/1121657736.db2.gz XREYRTZERAFFRV-HNNXBMFYSA-N 2 0 353.466 4.224 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(OCc2ccccc2)cc1 ZINC000124371278 1121688876 /nfs/dbraw/zinc/68/88/76/1121688876.db2.gz CJIXSNUJQPZDRR-QUCCMNQESA-N 2 0 350.506 4.401 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(OCc2ccccc2)cc1 ZINC000124371037 1121689139 /nfs/dbraw/zinc/68/91/39/1121689139.db2.gz CJIXSNUJQPZDRR-ICSRJNTNSA-N 2 0 350.506 4.401 20 0 FIADRP C[C@H](c1ccccc1)[C@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671752427 1121734954 /nfs/dbraw/zinc/73/49/54/1121734954.db2.gz XOZUJGLQHINZPU-RFRZSCIPSA-N 2 0 366.549 4.184 20 0 FIADRP CCCN(C)[C@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764441 1121798422 /nfs/dbraw/zinc/79/84/22/1121798422.db2.gz IWQIVHGFKUOXPP-OXQOHEQNSA-N 2 0 351.966 4.043 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)CCO2)cc1 ZINC001168597471 1121805811 /nfs/dbraw/zinc/80/58/11/1121805811.db2.gz BDCXCVBMAPFEOK-RQIDZSJNSA-N 2 0 360.542 4.049 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000126281421 1121941570 /nfs/dbraw/zinc/94/15/70/1121941570.db2.gz NTFQATIGRLCDJQ-KRWDZBQOSA-N 2 0 359.514 4.258 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126663279 1121973751 /nfs/dbraw/zinc/97/37/51/1121973751.db2.gz UTYHKTQBOOAEJV-YCRPNKLZSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)c(F)c3)cc2)C1 ZINC000917008507 1122000338 /nfs/dbraw/zinc/00/03/38/1122000338.db2.gz KUSABSRGESQXPO-KSFYIVLOSA-N 2 0 374.475 4.020 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215394 1122062890 /nfs/dbraw/zinc/06/28/90/1122062890.db2.gz XVQFCXSAFQJFKT-GOSISDBHSA-N 2 0 353.510 4.436 20 0 FIADRP CCC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000127328953 1122078919 /nfs/dbraw/zinc/07/89/19/1122078919.db2.gz HOIFANMSLUSUCM-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)CCO2)cc1 ZINC001168616003 1122100670 /nfs/dbraw/zinc/10/06/70/1122100670.db2.gz QEERKWQTBIGAJH-FYYLOGMGSA-N 2 0 372.553 4.160 20 0 FIADRP COCCC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000282287242 1122229520 /nfs/dbraw/zinc/22/95/20/1122229520.db2.gz LLLJYBJDYMUNCK-NRFANRHFSA-N 2 0 362.464 4.284 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+]C2c3ccccc3-c3ccccc32)c1 ZINC000497537097 1122275515 /nfs/dbraw/zinc/27/55/15/1122275515.db2.gz JWDUMHKJFHJGMN-UHFFFAOYSA-N 2 0 358.485 4.487 20 0 FIADRP C[C@H]([NH2+]C1(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000497593056 1122301180 /nfs/dbraw/zinc/30/11/80/1122301180.db2.gz WNPKVYUKGWPVLX-FPOVZHCZSA-N 2 0 371.569 4.031 20 0 FIADRP CCC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000128556196 1122342407 /nfs/dbraw/zinc/34/24/07/1122342407.db2.gz SRNMYRAMNNAJFH-LJQANCHMSA-N 2 0 371.491 4.164 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000262664763 1122413288 /nfs/dbraw/zinc/41/32/88/1122413288.db2.gz ISWTVRMLBVHAOU-FGSXEWAUSA-N 2 0 365.521 4.193 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497855078 1122441290 /nfs/dbraw/zinc/44/12/90/1122441290.db2.gz WLJXMVSTBGCJPI-OAQYLSRUSA-N 2 0 357.542 4.136 20 0 FIADRP CN1CC[C@H]([NH2+]CCc2c[nH]c3ccc(F)cc23)C[C@@H]1c1ccccc1 ZINC000556094302 1122648176 /nfs/dbraw/zinc/64/81/76/1122648176.db2.gz WNMUSVOIXOZIFD-SIKLNZKXSA-N 2 0 351.469 4.275 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@H]3C3CC3)C3(C2)CCOCC3)cc1 ZINC000556233533 1122750385 /nfs/dbraw/zinc/75/03/85/1122750385.db2.gz QJHWRGCRBSRDQZ-RJGXRXQPSA-N 2 0 368.565 4.084 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(Cl)s1 ZINC000498483612 1122828830 /nfs/dbraw/zinc/82/88/30/1122828830.db2.gz JTXFJNMNYMXRPS-AWEZNQCLSA-N 2 0 352.931 4.235 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc(Cl)ccc3F)cc2)CC1 ZINC000556408127 1122874362 /nfs/dbraw/zinc/87/43/62/1122874362.db2.gz VXQYHZAHXRHXBA-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556868724 1123149688 /nfs/dbraw/zinc/14/96/88/1123149688.db2.gz BMLHNFLWICWXPQ-HSALFYBXSA-N 2 0 355.551 4.232 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CCc1nccn1Cc1ccccc1)CCCO2 ZINC000132145900 1123222650 /nfs/dbraw/zinc/22/26/50/1123222650.db2.gz IHBRENVZKXNRLM-FQEVSTJZSA-N 2 0 365.452 4.117 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(Oc3ccccc3)nn2)CC1 ZINC000499103500 1123249419 /nfs/dbraw/zinc/24/94/19/1123249419.db2.gz VHVDAVMXNDNAOH-UHFFFAOYSA-N 2 0 368.525 4.213 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499138057 1123279468 /nfs/dbraw/zinc/27/94/68/1123279468.db2.gz BSNZRCCHNDHVIG-DKUWSORSSA-N 2 0 350.506 4.371 20 0 FIADRP C[C@@H]1CCC[N@@H+](C(C)(C)CN[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499145495 1123286558 /nfs/dbraw/zinc/28/65/58/1123286558.db2.gz HDYNTLWATNIGCA-ADHNFCLRSA-N 2 0 369.597 4.282 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499144745 1123287363 /nfs/dbraw/zinc/28/73/63/1123287363.db2.gz XXLDIIADNBBAQY-PESUVLPXSA-N 2 0 369.597 4.140 20 0 FIADRP CC(C)[NH+]1CCC(C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)CC1 ZINC000556998622 1123305502 /nfs/dbraw/zinc/30/55/02/1123305502.db2.gz ACZIXJJXPLJOBH-UHFFFAOYSA-N 2 0 371.569 4.020 20 0 FIADRP Fc1ccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499249031 1123357570 /nfs/dbraw/zinc/35/75/70/1123357570.db2.gz ZUCSQRHCKHQAGB-ACDBMABISA-N 2 0 372.459 4.129 20 0 FIADRP Clc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCCC2 ZINC000132980025 1123394070 /nfs/dbraw/zinc/39/40/70/1123394070.db2.gz TWRDHVRXXZWWRN-HRAATJIYSA-N 2 0 362.945 4.198 20 0 FIADRP CC[C@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C1 ZINC000237077636 1123593749 /nfs/dbraw/zinc/59/37/49/1123593749.db2.gz HTUVPGWDTOABBD-FPOVZHCZSA-N 2 0 374.569 4.235 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2nnc(-c3cccc(C)c3)o2)CC1 ZINC000921231362 1123593834 /nfs/dbraw/zinc/59/38/34/1123593834.db2.gz YJAHRPZIZJVFCB-KRWDZBQOSA-N 2 0 356.514 4.160 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccn3)s2)CC1 ZINC000134177122 1123600458 /nfs/dbraw/zinc/60/04/58/1123600458.db2.gz VQCOUYJDSCJEHA-UHFFFAOYSA-N 2 0 358.555 4.149 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2F)c1 ZINC000079307383 1123874018 /nfs/dbraw/zinc/87/40/18/1123874018.db2.gz LEJGWAHNIPYIRD-KRWDZBQOSA-N 2 0 371.500 4.093 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)Nc1ccccc1 ZINC000615314851 1123988795 /nfs/dbraw/zinc/98/87/95/1123988795.db2.gz JAUCWYQIEPJIPO-OALUTQOASA-N 2 0 365.521 4.178 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(C)c(C)c2)c1 ZINC000615324189 1123989768 /nfs/dbraw/zinc/98/97/68/1123989768.db2.gz HJTOHTBYYZXMAR-IBGZPJMESA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@H]([NH3+])c2ccccc2)cc1 ZINC000263368987 1124029820 /nfs/dbraw/zinc/02/98/20/1124029820.db2.gz XJBCYXNBYOJVKQ-UTKZUKDTSA-N 2 0 351.494 4.090 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245636988 1124154133 /nfs/dbraw/zinc/15/41/33/1124154133.db2.gz AAABSJJGQQEPSN-BKFWDETESA-N 2 0 369.597 4.284 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245650706 1124166347 /nfs/dbraw/zinc/16/63/47/1124166347.db2.gz CNHDYIIOFQGEGT-HWHRFOGPSA-N 2 0 364.533 4.499 20 0 FIADRP CN(C)[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccs1 ZINC000245754474 1124241646 /nfs/dbraw/zinc/24/16/46/1124241646.db2.gz UPDBWZHKOGZTQE-BURNTYAHSA-N 2 0 369.578 4.136 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000542775315 1124252448 /nfs/dbraw/zinc/25/24/48/1124252448.db2.gz UCDUUKOXBMAMIZ-VMSMKEMKSA-N 2 0 363.549 4.144 20 0 FIADRP CCO[C@@H]1C[C@H]([NH2+]C2CCN([C@H](C)c3ccncc3)CC2)C1(CC)CC ZINC000245843412 1124261481 /nfs/dbraw/zinc/26/14/81/1124261481.db2.gz DXMHYXMAECIDAO-JRGCBEDISA-N 2 0 359.558 4.180 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1ccccn1 ZINC000245845410 1124261930 /nfs/dbraw/zinc/26/19/30/1124261930.db2.gz CAFMCZNSBPDZMH-IPJJNNNSSA-N 2 0 367.537 4.322 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)c1ccc2ccccc2c1 ZINC000765881158 1124326436 /nfs/dbraw/zinc/32/64/36/1124326436.db2.gz NMYMKODQZMAEFV-BTZRARBUSA-N 2 0 374.528 4.373 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[NH+]1CCCCCC1 ZINC000303718026 1124460267 /nfs/dbraw/zinc/46/02/67/1124460267.db2.gz RCGSDDWOSPZGRU-LJQANCHMSA-N 2 0 357.542 4.122 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(OC(F)F)c2)[C@H](C)C1 ZINC000246844091 1124566336 /nfs/dbraw/zinc/56/63/36/1124566336.db2.gz CGWVNQMMIFGUCT-MDZRGWNJSA-N 2 0 370.484 4.076 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1CN[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247018926 1124582383 /nfs/dbraw/zinc/58/23/83/1124582383.db2.gz LRXCPYHSDMVZSG-HKUYNNGSSA-N 2 0 369.509 4.235 20 0 FIADRP CSc1cc(C)ccc1C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000247104443 1124590417 /nfs/dbraw/zinc/59/04/17/1124590417.db2.gz OVHLOBZWAPOUAW-XLIONFOSSA-N 2 0 355.551 4.112 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)C1 ZINC000247204580 1124598671 /nfs/dbraw/zinc/59/86/71/1124598671.db2.gz WMVSWWYAYKREHW-QAPCUYQASA-N 2 0 371.550 4.128 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000765922252 1124611831 /nfs/dbraw/zinc/61/18/31/1124611831.db2.gz WYJBGKYEEMIFHK-INIZCTEOSA-N 2 0 359.901 4.060 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@H](c3ccco3)[NH+]3CCCC3)CC2)C1 ZINC000248046729 1124739005 /nfs/dbraw/zinc/73/90/05/1124739005.db2.gz VGXSBUZBNQUZEA-HLAWJBBLSA-N 2 0 359.558 4.049 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248395278 1124759763 /nfs/dbraw/zinc/75/97/63/1124759763.db2.gz GEMFAJHZLWHZTL-NSHGMRRFSA-N 2 0 352.526 4.176 20 0 FIADRP COCCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248403058 1124762660 /nfs/dbraw/zinc/76/26/60/1124762660.db2.gz OBDOUBSSFBSIHD-NSHGMRRFSA-N 2 0 360.542 4.015 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(C)s1 ZINC000248464589 1124774322 /nfs/dbraw/zinc/77/43/22/1124774322.db2.gz ZMGYSZQSQMRHEL-UZLBHIALSA-N 2 0 358.551 4.172 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000249579460 1124866435 /nfs/dbraw/zinc/86/64/35/1124866435.db2.gz NBECPCHCXZEEEX-PXNSSMCTSA-N 2 0 370.562 4.216 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C2CCC2)cc1 ZINC000249875586 1124883731 /nfs/dbraw/zinc/88/37/31/1124883731.db2.gz GVKGZISPZPPPQK-RPWUZVMVSA-N 2 0 364.533 4.193 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000090468922 1124998168 /nfs/dbraw/zinc/99/81/68/1124998168.db2.gz XDHXRCLNGQKWLH-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(-c2ccccc2)o1 ZINC000090936918 1125028333 /nfs/dbraw/zinc/02/83/33/1125028333.db2.gz YELHPWIFACMYOC-QGZVFWFLSA-N 2 0 365.477 4.133 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285599 1125062357 /nfs/dbraw/zinc/06/23/57/1125062357.db2.gz ZIBDMCHFEGEQOX-LPHOPBHVSA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)C1CCCC1 ZINC000091343536 1125067390 /nfs/dbraw/zinc/06/73/90/1125067390.db2.gz HWIHFHSBTVYVNV-FDDCHVKYSA-N 2 0 372.553 4.017 20 0 FIADRP C[C@@H](C[NH2+][C@@H](c1cccc(Cl)c1)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000543012754 1125325087 /nfs/dbraw/zinc/32/50/87/1125325087.db2.gz VSYVRFANODRYEX-LAUBAEHRSA-N 2 0 363.977 4.187 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)ccc1OCc1cccs1 ZINC000062427114 567952217 /nfs/dbraw/zinc/95/22/17/567952217.db2.gz MFHJLPABODSMNK-SFHVURJKSA-N 2 0 374.550 4.156 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ncc(Br)cc1F ZINC000187010870 568044452 /nfs/dbraw/zinc/04/44/52/568044452.db2.gz WCQOLIVQUUFHNC-KBPBESRZSA-N 2 0 372.326 4.146 20 0 FIADRP C[C@H]1C[N@H+](CCCNc2cc[nH+]c3cc(C(F)(F)F)ccc23)CCCO1 ZINC000432876920 568478454 /nfs/dbraw/zinc/47/84/54/568478454.db2.gz HQXJVOCOEPCXSB-AWEZNQCLSA-N 2 0 367.415 4.166 20 0 FIADRP CN1CCC[C@H](C[NH2+]Cc2ccncc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605165437 568593828 /nfs/dbraw/zinc/59/38/28/568593828.db2.gz BRFZNWCVWXGTGI-IEBWSBKVSA-N 2 0 363.427 4.273 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OC)c(C[NH+]3CCCCC3)c2)C1 ZINC000182564277 1125560680 /nfs/dbraw/zinc/56/06/80/1125560680.db2.gz XJKOGPALSFUEKW-PMACEKPBSA-N 3 0 373.585 4.064 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)C2CCOCC2)cc1C[NH+]1CCCCC1 ZINC000183130438 1125754625 /nfs/dbraw/zinc/75/46/25/1125754625.db2.gz NTMSXBFVVKSFCK-ZWKOTPCHSA-N 2 0 360.542 4.147 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)C2CCOCC2)cc1C[NH+]1CCCCC1 ZINC000183130418 1125754887 /nfs/dbraw/zinc/75/48/87/1125754887.db2.gz NTMSXBFVVKSFCK-ROUUACIJSA-N 2 0 360.542 4.147 20 0 FIADRP c1ccc(CC[NH+]2CCC(NC3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000153239407 1125763219 /nfs/dbraw/zinc/76/32/19/1125763219.db2.gz LTBDYLRSSJWMBX-UHFFFAOYSA-N 2 0 369.597 4.080 20 0 FIADRP Cc1nccn1C[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1cccc2Br ZINC000557263590 1079659160 /nfs/dbraw/zinc/65/91/60/1079659160.db2.gz XKTPMAYQYFKVMD-PBFPGSCMSA-N 2 0 362.315 4.428 20 0 FIADRP CCOc1cc(C[NH2+][C@@]23CC[C@@]([NH2+]C)(C2)CCC3)ccc1Br ZINC001279365386 1080294416 /nfs/dbraw/zinc/29/44/16/1080294416.db2.gz ALURGCHUDIAWNS-MSOLQXFVSA-N 2 0 367.331 4.002 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CC1CCC(c2ccccc2)CC1 ZINC000547743965 1080373689 /nfs/dbraw/zinc/37/36/89/1080373689.db2.gz DBHUTXHPHSIVKV-RIYCBMTJSA-N 2 0 356.554 4.144 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000180460122 1080502124 /nfs/dbraw/zinc/50/21/24/1080502124.db2.gz XQTBPIHLCTWRSL-FQEVSTJZSA-N 2 0 360.448 4.309 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Cl)cc1 ZINC000180641413 1080531742 /nfs/dbraw/zinc/53/17/42/1080531742.db2.gz INDRUXXDXQPIQO-LEWJYISDSA-N 2 0 358.913 4.148 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000236636426 1080884226 /nfs/dbraw/zinc/88/42/26/1080884226.db2.gz XNJOPOSPGZUCAR-JOCHJYFZSA-N 2 0 365.521 4.337 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(C)c1 ZINC000137568409 1080983301 /nfs/dbraw/zinc/98/33/01/1080983301.db2.gz GYNYUCMUHSLYMX-OAQYLSRUSA-N 2 0 371.569 4.281 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000160295963 1081014025 /nfs/dbraw/zinc/01/40/25/1081014025.db2.gz XPGWJKJCAKLEIW-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP c1csc(C([NH2+]C2CCN(C[C@H]3CCCO3)CC2)c2cccs2)c1 ZINC000655729569 1081147298 /nfs/dbraw/zinc/14/72/98/1081147298.db2.gz KLOROOCZNCAEPG-MRXNPFEDSA-N 2 0 362.564 4.132 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000655805036 1081211365 /nfs/dbraw/zinc/21/13/65/1081211365.db2.gz JIHNFJDRMSEMPB-IETSOEAISA-N 2 0 357.723 4.020 20 0 FIADRP FC(F)(F)Oc1cccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000655820805 1081232184 /nfs/dbraw/zinc/23/21/84/1081232184.db2.gz LYBTVNYICCQRNX-DLBZAZTESA-N 2 0 368.443 4.223 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)C1 ZINC000655826116 1081233707 /nfs/dbraw/zinc/23/37/07/1081233707.db2.gz QKBNDACVVDWNNE-AKAXFMLLSA-N 2 0 363.299 4.139 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+][C@@H]2CCCN3CCCC[C@H]23)cc1 ZINC000655848504 1081257398 /nfs/dbraw/zinc/25/73/98/1081257398.db2.gz GFYYRULWEBSGFA-IOMROCGXSA-N 2 0 372.557 4.228 20 0 FIADRP CCSc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccn1 ZINC000547979459 1081315368 /nfs/dbraw/zinc/31/53/68/1081315368.db2.gz QYUKPSSLLQGEJC-FXAWDEMLSA-N 2 0 355.551 4.194 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[NH+](C)C ZINC000579986271 1081371249 /nfs/dbraw/zinc/37/12/49/1081371249.db2.gz XNFHXIZNXJDNHG-ZXHYAQOVSA-N 2 0 365.565 4.411 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4cccc5cccnc54)C[C@H]3C2)cc1 ZINC000312614225 1081459501 /nfs/dbraw/zinc/45/95/01/1081459501.db2.gz GEBXRVCSAWITEM-JTHBVZDNSA-N 2 0 357.501 4.189 20 0 FIADRP C[C@H](O)[C@@H]1CCCC[N@@H+]1C[C@@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167337095 1081469943 /nfs/dbraw/zinc/46/99/43/1081469943.db2.gz GZGCQRXXCLRXHP-ZTCOLXNVSA-N 2 0 366.549 4.138 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCc2cnccn2)c2ccc(F)cc2)CC1 ZINC000580221527 1081757794 /nfs/dbraw/zinc/75/77/94/1081757794.db2.gz KDQIEOUUVZVPFA-JOCHJYFZSA-N 2 0 370.516 4.001 20 0 FIADRP CCC[C@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471611260 1082093993 /nfs/dbraw/zinc/09/39/93/1082093993.db2.gz BRPNZCZRWSLEDF-BEFAXECRSA-N 2 0 372.384 4.450 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398201904 1082116115 /nfs/dbraw/zinc/11/61/15/1082116115.db2.gz PXNDEWGKKDHYMU-AUSIDOKSSA-N 2 0 352.522 4.476 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000430549270 1082435688 /nfs/dbraw/zinc/43/56/88/1082435688.db2.gz IHWAUFRWJKKWCA-AZUAARDMSA-N 2 0 360.505 4.099 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000430549277 1082435764 /nfs/dbraw/zinc/43/57/64/1082435764.db2.gz IHWAUFRWJKKWCA-UYAOXDASSA-N 2 0 360.505 4.099 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000548172569 1082577708 /nfs/dbraw/zinc/57/77/08/1082577708.db2.gz RZNJRQGCCUFRFO-UHFFFAOYSA-N 2 0 367.537 4.309 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)C[C@@H](C)c2cccc(Br)c2)CC1 ZINC000510434807 1082701919 /nfs/dbraw/zinc/70/19/19/1082701919.db2.gz GWBVXVIDUOJPEA-OAHLLOKOSA-N 2 0 353.348 4.359 20 0 FIADRP Fc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)cc1 ZINC000656786976 1082771610 /nfs/dbraw/zinc/77/16/10/1082771610.db2.gz YTNKYLGPPNNLNK-QGZVFWFLSA-N 2 0 359.514 4.161 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c2ccccc21 ZINC000558970667 1082823658 /nfs/dbraw/zinc/82/36/58/1082823658.db2.gz PZOQJXRMPTVPSR-AABGKKOBSA-N 2 0 360.542 4.124 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccccc3OC(F)F)CC2)C1 ZINC000471781750 1082983535 /nfs/dbraw/zinc/98/35/35/1082983535.db2.gz RJKYSDFLFMYQJB-QFBILLFUSA-N 2 0 366.496 4.463 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2nc3ccccc3s2)CC1 ZINC000581911417 1083023333 /nfs/dbraw/zinc/02/33/33/1083023333.db2.gz STOSSTWNIFXOAD-VQIMIIECSA-N 2 0 357.567 4.472 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000430758102 1083146057 /nfs/dbraw/zinc/14/60/57/1083146057.db2.gz YZBXQAQJWXFOCM-BXPDPKNNSA-N 2 0 369.322 4.153 20 0 FIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000510685266 1083238064 /nfs/dbraw/zinc/23/80/64/1083238064.db2.gz KLMZZHUXKHWSQH-MRXNPFEDSA-N 2 0 359.464 4.187 20 0 FIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1Cl ZINC000510739273 1083288520 /nfs/dbraw/zinc/28/85/20/1083288520.db2.gz XBLLKBYCOVIBGQ-KSZLIROESA-N 2 0 350.934 4.412 20 0 FIADRP C[C@@H]1[C@H](C(F)(F)F)CC[NH+]1CCCC[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000548427665 1083297855 /nfs/dbraw/zinc/29/78/55/1083297855.db2.gz XGNFURTYHORUTP-XJFOESAGSA-N 2 0 360.386 4.312 20 0 FIADRP C[C@H](c1ccccc1)[C@H](O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000658339388 1083415742 /nfs/dbraw/zinc/41/57/42/1083415742.db2.gz JTTDAQOBKHZTMN-DLQXEOFGSA-N 2 0 366.549 4.184 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2ccccn2)cc1 ZINC000658352927 1083423727 /nfs/dbraw/zinc/42/37/27/1083423727.db2.gz AFKLVZQTXVMORI-JOCHJYFZSA-N 2 0 353.485 4.022 20 0 FIADRP Brc1cc2c(s1)CC[C@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353562 1083425672 /nfs/dbraw/zinc/42/56/72/1083425672.db2.gz OVDQTBYGEOYOHL-OAHLLOKOSA-N 2 0 369.372 4.210 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCNc2ccccc21 ZINC000192682955 1083511000 /nfs/dbraw/zinc/51/10/00/1083511000.db2.gz MCNZTCKSURZICL-QFIPXVFZSA-N 2 0 367.537 4.444 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccc(F)c2)s1 ZINC000535807965 1083693818 /nfs/dbraw/zinc/69/38/18/1083693818.db2.gz KKAUJRGCUBGBLF-HOJAQTOUSA-N 2 0 374.525 4.238 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000181323640 1083865652 /nfs/dbraw/zinc/86/56/52/1083865652.db2.gz QPOXMXQRYIWFIJ-IIBYNOLFSA-N 2 0 372.484 4.331 20 0 FIADRP C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177489947 1083999930 /nfs/dbraw/zinc/99/99/30/1083999930.db2.gz FHEAFNSXRZKUPE-AEFFLSMTSA-N 2 0 367.578 4.017 20 0 FIADRP c1cn(-c2csc(C[NH2+]C[C@@H]3CCCO[C@H]3c3ccccc3)c2)cn1 ZINC001648924803 1084002975 /nfs/dbraw/zinc/00/29/75/1084002975.db2.gz SPEDUVFSSVZBLX-PXNSSMCTSA-N 2 0 353.491 4.191 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(Br)c3)CCCC2)CC[N@@H+]1C ZINC000537959507 1084108912 /nfs/dbraw/zinc/10/89/12/1084108912.db2.gz KCALMRIRDLESNT-YJBOKZPZSA-N 2 0 365.359 4.333 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000570474953 1084178025 /nfs/dbraw/zinc/17/80/25/1084178025.db2.gz RJAXKRAGKXZCOC-OXQOHEQNSA-N 2 0 370.940 4.138 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2cccc(Cl)c2)c1 ZINC000511016171 1084187187 /nfs/dbraw/zinc/18/71/87/1084187187.db2.gz ONKFVTFWJKTIDB-INIZCTEOSA-N 2 0 373.928 4.299 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000163300614 1084214438 /nfs/dbraw/zinc/21/44/38/1084214438.db2.gz GYHYKHRJQRIEBO-RHSMWYFYSA-N 2 0 359.514 4.258 20 0 FIADRP CCn1nc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c2ccccc21 ZINC000472079114 1084250883 /nfs/dbraw/zinc/25/08/83/1084250883.db2.gz GIGDYPCBMMUWHB-UHFFFAOYSA-N 2 0 354.542 4.189 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3c(C4CCC4)cnn3C)cc2)CC1 ZINC000657298382 1084309079 /nfs/dbraw/zinc/30/90/79/1084309079.db2.gz NOCJQNHQDNZPFM-UHFFFAOYSA-N 2 0 366.553 4.209 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NCc2ccnn2-c2cc[nH+]cc2)cc1 ZINC000657320279 1084540622 /nfs/dbraw/zinc/54/06/22/1084540622.db2.gz CDHIFTAPIFSZGP-GOSISDBHSA-N 2 0 361.493 4.254 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511479010 1084589541 /nfs/dbraw/zinc/58/95/41/1084589541.db2.gz HADSOFXVCQEPAG-UHFFFAOYSA-N 2 0 354.542 4.159 20 0 FIADRP COc1ccc([C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccc(F)cc2)cc1 ZINC000414191430 1084775382 /nfs/dbraw/zinc/77/53/82/1084775382.db2.gz RWYKEDIKKRPDBM-VGOFRKELSA-N 2 0 356.485 4.245 20 0 FIADRP CCC[C@H](O)C[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000559893826 1084907955 /nfs/dbraw/zinc/90/79/55/1084907955.db2.gz MDHVJXOJKIRZOO-LEWJYISDSA-N 2 0 350.522 4.130 20 0 FIADRP c1n[nH]cc1[C@H]1CCCC[NH+]1CCCCC[N@@H+]1CCCC[C@@H]1c1cn[nH]c1 ZINC000158160532 1084928910 /nfs/dbraw/zinc/92/89/10/1084928910.db2.gz IBVHCQJHTOVXGA-NHCUHLMSSA-N 2 0 370.545 4.057 20 0 FIADRP COCC[C@@H](Cc1ccco1)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582486516 1085063288 /nfs/dbraw/zinc/06/32/88/1085063288.db2.gz MMTBVBQFADEVRA-SFTDATJTSA-N 2 0 368.521 4.014 20 0 FIADRP CO[C@H](C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000549065106 1085067690 /nfs/dbraw/zinc/06/76/90/1085067690.db2.gz HZKAGCTVYCNFMN-JOCHJYFZSA-N 2 0 353.510 4.008 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000511146765 1085087801 /nfs/dbraw/zinc/08/78/01/1085087801.db2.gz QKQYNTOZEJQBBE-GZTJUZNOSA-N 2 0 356.485 4.227 20 0 FIADRP COCc1csc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000657470978 1085162820 /nfs/dbraw/zinc/16/28/20/1085162820.db2.gz XOIJFOIUHFGHRC-IBGZPJMESA-N 2 0 358.551 4.286 20 0 FIADRP Cn1cnc(C[N@@H+]2CCCCC[C@H]2C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000660765243 1085260023 /nfs/dbraw/zinc/26/00/23/1085260023.db2.gz UWMDBXJIEWILKE-QHCPKHFHSA-N 2 0 366.553 4.077 20 0 FIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)C1 ZINC001167601287 1085413171 /nfs/dbraw/zinc/41/31/71/1085413171.db2.gz APJGDNIVZNYRME-SFHVURJKSA-N 2 0 368.949 4.060 20 0 FIADRP C[C@@H](Nc1c[nH+]ccc1N1CC[NH+](C)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651744906 1085438984 /nfs/dbraw/zinc/43/89/84/1085438984.db2.gz TWAAMJLOMCMQNA-GOSISDBHSA-N 2 0 373.504 4.069 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000582757829 1085679792 /nfs/dbraw/zinc/67/97/92/1085679792.db2.gz WAPHWCVBNZZKAF-MTLXSTRDSA-N 2 0 350.453 4.107 20 0 FIADRP Cc1cc2cc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)oc2cc1C ZINC000657612613 1085689996 /nfs/dbraw/zinc/68/99/96/1085689996.db2.gz BDQMQGVECUUEDK-UHFFFAOYSA-N 2 0 363.505 4.446 20 0 FIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)c1 ZINC000657613726 1085699679 /nfs/dbraw/zinc/69/96/79/1085699679.db2.gz PYLJUQIYBFOHJW-FYYLOGMGSA-N 2 0 364.537 4.005 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)C[C@@H]2CCCN2C(=O)OC(C)(C)C)CC1 ZINC000236761552 1085937917 /nfs/dbraw/zinc/93/79/17/1085937917.db2.gz QCRJWRGIEKQWPV-HKUYNNGSSA-N 2 0 367.578 4.019 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1 ZINC000248445614 1086169762 /nfs/dbraw/zinc/16/97/62/1086169762.db2.gz MPUBUMZAWUXVLA-XZOQPEGZSA-N 2 0 352.522 4.274 20 0 FIADRP c1cnn(C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)c2ccccc2)c1 ZINC000663301607 1086388839 /nfs/dbraw/zinc/38/88/39/1086388839.db2.gz YBQBVOBUKBRMHP-DEOSSOPVSA-N 2 0 374.532 4.400 20 0 FIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290896 1086397405 /nfs/dbraw/zinc/39/74/05/1086397405.db2.gz MPTLDNBMQDCZEE-QUCCMNQESA-N 2 0 371.569 4.157 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2cccc(C(=O)Nc3ccccc3)c2)[C@@H]1CCC[NH3+] ZINC000662313797 1086413398 /nfs/dbraw/zinc/41/33/98/1086413398.db2.gz MTSUYXPONGLIBW-XMSQKQJNSA-N 2 0 365.521 4.278 20 0 FIADRP C[C@H](c1ccccc1Cl)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327668 1086419088 /nfs/dbraw/zinc/41/90/88/1086419088.db2.gz KMVVWMMTANGSHP-OAHLLOKOSA-N 2 0 372.944 4.471 20 0 FIADRP C[C@@H](C[NH2+]Cc1ncc(CN(C)C)s1)c1ccc(C(F)(F)F)cc1 ZINC000511979653 1086527403 /nfs/dbraw/zinc/52/74/03/1086527403.db2.gz YCMZQKLLMLGGDY-LBPRGKRZSA-N 2 0 357.445 4.117 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH2+]C2CCN([C@H]3CCOC3)CC2)c1 ZINC000657750130 1086552313 /nfs/dbraw/zinc/55/23/13/1086552313.db2.gz ASJVYMALVGBJKX-QFIPXVFZSA-N 2 0 350.506 4.005 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1OC(F)F ZINC000663467012 1086569394 /nfs/dbraw/zinc/56/93/94/1086569394.db2.gz CIXFMAVQVREVOC-ZBFHGGJFSA-N 2 0 368.468 4.069 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469979 1086576884 /nfs/dbraw/zinc/57/68/84/1086576884.db2.gz SHCQPUDPUWJRFY-ICSRJNTNSA-N 2 0 371.569 4.239 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCc2ncnc(-c3ccsc3)c2CC1 ZINC001167821036 1086582925 /nfs/dbraw/zinc/58/29/25/1086582925.db2.gz AAOLVCJPTRGHCW-KRWDZBQOSA-N 2 0 372.582 4.116 20 0 FIADRP c1ccc(CN2CC[C@H]([NH2+]CCCCC[NH+]3CCCC3)CC23CC3)cc1 ZINC000583380789 1086627883 /nfs/dbraw/zinc/62/78/83/1086627883.db2.gz DYEBUZCRHCBQHH-QFIPXVFZSA-N 2 0 355.570 4.039 20 0 FIADRP COc1ccccc1-c1ccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000583381484 1086628818 /nfs/dbraw/zinc/62/88/18/1086628818.db2.gz MNRMSEVDSBSLDF-OAQYLSRUSA-N 2 0 350.506 4.184 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(C(=O)c2ccc(OC)cc2)CC1 ZINC001167837505 1086711156 /nfs/dbraw/zinc/71/11/56/1086711156.db2.gz LSHHAJBRFUVEIB-GOSISDBHSA-N 2 0 360.542 4.100 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC001167836453 1086711218 /nfs/dbraw/zinc/71/12/18/1086711218.db2.gz DSFJMYNZBMYTLW-OAHLLOKOSA-N 2 0 373.372 4.021 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001167840637 1086726861 /nfs/dbraw/zinc/72/68/61/1086726861.db2.gz GTRBSUDCOGVCPM-FQEVSTJZSA-N 3 0 351.623 4.331 20 0 FIADRP CC(C)(C)OC1CC(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000432425781 1086752671 /nfs/dbraw/zinc/75/26/71/1086752671.db2.gz NPYAXAZCRNXDNI-LEHRLTEOSA-N 2 0 370.581 4.470 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(F)c(-c4cccs4)c3)C2)C1 ZINC000650706063 1086754335 /nfs/dbraw/zinc/75/43/35/1086754335.db2.gz CRWIZOJVOJNHGT-HLIPFELVSA-N 2 0 374.525 4.273 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CCCN2CCCO[C@H](C)C2)cc1 ZINC000432430008 1086757744 /nfs/dbraw/zinc/75/77/44/1086757744.db2.gz RJRVIGFAGMOSGL-MSOLQXFVSA-N 2 0 350.572 4.339 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000650706744 1086757885 /nfs/dbraw/zinc/75/78/85/1086757885.db2.gz RRMFKVLRAHMYEY-HQRMLTQVSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](CCCc3c(Cl)cccc3Cl)C2)C1 ZINC000650708693 1086767491 /nfs/dbraw/zinc/76/74/91/1086767491.db2.gz JBQZGCCPFXZOMI-CLCXKQKWSA-N 2 0 371.352 4.144 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc3occc3c2)C[C@H](C)O1 ZINC000512128924 1086796307 /nfs/dbraw/zinc/79/63/07/1086796307.db2.gz ISHYBSPTSSFYSA-ROUUACIJSA-N 2 0 364.489 4.332 20 0 FIADRP C[N@H+](Cc1cccc(C(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000279180055 1086853734 /nfs/dbraw/zinc/85/37/34/1086853734.db2.gz BIAJDXAAAWEEFV-UHFFFAOYSA-N 2 0 359.464 4.158 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)[C@H](C)[C@@H]([NH3+])c3ccccc3)c2C1 ZINC000246188624 1086904020 /nfs/dbraw/zinc/90/40/20/1086904020.db2.gz CVNRQIWVVXFVMA-VGOFRKELSA-N 2 0 365.521 4.323 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000650746373 1086930365 /nfs/dbraw/zinc/93/03/65/1086930365.db2.gz AQSPVJRGNALKEL-HNNXBMFYSA-N 2 0 357.723 4.272 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Br)cc1 ZINC000650752551 1086952030 /nfs/dbraw/zinc/95/20/30/1086952030.db2.gz TYFBZCSWABDFQA-KRWDZBQOSA-N 2 0 351.263 4.288 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3cc(Br)ccc32)c(F)c1 ZINC000650754956 1086963951 /nfs/dbraw/zinc/96/39/51/1086963951.db2.gz VPUTZBPSPFSQNF-GOSISDBHSA-N 2 0 363.274 4.214 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCCn3ccnc3)s2)cc1 ZINC000151146612 1086966454 /nfs/dbraw/zinc/96/64/54/1086966454.db2.gz OXMPONITPMXHMA-CQSZACIVSA-N 2 0 356.495 4.065 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000650757172 1086970154 /nfs/dbraw/zinc/97/01/54/1086970154.db2.gz QGJFTGQJRFXQQK-KRWDZBQOSA-N 2 0 365.340 4.471 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Br)cc2Cl)CC1 ZINC000566728745 1086990164 /nfs/dbraw/zinc/99/01/64/1086990164.db2.gz KYHHCXLCKBEIKG-LRDDRELGSA-N 2 0 371.750 4.064 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(Cl)cc3F)cc2)CC1 ZINC000584068267 1087151999 /nfs/dbraw/zinc/15/19/99/1087151999.db2.gz CEIGBSGKLFORHZ-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)C(C)(C)C(F)F ZINC000657826476 1087159549 /nfs/dbraw/zinc/15/95/49/1087159549.db2.gz GWCVGQSFXGLSDX-OWCLPIDISA-N 2 0 354.485 4.065 20 0 FIADRP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657839827 1087282324 /nfs/dbraw/zinc/28/23/24/1087282324.db2.gz HKEKBJAXYOKRPX-FHWLQOOXSA-N 2 0 365.359 4.233 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cc2cnccc2o1 ZINC000657860113 1087397870 /nfs/dbraw/zinc/39/78/70/1087397870.db2.gz AWQIVFXVPKQGKL-OAHLLOKOSA-N 2 0 355.507 4.452 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000091285115 1087426854 /nfs/dbraw/zinc/42/68/54/1087426854.db2.gz SKECYHDIPUVNRB-IBGZPJMESA-N 2 0 372.384 4.308 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000091317659 1087427911 /nfs/dbraw/zinc/42/79/11/1087427911.db2.gz DTDVKYASNWIWQA-LJQANCHMSA-N 2 0 370.459 4.247 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CCC3CC[NH+](C)CC3)cc2cc1OC ZINC000657869875 1087480145 /nfs/dbraw/zinc/48/01/45/1087480145.db2.gz BGECALIPNQXGII-MRXNPFEDSA-N 2 0 356.510 4.240 20 0 FIADRP CCOc1ccccc1CC[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508720461 1087622312 /nfs/dbraw/zinc/62/23/12/1087622312.db2.gz MSZNWCUQRTZMQK-UGKGYDQZSA-N 2 0 352.522 4.128 20 0 FIADRP CC[NH+](C/C=C/C[N@@H+](CC)[C@@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685589919 1087634569 /nfs/dbraw/zinc/63/45/69/1087634569.db2.gz AEFZJLHSTRAIRH-RMQQFATJSA-N 2 0 366.590 4.102 20 0 FIADRP CCC[N@H+](CC)C[C@H](C)NC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000685666135 1087669692 /nfs/dbraw/zinc/66/96/92/1087669692.db2.gz ZFDZHOGHERHKBM-KRWDZBQOSA-N 2 0 351.966 4.014 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2ccncc2s1 ZINC000657999162 1087696234 /nfs/dbraw/zinc/69/62/34/1087696234.db2.gz SQUJQOXOMFRQFJ-SJLPKXTDSA-N 2 0 351.519 4.469 20 0 FIADRP CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658070146 1087711651 /nfs/dbraw/zinc/71/16/51/1087711651.db2.gz MVNXOSAGITXHAU-YADHBBJMSA-N 2 0 356.554 4.049 20 0 FIADRP CCO[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C12CCCCC2 ZINC000658166759 1087761353 /nfs/dbraw/zinc/76/13/53/1087761353.db2.gz ONHFFQABZVIDTF-FGZHOGPDSA-N 2 0 371.569 4.011 20 0 FIADRP CCOc1ccccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168134 1087765206 /nfs/dbraw/zinc/76/52/06/1087765206.db2.gz VVVSQRXXPZKTAL-SFHVURJKSA-N 2 0 353.510 4.043 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCC23CCOCC3)C1 ZINC000548861107 1087770462 /nfs/dbraw/zinc/77/04/62/1087770462.db2.gz GYYMNLUFYOGXFK-XQBPLPMBSA-N 2 0 356.554 4.213 20 0 FIADRP C[C@H]([NH2+][C@H]1CSCc2ccc(Br)cc21)C1CC[NH+](C)CC1 ZINC000658189400 1087779102 /nfs/dbraw/zinc/77/91/02/1087779102.db2.gz RWBRVFGMAMTYGD-SJCJKPOMSA-N 2 0 369.372 4.057 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424280372 1087910150 /nfs/dbraw/zinc/91/01/50/1087910150.db2.gz HEWBRGRPJNWZME-VQTJNVASSA-N 2 0 357.567 4.385 20 0 FIADRP c1csc([C@H](Cc2ccncc2)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000424325168 1087921487 /nfs/dbraw/zinc/92/14/87/1087921487.db2.gz XFEDKQCHUZCAST-FQEVSTJZSA-N 2 0 355.551 4.424 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC(C)([NH3+])CC1 ZINC000647530764 1087943617 /nfs/dbraw/zinc/94/36/17/1087943617.db2.gz DLKSIXHXIHDQME-UHFFFAOYSA-N 2 0 360.505 4.161 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]C[C@@H]3CCCC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424343559 1087953401 /nfs/dbraw/zinc/95/34/01/1087953401.db2.gz FTIAOXXFZRAASJ-LHGONGGSSA-N 2 0 356.554 4.082 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000414802927 1088105916 /nfs/dbraw/zinc/10/59/16/1088105916.db2.gz CBFGVGCQQCYENK-INIZCTEOSA-N 2 0 357.929 4.114 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414836489 1088402555 /nfs/dbraw/zinc/40/25/55/1088402555.db2.gz SPXKOPZYOMWJEK-HNNXBMFYSA-N 2 0 360.933 4.048 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000513826829 1088425568 /nfs/dbraw/zinc/42/55/68/1088425568.db2.gz CKMGJTNGKUGMJI-QUCCMNQESA-N 2 0 360.542 4.160 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cc(C(=O)OC)cs2)c1 ZINC000514103851 1088748755 /nfs/dbraw/zinc/74/87/55/1088748755.db2.gz FTFGBSIQBYOZQD-OAHLLOKOSA-N 2 0 360.523 4.227 20 0 FIADRP C[NH+](C/C=C\C[N@@H+](C)Cc1ccc(F)c(F)c1)Cc1ccc(F)c(F)c1 ZINC000613592051 1088750126 /nfs/dbraw/zinc/75/01/26/1088750126.db2.gz ZGQQQZXHYHJLFL-ARJAWSKDSA-N 2 0 366.402 4.363 20 0 FIADRP CCOCOc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000782969810 1088771148 /nfs/dbraw/zinc/77/11/48/1088771148.db2.gz XNPOGKFTAGYDJF-DENIHFKCSA-N 2 0 368.521 4.060 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc21 ZINC000549145880 1089015499 /nfs/dbraw/zinc/01/54/99/1089015499.db2.gz IBSUDADSQDHTNY-OALUTQOASA-N 2 0 358.526 4.067 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000415022927 1089060971 /nfs/dbraw/zinc/06/09/71/1089060971.db2.gz MCWYHWBOZFSUIX-IBGZPJMESA-N 2 0 362.521 4.124 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415045251 1089091720 /nfs/dbraw/zinc/09/17/20/1089091720.db2.gz BGGVIQNDQVIHLZ-NQIIRXRSSA-N 2 0 353.510 4.090 20 0 FIADRP CCc1ccccc1NC(=O)C[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415055310 1089099562 /nfs/dbraw/zinc/09/95/62/1089099562.db2.gz OGXAQEUJYPAFDK-LAUBAEHRSA-N 2 0 353.510 4.036 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)CCN1Cc1ccccc1 ZINC000415062072 1089112439 /nfs/dbraw/zinc/11/24/39/1089112439.db2.gz ZNXKLBFGBYEXTJ-OIBXWCBGSA-N 2 0 351.538 4.109 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(F)c(Br)c1)c1ccccc1 ZINC000415072059 1089129147 /nfs/dbraw/zinc/12/91/47/1089129147.db2.gz XMMSIGHDIFNRHH-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](C)[C@H](OC1CCOCC1)c1ccccc1 ZINC000415084433 1089139593 /nfs/dbraw/zinc/13/95/93/1089139593.db2.gz PDZGAPXXLCETDA-URLVKDPJSA-N 2 0 374.569 4.212 20 0 FIADRP CCOc1ccc(C2(C[NH2+][C@@H](C)C[C@@H]3CCCCC[NH2+]3)CCOCC2)cc1 ZINC000415090037 1089142293 /nfs/dbraw/zinc/14/22/93/1089142293.db2.gz OMFSSQALJRVTDX-FPOVZHCZSA-N 2 0 374.569 4.034 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000415085891 1089146103 /nfs/dbraw/zinc/14/61/03/1089146103.db2.gz IYJODWJZXWIHNT-ROUUACIJSA-N 2 0 369.509 4.140 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1)[C@@H]1CCC[NH2+]C1 ZINC000414859984 1089147106 /nfs/dbraw/zinc/14/71/06/1089147106.db2.gz VBAIIFGSVFMYQT-MAUKXSAKSA-N 2 0 371.912 4.070 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)s2)cs1 ZINC000415086611 1089147709 /nfs/dbraw/zinc/14/77/09/1089147709.db2.gz JTWINUMXDXZNEK-BBWFWOEESA-N 2 0 361.580 4.233 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)s2)cs1 ZINC000415086614 1089148937 /nfs/dbraw/zinc/14/89/37/1089148937.db2.gz JTWINUMXDXZNEK-ZACQAIPSSA-N 2 0 361.580 4.233 20 0 FIADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000415093801 1089153452 /nfs/dbraw/zinc/15/34/52/1089153452.db2.gz WCGCHMJKUGGZNW-GDBMZVCRSA-N 2 0 371.352 4.162 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C)[C@H]3CCC[NH2+]C3)s2)cc1 ZINC000415097798 1089158326 /nfs/dbraw/zinc/15/83/26/1089158326.db2.gz DNJJYUMAVSDDOL-KEYYUXOJSA-N 2 0 359.539 4.166 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000415101398 1089161812 /nfs/dbraw/zinc/16/18/12/1089161812.db2.gz BITOOXXZUMJLIO-TZIWHRDSSA-N 2 0 374.525 4.273 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000415116685 1089175453 /nfs/dbraw/zinc/17/54/53/1089175453.db2.gz IADUUJLXLKHUBZ-PCCBWWKXSA-N 2 0 352.526 4.006 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000415125030 1089187177 /nfs/dbraw/zinc/18/71/77/1089187177.db2.gz KZKIVLVHOXMZTF-PZJWPPBQSA-N 2 0 356.535 4.133 20 0 FIADRP C[C@@H]1CC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@@H]1C[NH3+] ZINC000415131980 1089197397 /nfs/dbraw/zinc/19/73/97/1089197397.db2.gz SWKHJKMNNAETOO-WBVHZDCISA-N 2 0 371.912 4.009 20 0 FIADRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000415138147 1089199427 /nfs/dbraw/zinc/19/94/27/1089199427.db2.gz YLEKUYWXDQGFLA-RTWAWAEBSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000415139381 1089200048 /nfs/dbraw/zinc/20/00/48/1089200048.db2.gz ZNFMHMQEYFVUBI-TZIWHRDSSA-N 2 0 374.525 4.273 20 0 FIADRP C[NH+](C)[C@@H]1CCOc2c(NC3CC[NH+](C4CCCCC4)CC3)cccc21 ZINC000435037912 1089215767 /nfs/dbraw/zinc/21/57/67/1089215767.db2.gz OVWPAZSMWCDAQZ-OAQYLSRUSA-N 2 0 357.542 4.281 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(OC)cc1Br ZINC000313954117 1089287257 /nfs/dbraw/zinc/28/72/57/1089287257.db2.gz ARXXIBWCCKLSRI-AWEZNQCLSA-N 2 0 357.336 4.058 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000314224424 1089473344 /nfs/dbraw/zinc/47/33/44/1089473344.db2.gz PHOAYXCMOLWZDI-GOSISDBHSA-N 2 0 351.332 4.291 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000314224429 1089473392 /nfs/dbraw/zinc/47/33/92/1089473392.db2.gz PHOAYXCMOLWZDI-SFHVURJKSA-N 2 0 351.332 4.291 20 0 FIADRP CCn1ccnc1CN(Cc1ccc2ccccc2c1)[C@H]1CC12CC[NH2+]CC2 ZINC000435420055 1089634831 /nfs/dbraw/zinc/63/48/31/1089634831.db2.gz APXXAWLGKVWHBB-QFIPXVFZSA-N 2 0 374.532 4.201 20 0 FIADRP c1cc(C[N@H+](Cc2cccc3cccnc32)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000435427317 1089645402 /nfs/dbraw/zinc/64/54/02/1089645402.db2.gz MGWLSWWJQRARJJ-HXUWFJFHSA-N 2 0 363.530 4.441 20 0 FIADRP C[N@H+](Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC000435437496 1089660723 /nfs/dbraw/zinc/66/07/23/1089660723.db2.gz KWSJZMAREDVJLM-SFHVURJKSA-N 2 0 371.912 4.166 20 0 FIADRP C[N@H+](Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC000435437495 1089661458 /nfs/dbraw/zinc/66/14/58/1089661458.db2.gz KWSJZMAREDVJLM-GOSISDBHSA-N 2 0 371.912 4.166 20 0 FIADRP CCCCCOc1ccc(C[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000514976463 1089681237 /nfs/dbraw/zinc/68/12/37/1089681237.db2.gz LAAAKSBWRPMHLB-UHFFFAOYSA-N 2 0 350.572 4.173 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000163782274 1089783783 /nfs/dbraw/zinc/78/37/83/1089783783.db2.gz YNOXVWFEPUOHCI-NSYGIPOTSA-N 2 0 358.551 4.117 20 0 FIADRP CC(C)(C)OC(=O)NC1CCC([NH2+]CCCCC[NH+]2CCCCC2)CC1 ZINC000180534483 1090213124 /nfs/dbraw/zinc/21/31/24/1090213124.db2.gz INLCQLZPCLJFEL-UHFFFAOYSA-N 2 0 367.578 4.068 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)C[C@@H](c1ccccc1)[NH+](C)C ZINC000416175654 1090239336 /nfs/dbraw/zinc/23/93/36/1090239336.db2.gz IIQXTASJXGOZBO-QFIPXVFZSA-N 2 0 365.521 4.222 20 0 FIADRP CSC1(CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[NH+](C)CC1 ZINC000584562735 1090271283 /nfs/dbraw/zinc/27/12/83/1090271283.db2.gz XMLZWROKNDURPS-UHFFFAOYSA-N 2 0 369.456 4.493 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@@H]4CCC[C@H](C)C4)CC3)CC2)c1 ZINC000582032412 1090327562 /nfs/dbraw/zinc/32/75/62/1090327562.db2.gz HGLIODLLXXBCKC-GHTZIAJQSA-N 2 0 356.554 4.360 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)ccc1OC ZINC000182123097 1090330761 /nfs/dbraw/zinc/33/07/61/1090330761.db2.gz BXMMFXDKSBHZTF-OAHLLOKOSA-N 2 0 361.917 4.436 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1cccc(OCC[NH+](C)C)c1 ZINC000378389871 1090335251 /nfs/dbraw/zinc/33/52/51/1090335251.db2.gz AQLFOACJXGNFCK-ZEYPLWLESA-N 2 0 368.521 4.055 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000378398341 1090345529 /nfs/dbraw/zinc/34/55/29/1090345529.db2.gz QOXMXORYQLRLQT-QTGUNEKASA-N 2 0 368.521 4.055 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCc2ccc(C)nc2)cc1C[NH+]1CCCCC1 ZINC000182947377 1090381714 /nfs/dbraw/zinc/38/17/14/1090381714.db2.gz FQUPJKGDHPWVHG-LJQANCHMSA-N 2 0 367.537 4.278 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)ccc1OC ZINC000183013419 1090385984 /nfs/dbraw/zinc/38/59/84/1090385984.db2.gz JWZNMHPZSNZHKV-MEGFKASBSA-N 2 0 360.542 4.001 20 0 FIADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@@H]2c2ccccc2Br)CC1 ZINC001207479930 1090543865 /nfs/dbraw/zinc/54/38/65/1090543865.db2.gz PPILKJDOOJAJQJ-GOSISDBHSA-N 2 0 351.332 4.318 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310970 1090805509 /nfs/dbraw/zinc/80/55/09/1090805509.db2.gz LELUWSLBEXWJAN-ZIBCJSCZSA-N 2 0 354.563 4.394 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CCCO1 ZINC000584759985 1090844515 /nfs/dbraw/zinc/84/45/15/1090844515.db2.gz BOMNJVSWNMSBOW-XXBNENTESA-N 2 0 370.512 4.200 20 0 FIADRP OC1(C[NH2+]C2CCC3(CCCC3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000397524856 1090992264 /nfs/dbraw/zinc/99/22/64/1090992264.db2.gz WBCVMUCPUOOILN-UHFFFAOYSA-N 2 0 356.554 4.106 20 0 FIADRP Cc1cccc([C@H]2CCCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)c1C ZINC000500069916 1091021812 /nfs/dbraw/zinc/02/18/12/1091021812.db2.gz KZOVRDIHAPDRNT-HSZRJFAPSA-N 2 0 357.586 4.247 20 0 FIADRP Cc1nccn1-c1ccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2C)cn1 ZINC000190845002 1091034262 /nfs/dbraw/zinc/03/42/62/1091034262.db2.gz LRGJJHGLRQOEGD-UHFFFAOYSA-N 2 0 360.383 4.193 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000500098518 1091036677 /nfs/dbraw/zinc/03/66/77/1091036677.db2.gz MPKREJSHPISINB-MOPGFXCFSA-N 2 0 365.993 4.180 20 0 FIADRP Oc1cccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1Cl ZINC000390526581 1091182930 /nfs/dbraw/zinc/18/29/30/1091182930.db2.gz CPYRTERJXDVAPB-YQQQUEKLSA-N 2 0 356.897 4.331 20 0 FIADRP CCC(CC)(C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)SC ZINC000759820884 1091213342 /nfs/dbraw/zinc/21/33/42/1091213342.db2.gz YXDJECZETMBNSH-UHFFFAOYSA-N 2 0 363.615 4.228 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000388464735 1091370862 /nfs/dbraw/zinc/37/08/62/1091370862.db2.gz CYJZDMFTAFOJMX-SJLPKXTDSA-N 2 0 360.448 4.461 20 0 FIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000500386154 1091398653 /nfs/dbraw/zinc/39/86/53/1091398653.db2.gz TVRZMVXRANJORP-QGZVFWFLSA-N 2 0 365.512 4.132 20 0 FIADRP C[NH+](C)CCCOc1ccc(CNc2cc[nH+]c3cc(F)ccc23)cc1 ZINC000500411926 1091466355 /nfs/dbraw/zinc/46/63/55/1091466355.db2.gz XLMYYHVRKKCOMI-UHFFFAOYSA-N 2 0 353.441 4.317 20 0 FIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000500416083 1091469426 /nfs/dbraw/zinc/46/94/26/1091469426.db2.gz MWFMNIRGWZBYHN-HJUDDPQBSA-N 2 0 370.459 4.199 20 0 FIADRP c1c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2n1Cc1ccccc1 ZINC000590612028 1091608620 /nfs/dbraw/zinc/60/86/20/1091608620.db2.gz UZZLBNNHPILMQW-FGZHOGPDSA-N 2 0 359.517 4.406 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000320060036 1091836451 /nfs/dbraw/zinc/83/64/51/1091836451.db2.gz MHJHSWQOJZYNBF-HNNXBMFYSA-N 2 0 374.326 4.034 20 0 FIADRP CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000187170424 1091844795 /nfs/dbraw/zinc/84/47/95/1091844795.db2.gz WTACVQYJHPKBTM-DEOSSOPVSA-N 2 0 366.549 4.000 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(F)c3cccnc23)C1 ZINC000512215147 1091915743 /nfs/dbraw/zinc/91/57/43/1091915743.db2.gz VLYURKBVOBYDQF-QZTJIDSGSA-N 2 0 355.501 4.460 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccc5ncccc5c4)C3)C2)cc1 ZINC000512246897 1091960259 /nfs/dbraw/zinc/96/02/59/1091960259.db2.gz VYCQAZXHRYGVDO-DEOSSOPVSA-N 2 0 357.501 4.333 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)c(OC)c1 ZINC000512314229 1092032243 /nfs/dbraw/zinc/03/22/43/1092032243.db2.gz NNOLVQRNNWGTJD-QRFRQXIXSA-N 2 0 360.542 4.398 20 0 FIADRP COCc1ccc(C[NH+]2CCC3(CC[N@H+](CCCC(F)(F)F)C3)CC2)o1 ZINC001279306822 1092049165 /nfs/dbraw/zinc/04/91/65/1092049165.db2.gz SHWJLBYBFHMJPF-UHFFFAOYSA-N 2 0 374.447 4.056 20 0 FIADRP C[NH+](C)CCC[NH2+]Cc1ccc(-c2cccc(Br)c2)s1 ZINC000521182865 1092561753 /nfs/dbraw/zinc/56/17/53/1092561753.db2.gz ZBJUHUXWRRCCIE-UHFFFAOYSA-N 2 0 353.329 4.219 20 0 FIADRP COc1c(F)cccc1C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001143533476 1092700453 /nfs/dbraw/zinc/70/04/53/1092700453.db2.gz CIGIWDCLJQWVRQ-WOJBJXKFSA-N 2 0 368.496 4.178 20 0 FIADRP FC(F)(F)c1ccc([C@H]2CC[C@H]([NH2+]CCCC[NH+]3CCOCC3)C2)cc1 ZINC000442710429 1092734526 /nfs/dbraw/zinc/73/45/26/1092734526.db2.gz CAQSWIBRSGPAPN-HKUYNNGSSA-N 2 0 370.459 4.044 20 0 FIADRP C[N@H+](CCOC(c1ccccc1)c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442758433 1092750231 /nfs/dbraw/zinc/75/02/31/1092750231.db2.gz IMRNTRYTGRERDV-CBQGHPETSA-N 2 0 350.506 4.007 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000442800058 1092773193 /nfs/dbraw/zinc/77/31/93/1092773193.db2.gz JQZGUSIMTAZXQQ-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP C[C@H]1CC[C@H](C)[NH+]1Cc1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000443088346 1092932283 /nfs/dbraw/zinc/93/22/83/1092932283.db2.gz AKYNLNMRQOPBLA-IRXDYDNUSA-N 2 0 354.498 4.095 20 0 FIADRP CCCOc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000521830262 1092933250 /nfs/dbraw/zinc/93/32/50/1092933250.db2.gz LVPCIUAKTCYYBK-JOCHJYFZSA-N 2 0 352.522 4.130 20 0 FIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cc1 ZINC000521845381 1092943336 /nfs/dbraw/zinc/94/33/36/1092943336.db2.gz QEALCJPEKKTIKF-UHFFFAOYSA-N 2 0 358.913 4.350 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@@H](C)C1 ZINC000443099754 1092950183 /nfs/dbraw/zinc/95/01/83/1092950183.db2.gz UZWKNXUJISYUOL-GUYCJALGSA-N 2 0 358.423 4.196 20 0 FIADRP C[C@H](c1nc(-c2cccc(C[NH+]3CCCC3)c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443212201 1092985334 /nfs/dbraw/zinc/98/53/34/1092985334.db2.gz LVBVCOCTQQFJLW-BRWVUGGUSA-N 2 0 354.498 4.266 20 0 FIADRP COc1cccc(OC)c1CNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168015903 1093051985 /nfs/dbraw/zinc/05/19/85/1093051985.db2.gz TXMKTWKUQAYQTN-QZTJIDSGSA-N 2 0 368.521 4.235 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000512659446 1093094790 /nfs/dbraw/zinc/09/47/90/1093094790.db2.gz HATYFYVYOVJUAI-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)sc1C ZINC000512666371 1093105968 /nfs/dbraw/zinc/10/59/68/1093105968.db2.gz KFBQXQHTJHVQMR-QHAWAJNXSA-N 2 0 369.578 4.193 20 0 FIADRP C[C@H]1CC(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168017512 1093151036 /nfs/dbraw/zinc/15/10/36/1093151036.db2.gz AVOOOVGUTFYMBP-GZEZKRSXSA-N 2 0 355.570 4.033 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)c1 ZINC000474053068 1093153170 /nfs/dbraw/zinc/15/31/70/1093153170.db2.gz NZOMOBUGMBNGOI-DNVJHFABSA-N 2 0 356.554 4.357 20 0 FIADRP C[NH+]1CCC2(C[NH+](Cc3c(Br)ccc4ccccc43)C2)CC1 ZINC001141721290 1093158752 /nfs/dbraw/zinc/15/87/52/1093158752.db2.gz PUSNZYZWQLVTCL-UHFFFAOYSA-N 2 0 359.311 4.130 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3[C@H]3CCOC3)CC2)c1 ZINC000474069760 1093180879 /nfs/dbraw/zinc/18/08/79/1093180879.db2.gz ZAKFAYLSLVINHW-SESVDKBCSA-N 2 0 362.583 4.145 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000522197318 1093201654 /nfs/dbraw/zinc/20/16/54/1093201654.db2.gz AYWMIPMWNKZUIT-UHFFFAOYSA-N 2 0 357.445 4.260 20 0 FIADRP C[C@H]1CC([NH2+][C@@]23C[C@H]4C[C@@H](C2)C[C@](O)(C4)C3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168022422 1093301757 /nfs/dbraw/zinc/30/17/57/1093301757.db2.gz RXXKGJGQMPMEAZ-IHZAIKKNSA-N 2 0 368.565 4.101 20 0 FIADRP CCN(CC)Cc1nc(C2([NH2+]C[C@H]3C(C)=CCC[C@@H]3C)CCCC2)no1 ZINC000443639439 1093364898 /nfs/dbraw/zinc/36/48/98/1093364898.db2.gz GPOLBGNQUVWFAJ-ROUUACIJSA-N 2 0 360.546 4.263 20 0 FIADRP C[C@@H]1C[C@@H](n2cc(CC[NH3+])c3c[nH+]ccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024459 1093393585 /nfs/dbraw/zinc/39/35/85/1093393585.db2.gz GYHITWIVXDWGDC-RMFSNUHRSA-N 3 0 362.521 4.152 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000389141371 1093454344 /nfs/dbraw/zinc/45/43/44/1093454344.db2.gz VHIMAEBOXPJVON-ABSDTBQOSA-N 2 0 356.485 4.396 20 0 FIADRP C[C@H](COc1ccccc1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168026950 1093506959 /nfs/dbraw/zinc/50/69/59/1093506959.db2.gz MMIFLQIAURYSOH-XWSHUIEDSA-N 2 0 352.522 4.485 20 0 FIADRP COC(=O)CC1([NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001168028840 1093543835 /nfs/dbraw/zinc/54/38/35/1093543835.db2.gz QPXHVFUEEYSVMY-OALUTQOASA-N 2 0 372.553 4.284 20 0 FIADRP Cc1ccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)[C@@H](C)C3)CC2)nc1 ZINC001168032240 1093652555 /nfs/dbraw/zinc/65/25/55/1093652555.db2.gz GVLNLSZCGAFLHG-VTYHHJSWSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC1CC[NH+](C2CCCCC2)CC1 ZINC000513042933 1093689079 /nfs/dbraw/zinc/68/90/79/1093689079.db2.gz VUAKJTCVFNUPAO-GBXCKJPGSA-N 2 0 369.597 4.284 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000513052909 1093697563 /nfs/dbraw/zinc/69/75/63/1093697563.db2.gz UHINXJVCYUNDCF-AUSIDOKSSA-N 2 0 359.517 4.420 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474427914 1093779976 /nfs/dbraw/zinc/77/99/76/1093779976.db2.gz SFNXEXGDUZYHGF-MRXNPFEDSA-N 2 0 356.341 4.036 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1OCc1ccccc1 ZINC000647793747 1093800718 /nfs/dbraw/zinc/80/07/18/1093800718.db2.gz GYZJDXMSOJPNQZ-AYWYSENESA-N 2 0 350.506 4.304 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000474468932 1093806592 /nfs/dbraw/zinc/80/65/92/1093806592.db2.gz FRQJFSCPWAICBZ-FQEVSTJZSA-N 2 0 351.538 4.487 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)cn1 ZINC000474465923 1093812555 /nfs/dbraw/zinc/81/25/55/1093812555.db2.gz ASTULRDXRMZKLA-LJQANCHMSA-N 2 0 351.538 4.344 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C(C)(C)Cc1ccccc1Cl ZINC000544192414 1093996944 /nfs/dbraw/zinc/99/69/44/1093996944.db2.gz RFHPXHFZTFUXLF-UHFFFAOYSA-N 2 0 354.885 4.340 20 0 FIADRP COCc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513487682 1094158325 /nfs/dbraw/zinc/15/83/25/1094158325.db2.gz IQOZTGBOZOPEIT-KNQAVFIVSA-N 2 0 352.522 4.223 20 0 FIADRP CC(=O)Nc1ccccc1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513501974 1094174020 /nfs/dbraw/zinc/17/40/20/1094174020.db2.gz WEFQSXYXOKQWTE-WIYYLYMNSA-N 2 0 365.521 4.035 20 0 FIADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000513678612 1094269941 /nfs/dbraw/zinc/26/99/41/1094269941.db2.gz PVOGIMNQNKQHER-BHDDXSALSA-N 2 0 358.570 4.066 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ncccc3F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168037335 1094366776 /nfs/dbraw/zinc/36/67/76/1094366776.db2.gz ZXPAJLBDOLPXRS-OPVJXMOQSA-N 2 0 367.512 4.284 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000474607385 1094410908 /nfs/dbraw/zinc/41/09/08/1094410908.db2.gz YDZGHTWFPBOVDX-ROUUACIJSA-N 2 0 374.569 4.440 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+]C2(c3cccc(Cl)c3)CCCC2)CC1 ZINC000501007025 1094416844 /nfs/dbraw/zinc/41/68/44/1094416844.db2.gz KIJFMBUCNZSVON-UHFFFAOYSA-N 2 0 363.977 4.115 20 0 FIADRP C[N@@H+](Cc1cccc(Br)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501035907 1094461145 /nfs/dbraw/zinc/46/11/45/1094461145.db2.gz BYMUZHQPYJCVPS-UHFFFAOYSA-N 2 0 374.326 4.193 20 0 FIADRP CC(C)C[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501057676 1094469350 /nfs/dbraw/zinc/46/93/50/1094469350.db2.gz XDUKEXHSUJXDLQ-OAQYLSRUSA-N 2 0 365.993 4.433 20 0 FIADRP C[N@H+](CCCCOc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501061122 1094471921 /nfs/dbraw/zinc/47/19/21/1094471921.db2.gz DLWONRBOHPTRCV-UHFFFAOYSA-N 2 0 353.510 4.089 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)[C@@H](C)C1CCCCC1 ZINC000474798627 1094616655 /nfs/dbraw/zinc/61/66/55/1094616655.db2.gz DJZCNHQQUKCDTK-RTBURBONSA-N 2 0 358.570 4.338 20 0 FIADRP Cc1ccc(CCC[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000474814002 1094658256 /nfs/dbraw/zinc/65/82/56/1094658256.db2.gz FNZVBZUIOSRJNS-MOJGAOKDSA-N 2 0 351.538 4.069 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1OC ZINC000474818619 1094665159 /nfs/dbraw/zinc/66/51/59/1094665159.db2.gz UFSRATKZVORNJL-JKSUJKDBSA-N 2 0 374.500 4.186 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000501390755 1094675125 /nfs/dbraw/zinc/67/51/25/1094675125.db2.gz UFQLFUNHDBJLRW-UNMCSNQZSA-N 2 0 367.537 4.228 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501423269 1094703283 /nfs/dbraw/zinc/70/32/83/1094703283.db2.gz MWUNDAVKBLLCOI-QGZVFWFLSA-N 2 0 358.476 4.418 20 0 FIADRP COc1ccc2c(c1)[C@@H]([N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1)CCO2 ZINC000420296734 1094856703 /nfs/dbraw/zinc/85/67/03/1094856703.db2.gz DRJNZFNXULHETF-GCJKJVERSA-N 2 0 366.505 4.021 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OC ZINC000474893877 1094862256 /nfs/dbraw/zinc/86/22/56/1094862256.db2.gz ZRSMVOSDPWVSCY-DLBZAZTESA-N 2 0 356.510 4.047 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000474895487 1094866958 /nfs/dbraw/zinc/86/69/58/1094866958.db2.gz WTLHAWXNWMXBHN-UHFFFAOYSA-N 2 0 360.505 4.066 20 0 FIADRP Clc1ccc(COC2CC[NH+](CC[C@H]3CCC[NH2+]C3)CC2)cc1Cl ZINC000420313583 1094876320 /nfs/dbraw/zinc/87/63/20/1094876320.db2.gz YCUQAMXPSGEXEE-OAHLLOKOSA-N 2 0 371.352 4.364 20 0 FIADRP c1ccc(C[N@@H+](CCc2ccc3ccccc3c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000420320215 1094881509 /nfs/dbraw/zinc/88/15/09/1094881509.db2.gz YOTNIIQWXRBPCX-DEOSSOPVSA-N 2 0 359.517 4.422 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000420372340 1094903354 /nfs/dbraw/zinc/90/33/54/1094903354.db2.gz FEBKXAOJSVOOGB-HKUYNNGSSA-N 2 0 368.974 4.041 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](CCC(=O)Nc2cccc3ccccc32)CC1 ZINC000501773727 1094916706 /nfs/dbraw/zinc/91/67/06/1094916706.db2.gz KSQGBUGWFRLSNC-UHFFFAOYSA-N 2 0 367.537 4.222 20 0 FIADRP CC(C)O[C@@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000428306981 1095047932 /nfs/dbraw/zinc/04/79/32/1095047932.db2.gz RFNKCXQYRWUZTO-QHCPKHFHSA-N 2 0 367.537 4.396 20 0 FIADRP CCc1cc(N2CCC(OCC[NH+](CC)CC)CC2)c2ccccc2[nH+]1 ZINC000443876413 1095143310 /nfs/dbraw/zinc/14/33/10/1095143310.db2.gz GWTDXMLHJMBSMM-UHFFFAOYSA-N 2 0 355.526 4.124 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000502240043 1095244524 /nfs/dbraw/zinc/24/45/24/1095244524.db2.gz FXSOBZFDNKWVEO-GOSISDBHSA-N 2 0 374.569 4.330 20 0 FIADRP CCC1(C[NH2+][C@H]2CCC[C@@H]2CCOC)CC[NH+](Cc2ccccc2)CC1 ZINC000502428573 1095446330 /nfs/dbraw/zinc/44/63/30/1095446330.db2.gz LZNPTONPSJXKQE-YADHBBJMSA-N 2 0 358.570 4.474 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000421374021 1095575736 /nfs/dbraw/zinc/57/57/36/1095575736.db2.gz OPMARGRRVNYPDN-UHFFFAOYSA-N 2 0 351.741 4.126 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](C(=O)OC(C)(C)C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168051054 1095769810 /nfs/dbraw/zinc/76/98/10/1095769810.db2.gz FRJBCFMRNTWGPJ-KOUHRCEDSA-N 2 0 372.553 4.092 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000513756215 1095870266 /nfs/dbraw/zinc/87/02/66/1095870266.db2.gz XCWUHEKNASOWCY-UHFFFAOYSA-N 2 0 374.532 4.421 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000421832209 1095943642 /nfs/dbraw/zinc/94/36/42/1095943642.db2.gz FNFIOFFKYCHEHE-HNNXBMFYSA-N 2 0 359.901 4.311 20 0 FIADRP C[C@H](C[NH+](C)C[C@@H](C)c1nccs1)C[N@H+](C)C[C@H](C)c1nccs1 ZINC000273087633 1096232707 /nfs/dbraw/zinc/23/27/07/1096232707.db2.gz SBTZFADDVNQVQG-PHZGNYQRSA-N 2 0 366.600 4.007 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000414662430 1096371748 /nfs/dbraw/zinc/37/17/48/1096371748.db2.gz QFNRHQAIUWOBTI-AZUAARDMSA-N 2 0 360.505 4.017 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000414662432 1096372253 /nfs/dbraw/zinc/37/22/53/1096372253.db2.gz QFNRHQAIUWOBTI-QUCCMNQESA-N 2 0 360.505 4.017 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(c2ccc(Br)cc2)CC1 ZINC000503377168 1096378047 /nfs/dbraw/zinc/37/80/47/1096378047.db2.gz PILOTVOSGIAURN-SFHVURJKSA-N 2 0 351.332 4.113 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3c(cc2OC)C[C@@H](C)O3)c1 ZINC000613262356 1096476110 /nfs/dbraw/zinc/47/61/10/1096476110.db2.gz UPHBXTJVKGHZSX-QGZVFWFLSA-N 2 0 368.521 4.150 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1c2cc(Br)ccc2SC[C@@H]1C ZINC000422740854 1096477678 /nfs/dbraw/zinc/47/76/78/1096477678.db2.gz NNWROMFIVJGDEA-HWWQOWPSSA-N 2 0 357.361 4.339 20 0 FIADRP CC(C)[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1 ZINC000422778321 1096488932 /nfs/dbraw/zinc/48/89/32/1096488932.db2.gz DJOFLKXTKZBWHY-ILWGZMRPSA-N 2 0 354.469 4.368 20 0 FIADRP CC(C)[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1 ZINC000422778319 1096488967 /nfs/dbraw/zinc/48/89/67/1096488967.db2.gz DJOFLKXTKZBWHY-BVSLBCMMSA-N 2 0 354.469 4.368 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422785840 1096490400 /nfs/dbraw/zinc/49/04/00/1096490400.db2.gz RUWHERPACBBDEO-JWNTYJGQSA-N 2 0 366.505 4.382 20 0 FIADRP c1ccc2cc(OCC[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422804490 1096496179 /nfs/dbraw/zinc/49/61/79/1096496179.db2.gz FEAVQTUXDBBFPP-LADGPHEKSA-N 2 0 374.484 4.064 20 0 FIADRP c1ccc2cc(OCC[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422804491 1096496470 /nfs/dbraw/zinc/49/64/70/1096496470.db2.gz FEAVQTUXDBBFPP-UPVQGACJSA-N 2 0 374.484 4.064 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000422813888 1096498317 /nfs/dbraw/zinc/49/83/17/1096498317.db2.gz YUXJCKNCBBWYPL-UPVQGACJSA-N 2 0 371.484 4.094 20 0 FIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422814997 1096498563 /nfs/dbraw/zinc/49/85/63/1096498563.db2.gz ALRKEUQRCWZNBA-KLICCBINSA-N 2 0 368.443 4.201 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000422855852 1096506070 /nfs/dbraw/zinc/50/60/70/1096506070.db2.gz FLOWQKRUZOWOGW-QZTJIDSGSA-N 3 0 366.553 4.074 20 0 FIADRP c1ccc(COCc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000422859805 1096506741 /nfs/dbraw/zinc/50/67/41/1096506741.db2.gz KNQRHXPFGGKBOA-KMDXXIMOSA-N 2 0 364.533 4.414 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000422886583 1096514504 /nfs/dbraw/zinc/51/45/04/1096514504.db2.gz XCCPQPFGSMQNBW-ROUUACIJSA-N 3 0 366.553 4.074 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000422874670 1096518133 /nfs/dbraw/zinc/51/81/33/1096518133.db2.gz OCMXHEFAWNIHSZ-UONOGXRCSA-N 2 0 357.473 4.188 20 0 FIADRP Cc1c2cc(F)ccc2oc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422897791 1096519741 /nfs/dbraw/zinc/51/97/41/1096519741.db2.gz CVHSUWPUTMVOFH-PGRDOPGGSA-N 2 0 366.436 4.226 20 0 FIADRP c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)CCCCCC2)cc1 ZINC000422909597 1096521268 /nfs/dbraw/zinc/52/12/68/1096521268.db2.gz OJHUMEDVXJRCOL-YPAWHYETSA-N 2 0 356.554 4.025 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)C1C[NH2+]C1 ZINC000422923436 1096525856 /nfs/dbraw/zinc/52/58/56/1096525856.db2.gz WCTKEMHCAGBYOC-ZDUSSCGKSA-N 2 0 350.384 4.195 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000422936972 1096529996 /nfs/dbraw/zinc/52/99/96/1096529996.db2.gz NJCTZPFMTPGZIA-STQMWFEESA-N 2 0 351.416 4.149 20 0 FIADRP Clc1ccc(C2([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422937589 1096530045 /nfs/dbraw/zinc/53/00/45/1096530045.db2.gz OIRZQUGDXAUATJ-ICSRJNTNSA-N 2 0 354.881 4.175 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OCC(C)C ZINC000422944542 1096535848 /nfs/dbraw/zinc/53/58/48/1096535848.db2.gz SHEJUIZVAYDVHR-HZPDHXFCSA-N 2 0 371.525 4.304 20 0 FIADRP Clc1cccc2c1OCC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422947453 1096536745 /nfs/dbraw/zinc/53/67/45/1096536745.db2.gz QDCLOUHFSAEJKS-BBTUJRGHSA-N 2 0 370.880 4.009 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422977046 1096543642 /nfs/dbraw/zinc/54/36/42/1096543642.db2.gz WAHXXKHKWNDWOZ-YDHSSHFGSA-N 2 0 366.505 4.447 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)Cc1c(Cl)cccc1Cl ZINC000423015024 1096550596 /nfs/dbraw/zinc/55/05/96/1096550596.db2.gz QEKSVDYGXWRMDJ-VXGBXAGGSA-N 2 0 352.309 4.437 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423015023 1096550703 /nfs/dbraw/zinc/55/07/03/1096550703.db2.gz QEKSVDYGXWRMDJ-RYUDHWBXSA-N 2 0 352.309 4.437 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423035612 1096555926 /nfs/dbraw/zinc/55/59/26/1096555926.db2.gz SADHWNIFUKZMTA-DNVCBOLYSA-N 2 0 370.368 4.065 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CC(F)(F)F)c1ccc(Br)cc1 ZINC000423041888 1096558494 /nfs/dbraw/zinc/55/84/94/1096558494.db2.gz YALSNMVZOVVSLN-MFKMUULPSA-N 2 0 353.226 4.160 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000414715540 1096563909 /nfs/dbraw/zinc/56/39/09/1096563909.db2.gz RBHQEPCWBPVIQR-MSOLQXFVSA-N 2 0 372.557 4.042 20 0 FIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423100687 1096575093 /nfs/dbraw/zinc/57/50/93/1096575093.db2.gz VLVNKWTVBHWDBX-QWJIHBKKSA-N 2 0 368.908 4.432 20 0 FIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C2)c1 ZINC000423105675 1096583401 /nfs/dbraw/zinc/58/34/01/1096583401.db2.gz ZGGWNSBYTGZQCW-XFUTXVRSSA-N 2 0 352.444 4.462 20 0 FIADRP CCOc1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1Cl ZINC000423107724 1096583483 /nfs/dbraw/zinc/58/34/83/1096583483.db2.gz QCGWJNXLMGLUKU-GHTZIAJQSA-N 2 0 372.896 4.084 20 0 FIADRP Fc1cc(F)c2c(c1)[C@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146244 1096586437 /nfs/dbraw/zinc/58/64/37/1096586437.db2.gz OVMVWBVCASAQOH-SJBKTWHCSA-N 2 0 370.443 4.188 20 0 FIADRP Fc1cc(F)c2c(c1)[C@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146243 1096586587 /nfs/dbraw/zinc/58/65/87/1096586587.db2.gz OVMVWBVCASAQOH-RZUBCFFCSA-N 2 0 370.443 4.188 20 0 FIADRP Brc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423144830 1096586772 /nfs/dbraw/zinc/58/67/72/1096586772.db2.gz ZNGMICYPQNWMJN-RXABAKJHSA-N 2 0 363.343 4.205 20 0 FIADRP Fc1cc(F)c2c(c1)[C@@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146245 1096587021 /nfs/dbraw/zinc/58/70/21/1096587021.db2.gz OVMVWBVCASAQOH-TUNNFDKTSA-N 2 0 370.443 4.188 20 0 FIADRP Clc1cccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)C2)c1 ZINC000423157409 1096590553 /nfs/dbraw/zinc/59/05/53/1096590553.db2.gz AZDADBFQHCRAGK-OBJCFNGXSA-N 2 0 362.945 4.113 20 0 FIADRP Clc1cccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)C2)c1 ZINC000423157410 1096590641 /nfs/dbraw/zinc/59/06/41/1096590641.db2.gz AZDADBFQHCRAGK-RSRIQPTJSA-N 2 0 362.945 4.113 20 0 FIADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Br)cc1Cl ZINC000423135904 1096592795 /nfs/dbraw/zinc/59/27/95/1096592795.db2.gz ONZRPAJWDSOBBZ-PBWFPOADSA-N 2 0 371.750 4.253 20 0 FIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC[C@@H](c1ccccc1)C(F)(F)F ZINC000423139602 1096593567 /nfs/dbraw/zinc/59/35/67/1096593567.db2.gz VTTKPOCNUMJVPX-SNRMKQJTSA-N 2 0 350.428 4.271 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@H]1CCC[NH2+]C1 ZINC000423209409 1096608456 /nfs/dbraw/zinc/60/84/56/1096608456.db2.gz FFQDULLZEDMYJW-JLJPHGGASA-N 2 0 359.514 4.304 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423225453 1096622896 /nfs/dbraw/zinc/62/28/96/1096622896.db2.gz MVPRFFXTAKLJSG-WDEREUQCSA-N 2 0 368.344 4.269 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000423229905 1096624300 /nfs/dbraw/zinc/62/43/00/1096624300.db2.gz IEHFZVUVSGWOKV-ZUEPYMLJSA-N 2 0 357.723 4.413 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000423291464 1096636148 /nfs/dbraw/zinc/63/61/48/1096636148.db2.gz IJMKEVKONNHEMH-GTNSWQLSSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000423293162 1096636782 /nfs/dbraw/zinc/63/67/82/1096636782.db2.gz QASAPGUGVSJZCA-YGRLFVJLSA-N 2 0 351.313 4.307 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@]3(C)CCC[NH2+]C3)s2)cc1 ZINC000423315744 1096641551 /nfs/dbraw/zinc/64/15/51/1096641551.db2.gz AELSGHKQDWOJJH-JLTOFOAXSA-N 2 0 359.539 4.167 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OC(F)F ZINC000423293831 1096643634 /nfs/dbraw/zinc/64/36/34/1096643634.db2.gz SDLCTNDBAJJQDS-STQMWFEESA-N 2 0 350.409 4.167 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423297292 1096644768 /nfs/dbraw/zinc/64/47/68/1096644768.db2.gz JQRCOFLPIRCRBF-QWRGUYRKSA-N 2 0 368.344 4.126 20 0 FIADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423347971 1096647325 /nfs/dbraw/zinc/64/73/25/1096647325.db2.gz ROBYJOSTTYPQNG-SNVBAGLBSA-N 2 0 363.221 4.038 20 0 FIADRP C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423339568 1096651230 /nfs/dbraw/zinc/65/12/30/1096651230.db2.gz IYPOWVWGVJQZJP-BAHGYDIPSA-N 2 0 366.549 4.126 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423368150 1096658284 /nfs/dbraw/zinc/65/82/84/1096658284.db2.gz DCLVBODYHQXFHF-SFHVURJKSA-N 2 0 357.295 4.138 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423399893 1096667281 /nfs/dbraw/zinc/66/72/81/1096667281.db2.gz VFVSHEBUABIXQD-INIZCTEOSA-N 2 0 366.509 4.014 20 0 FIADRP COc1cccc(C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2ccccc2)c1 ZINC000423406110 1096673392 /nfs/dbraw/zinc/67/33/92/1096673392.db2.gz YNBOMTRJAXPKAP-DEOSSOPVSA-N 2 0 358.485 4.372 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]Cc2ccc4c(c2)CCCN4)C3)cc1 ZINC000423437135 1096685488 /nfs/dbraw/zinc/68/54/88/1096685488.db2.gz GCUFCDFCNQMZJQ-WBDAEOGXSA-N 2 0 361.533 4.330 20 0 FIADRP Cc1c([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cnn1-c1ccc(Cl)cc1Cl ZINC000423458601 1096689105 /nfs/dbraw/zinc/68/91/05/1096689105.db2.gz QGYSLERVXVWONQ-NWDGAFQWSA-N 2 0 355.313 4.266 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cnn1-c1ccc(Cl)cc1Cl ZINC000423458602 1096689285 /nfs/dbraw/zinc/68/92/85/1096689285.db2.gz QGYSLERVXVWONQ-RYUDHWBXSA-N 2 0 355.313 4.266 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000423465331 1096691926 /nfs/dbraw/zinc/69/19/26/1096691926.db2.gz HSVLPJCEADBUFJ-TVTNDZMWSA-N 2 0 370.516 4.181 20 0 FIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423471312 1096694449 /nfs/dbraw/zinc/69/44/49/1096694449.db2.gz FAQOMAMDXURKLH-VXGBXAGGSA-N 2 0 364.383 4.072 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCS2 ZINC000423472388 1096694540 /nfs/dbraw/zinc/69/45/40/1096694540.db2.gz FUXOJKCSKPTHEA-HIFRSBDPSA-N 2 0 355.345 4.108 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000423482439 1096696770 /nfs/dbraw/zinc/69/67/70/1096696770.db2.gz XRMPACFEBABUFD-WJFJTQNHSA-N 2 0 367.512 4.230 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000423482435 1096697291 /nfs/dbraw/zinc/69/72/91/1096697291.db2.gz XRMPACFEBABUFD-NKRSRWBGSA-N 2 0 367.512 4.230 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000423453555 1096697782 /nfs/dbraw/zinc/69/77/82/1096697782.db2.gz AQBALJDXXAGXGT-IAOVAPTHSA-N 2 0 359.514 4.434 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]3CCC[C@@H]([NH3+])C3)s2)cc1 ZINC000423454778 1096698527 /nfs/dbraw/zinc/69/85/27/1096698527.db2.gz DJEPDTULXHQOOG-YSVLISHTSA-N 2 0 359.539 4.295 20 0 FIADRP Cc1c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000423503604 1096700567 /nfs/dbraw/zinc/70/05/67/1096700567.db2.gz MWEAJRYMNDAWLE-ZHRRBRCNSA-N 2 0 366.484 4.451 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000423503600 1096700894 /nfs/dbraw/zinc/70/08/94/1096700894.db2.gz MWEAJRYMNDAWLE-KSFYIVLOSA-N 2 0 366.484 4.451 20 0 FIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cncn2)cc1Cl ZINC000423507782 1096701973 /nfs/dbraw/zinc/70/19/73/1096701973.db2.gz QKOGOLFSIAQYQT-YWZLYKJASA-N 2 0 369.900 4.052 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423483488 1096703510 /nfs/dbraw/zinc/70/35/10/1096703510.db2.gz QBNQWTBEYMSBDU-RHSMWYFYSA-N 2 0 355.295 4.161 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423483967 1096703517 /nfs/dbraw/zinc/70/35/17/1096703517.db2.gz QLWDAXAVVUNCHH-IRXDYDNUSA-N 2 0 359.514 4.448 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCC[C@H]3CCC[NH2+]3)s2)cc1 ZINC000423487403 1096704634 /nfs/dbraw/zinc/70/46/34/1096704634.db2.gz UGQFXSQPIQXQLS-YOEHRIQHSA-N 2 0 359.539 4.310 20 0 FIADRP [NH3+]CCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000423518631 1096711964 /nfs/dbraw/zinc/71/19/64/1096711964.db2.gz PFLOXMMJLDLOSJ-XQUALCHDSA-N 3 0 363.549 4.252 20 0 FIADRP CCC[C@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000423559053 1096714033 /nfs/dbraw/zinc/71/40/33/1096714033.db2.gz JDBPILYOVJTJSM-FQEVSTJZSA-N 2 0 357.567 4.172 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423538386 1096715292 /nfs/dbraw/zinc/71/52/92/1096715292.db2.gz MSVUSADEZVDFLL-QGZVFWFLSA-N 2 0 357.498 4.226 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCC1=CC[NH2+]CC1 ZINC000423544228 1096717256 /nfs/dbraw/zinc/71/72/56/1096717256.db2.gz WGVABOPSEXXEEF-GOSISDBHSA-N 2 0 374.326 4.207 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@H]4C2)CCC3)cc1 ZINC000423547821 1096718232 /nfs/dbraw/zinc/71/82/32/1096718232.db2.gz QGRRWKNNMFVPBQ-JOCBIADPSA-N 2 0 371.525 4.304 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000423550022 1096719079 /nfs/dbraw/zinc/71/90/79/1096719079.db2.gz NRNVHAVLJSVSPG-LIEJCIORSA-N 2 0 352.444 4.319 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000423550021 1096719153 /nfs/dbraw/zinc/71/91/53/1096719153.db2.gz NRNVHAVLJSVSPG-AEIBSFOJSA-N 2 0 352.444 4.319 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000423550023 1096719433 /nfs/dbraw/zinc/71/94/33/1096719433.db2.gz NRNVHAVLJSVSPG-PHAGKYIGSA-N 2 0 352.444 4.319 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc(OCc2ccccc2)c1 ZINC000423553913 1096720107 /nfs/dbraw/zinc/72/01/07/1096720107.db2.gz WHWOEYSCHZMHMR-KVJIRVJXSA-N 2 0 350.506 4.304 20 0 FIADRP CSC1(C[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[NH+](C)CC1 ZINC000515465828 1098604406 /nfs/dbraw/zinc/60/44/06/1098604406.db2.gz OWTFMABYYIQFTR-UHFFFAOYSA-N 2 0 372.500 4.368 20 0 FIADRP CC[N@H+](Cc1nc(C)cs1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533073589 1098740765 /nfs/dbraw/zinc/74/07/65/1098740765.db2.gz FFCRIHFFJJDCKG-UHFFFAOYSA-N 2 0 373.570 4.164 20 0 FIADRP COCCC1(CNc2ccc(N3CCC([NH+](C)C)CC3)cn2)CCCCC1 ZINC000436290991 1098906632 /nfs/dbraw/zinc/90/66/32/1098906632.db2.gz KCBLYACGMIGNJP-UHFFFAOYSA-N 2 0 374.573 4.011 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cc3c(cccc3F)[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000436298648 1098910947 /nfs/dbraw/zinc/91/09/47/1098910947.db2.gz ZLNCRFBCMIPSNA-FUHWJXTLSA-N 2 0 351.469 4.450 20 0 FIADRP CSc1ccc(CC[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000436301169 1098914631 /nfs/dbraw/zinc/91/46/31/1098914631.db2.gz YGCXZVVYZGHURE-KRWDZBQOSA-N 2 0 358.551 4.242 20 0 FIADRP CCOC(=O)c1oc2ccccc2c1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000533271649 1098922861 /nfs/dbraw/zinc/92/28/61/1098922861.db2.gz JYFAAUOQBBFULZ-UHFFFAOYSA-N 2 0 372.509 4.162 20 0 FIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(OC2CC[NH+](C)CC2)cn1 ZINC001211991999 1099065954 /nfs/dbraw/zinc/06/59/54/1099065954.db2.gz YLRMSRDYIYJMEB-UHFFFAOYSA-N 2 0 368.525 4.140 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000533447235 1099072993 /nfs/dbraw/zinc/07/29/93/1099072993.db2.gz PKNCLIJZTXZWHN-UONOGXRCSA-N 2 0 372.340 4.127 20 0 FIADRP CCCC[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000533715067 1099359127 /nfs/dbraw/zinc/35/91/27/1099359127.db2.gz XMLNRGKVASTMBF-KRWDZBQOSA-N 2 0 359.341 4.271 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@H]2CCC[C@@H]21 ZINC000516324646 1099369605 /nfs/dbraw/zinc/36/96/05/1099369605.db2.gz XWBHALNZIDQFTM-GIWBLDEGSA-N 2 0 374.532 4.047 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3cnc(C4CC4)nc3)cc2)C1 ZINC000459389590 1099373653 /nfs/dbraw/zinc/37/36/53/1099373653.db2.gz MFGFYOWMFXKAEF-HDICACEKSA-N 2 0 364.537 4.122 20 0 FIADRP CC1(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[NH2+]CC1 ZINC000414900262 1099757124 /nfs/dbraw/zinc/75/71/24/1099757124.db2.gz IEKSXAANUOZGQV-UHFFFAOYSA-N 2 0 366.534 4.080 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162502157 1099813159 /nfs/dbraw/zinc/81/31/59/1099813159.db2.gz MKROSKKKBHKNMR-HNNXBMFYSA-N 2 0 362.514 4.339 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1 ZINC000162529565 1099827601 /nfs/dbraw/zinc/82/76/01/1099827601.db2.gz ULAPSZZBQDNIEU-IBGZPJMESA-N 2 0 360.498 4.093 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)c1 ZINC000162547465 1099837510 /nfs/dbraw/zinc/83/75/10/1099837510.db2.gz QCDYRCUITISPJG-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@@H](NCCC[N@H+](C)Cc1ccccc1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508701303 1099842898 /nfs/dbraw/zinc/84/28/98/1099842898.db2.gz WNIYKKAQWZLLAT-QPPBQGQZSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H](COc1ccc(F)cc1F)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702511 1099854073 /nfs/dbraw/zinc/85/40/73/1099854073.db2.gz ZILSBGHWGDQPLV-ZHALLVOQSA-N 2 0 374.475 4.232 20 0 FIADRP CCOCCC1(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508703569 1099857149 /nfs/dbraw/zinc/85/71/49/1099857149.db2.gz YWTAGFDSYRTLEB-IRLDBZIGSA-N 2 0 358.570 4.474 20 0 FIADRP Cc1ccc([C@H](CN[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000508709535 1099876926 /nfs/dbraw/zinc/87/69/26/1099876926.db2.gz HSMJTJIAJZXKGI-HUVFLSCGSA-N 2 0 365.565 4.098 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000508708938 1099887990 /nfs/dbraw/zinc/88/79/90/1099887990.db2.gz FCXQGUBSRIBUKA-ILWGZMRPSA-N 2 0 369.553 4.163 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@@H]2CC[NH+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000516866861 1099895881 /nfs/dbraw/zinc/89/58/81/1099895881.db2.gz UZUMPINZNKEABM-DHIUTWEWSA-N 2 0 369.597 4.141 20 0 FIADRP COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000516870696 1099897821 /nfs/dbraw/zinc/89/78/21/1099897821.db2.gz KVDJIISYHVGUIV-UYAOXDASSA-N 2 0 364.574 4.275 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709974 1099899701 /nfs/dbraw/zinc/89/97/01/1099899701.db2.gz KNQCSAZHQMXPGQ-UVUJQTEASA-N 2 0 358.570 4.328 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000508709807 1099899965 /nfs/dbraw/zinc/89/99/65/1099899965.db2.gz JOMTZMFQRRLSSA-GBXCKJPGSA-N 3 0 365.565 4.139 20 0 FIADRP COc1ccc(CCC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711291 1099900686 /nfs/dbraw/zinc/90/06/86/1099900686.db2.gz AIUARZHYIXHIRP-DENIHFKCSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(-n2cccn2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712667 1099902790 /nfs/dbraw/zinc/90/27/90/1099902790.db2.gz RMVOUBRDVSVNQI-MIZPHKNDSA-N 2 0 374.532 4.434 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000516905215 1099915664 /nfs/dbraw/zinc/91/56/64/1099915664.db2.gz SUEFBQWBFQRFTD-MRXNPFEDSA-N 2 0 357.361 4.283 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]CC2CCN(Cc3nc(C)c(C)o3)CC2)cc1 ZINC000162729044 1099976179 /nfs/dbraw/zinc/97/61/79/1099976179.db2.gz ZCMJUNFSGIFNET-KRWDZBQOSA-N 2 0 355.526 4.417 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000467360076 1100103699 /nfs/dbraw/zinc/10/36/99/1100103699.db2.gz WFCXVVUHIAEVHO-KNQBKSORSA-N 2 0 356.554 4.082 20 0 FIADRP COc1ccccc1[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459418707 1100145543 /nfs/dbraw/zinc/14/55/43/1100145543.db2.gz TZOGVAVNWDISTA-XMMPIXPASA-N 2 0 373.500 4.438 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000536695558 1100194272 /nfs/dbraw/zinc/19/42/72/1100194272.db2.gz IFPAIKBPLZSEDR-UHFFFAOYSA-N 2 0 355.501 4.442 20 0 FIADRP CC(C)(C[NH2+]Cc1cc(C2CC[NH2+]CC2)no1)c1c(F)cccc1Cl ZINC000425899322 1100196547 /nfs/dbraw/zinc/19/65/47/1100196547.db2.gz KWPBKVKWYINHPA-UHFFFAOYSA-N 2 0 365.880 4.002 20 0 FIADRP CCC1(C[NH2+]Cc2cnc(C3CC3)nc2)CC[NH+](Cc2ccccc2)CC1 ZINC000459464703 1100208990 /nfs/dbraw/zinc/20/89/90/1100208990.db2.gz WZTAQAGNOVFXOI-UHFFFAOYSA-N 2 0 364.537 4.136 20 0 FIADRP CCc1ncc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)s1 ZINC000536709745 1100230055 /nfs/dbraw/zinc/23/00/55/1100230055.db2.gz MYPHFHBMPZZZMD-UHFFFAOYSA-N 2 0 355.551 4.194 20 0 FIADRP CCCn1ccnc1CCC[N@H+](C)Cc1c(C)nc2scc(C3CC3)n12 ZINC000459552222 1100299173 /nfs/dbraw/zinc/29/91/73/1100299173.db2.gz SRNJUGYZTUUCAX-UHFFFAOYSA-N 2 0 371.554 4.253 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000536820987 1100338057 /nfs/dbraw/zinc/33/80/57/1100338057.db2.gz MGLYQUHIVZJHCU-HNNXBMFYSA-N 2 0 359.901 4.311 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2csc3ccccc23)[C@@H](C)C1 ZINC000536849941 1100363025 /nfs/dbraw/zinc/36/30/25/1100363025.db2.gz DRGOABVKVLOKPN-PXNSSMCTSA-N 2 0 360.567 4.170 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C[C@H](C)O1 ZINC000536861961 1100379955 /nfs/dbraw/zinc/37/99/55/1100379955.db2.gz IKPHQBXLUAJAPT-RVKKMQEKSA-N 2 0 368.974 4.356 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000459652836 1100396003 /nfs/dbraw/zinc/39/60/03/1100396003.db2.gz QVRQBYIKQFPSJM-RTWAWAEBSA-N 2 0 365.565 4.478 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cc4c(cccc4F)[nH]3)CC2)C[C@H](C)O1 ZINC000438112139 1100436688 /nfs/dbraw/zinc/43/66/88/1100436688.db2.gz DRUAGBCPRLMUKU-IRXDYDNUSA-N 2 0 373.516 4.018 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000425951567 1100446622 /nfs/dbraw/zinc/44/66/22/1100446622.db2.gz QCXJNKYFOYGXPS-HKBOAZHASA-N 2 0 355.913 4.235 20 0 FIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc(Cl)c1OC ZINC000517537209 1100474891 /nfs/dbraw/zinc/47/48/91/1100474891.db2.gz KLXCKSXYLDVOSS-HZPDHXFCSA-N 2 0 368.949 4.205 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000425956270 1100476844 /nfs/dbraw/zinc/47/68/44/1100476844.db2.gz WFVZYNQPOODBDW-INIZCTEOSA-N 2 0 356.485 4.494 20 0 FIADRP CN(c1ccccc1C[N@H+](C)Cc1ccc(F)c(F)c1)C1CC[NH+](C)CC1 ZINC000506220306 1100642949 /nfs/dbraw/zinc/64/29/49/1100642949.db2.gz VYKHBUJPTSYUJQ-UHFFFAOYSA-N 2 0 373.491 4.127 20 0 FIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000438581049 1100768310 /nfs/dbraw/zinc/76/83/10/1100768310.db2.gz PQFKGKHQQRDKQC-NRFANRHFSA-N 2 0 355.526 4.018 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000414946991 1100903756 /nfs/dbraw/zinc/90/37/56/1100903756.db2.gz KFAHSURLPVIFRG-ICSRJNTNSA-N 2 0 360.505 4.078 20 0 FIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414949307 1100905715 /nfs/dbraw/zinc/90/57/15/1100905715.db2.gz ZTNDRMIEXSMHKI-MLGOLLRUSA-N 2 0 365.340 4.265 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1O ZINC000426175974 1100948122 /nfs/dbraw/zinc/94/81/22/1100948122.db2.gz XAKGWVVEFXOYRA-SFHVURJKSA-N 2 0 362.558 4.070 20 0 FIADRP CC1(C)Cc2ccc(Br)cc2[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000426335051 1101288524 /nfs/dbraw/zinc/28/85/24/1101288524.db2.gz NKPOUSQBKFKIPI-BQFCYCMXSA-N 2 0 363.343 4.289 20 0 FIADRP C[C@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001167964324 1101349195 /nfs/dbraw/zinc/34/91/95/1101349195.db2.gz OXLPUZDLYCQICJ-FNFMLGTDSA-N 2 0 367.581 4.035 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)ccc1OCc1ccccc1 ZINC000459733361 1101350496 /nfs/dbraw/zinc/35/04/96/1101350496.db2.gz NKEHUBOTYQRAQL-LJQANCHMSA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000536962217 1101359288 /nfs/dbraw/zinc/35/92/88/1101359288.db2.gz GEEHBCSEELEDGV-HNAYVOBHSA-N 2 0 372.384 4.306 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1OCc1ccccc1 ZINC000459736656 1101366108 /nfs/dbraw/zinc/36/61/08/1101366108.db2.gz QGSDUIMIZSMAIZ-IBGZPJMESA-N 2 0 368.521 4.096 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cccc(Br)c21 ZINC000423369511 1101508233 /nfs/dbraw/zinc/50/82/33/1101508233.db2.gz DYSFCENHFBQTID-XIKOKIGWSA-N 2 0 357.295 4.390 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc(Br)cs2)C1 ZINC000518763529 1101518874 /nfs/dbraw/zinc/51/88/74/1101518874.db2.gz SQPAKFVCTBMAHY-ZIAGYGMSSA-N 2 0 359.377 4.358 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1O ZINC000426418774 1101538597 /nfs/dbraw/zinc/53/85/97/1101538597.db2.gz YDDFLRUJNQKNFL-OTWHNJEPSA-N 2 0 362.558 4.070 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000415001253 1101552490 /nfs/dbraw/zinc/55/24/90/1101552490.db2.gz KSALZNMZULKSPC-RDJZCZTQSA-N 2 0 371.912 4.199 20 0 FIADRP CCO[C@@H]1C[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C12CCCCC2 ZINC000537294004 1101612850 /nfs/dbraw/zinc/61/28/50/1101612850.db2.gz PZTRJNABXWTFRV-LEWJYISDSA-N 2 0 357.542 4.016 20 0 FIADRP C[C@H](C[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CC[NH+](C)CC1 ZINC000537295451 1101616957 /nfs/dbraw/zinc/61/69/57/1101616957.db2.gz LJPGBIQXTHZDCL-XLIONFOSSA-N 2 0 365.993 4.290 20 0 FIADRP CCC1(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000537307395 1101634511 /nfs/dbraw/zinc/63/45/11/1101634511.db2.gz NQWVNSPNMFFRAL-VSKRKVRLSA-N 2 0 368.565 4.226 20 0 FIADRP CC[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CCO1 ZINC000648446705 1101706666 /nfs/dbraw/zinc/70/66/66/1101706666.db2.gz PQTKYSUARUHPTN-MOPGFXCFSA-N 2 0 350.934 4.099 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000537445362 1101788653 /nfs/dbraw/zinc/78/86/53/1101788653.db2.gz BHJPHDRQPZAONS-GOSISDBHSA-N 2 0 355.526 4.170 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)N[C@H](C)c2ccccc2C)CC1 ZINC000519222206 1102019803 /nfs/dbraw/zinc/01/98/03/1102019803.db2.gz SFFBTFOBBXAMNJ-WOJBJXKFSA-N 2 0 373.585 4.005 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc(Cl)c2C)CC1 ZINC000519225060 1102021522 /nfs/dbraw/zinc/02/15/22/1102021522.db2.gz ORIKSCAAHDEPGR-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP COc1ccc(Cl)cc1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC001648978945 1102118241 /nfs/dbraw/zinc/11/82/41/1102118241.db2.gz DGYBXKHYYIQYSK-UHFFFAOYSA-N 2 0 364.942 4.412 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccc(F)cc2)CC1 ZINC000462819262 1102242240 /nfs/dbraw/zinc/24/22/40/1102242240.db2.gz RTYYLRADUQCTFL-YSFYHYPLSA-N 2 0 360.517 4.288 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc3ccccc3c2)CC1 ZINC000061070267 1102257233 /nfs/dbraw/zinc/25/72/33/1102257233.db2.gz HZVCMUDXZRFTKB-UHFFFAOYSA-N 2 0 373.544 4.267 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000415020366 1102263889 /nfs/dbraw/zinc/26/38/89/1102263889.db2.gz XIUJSLYJTXACJW-GFCCVEGCSA-N 2 0 368.344 4.180 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000415021931 1102264430 /nfs/dbraw/zinc/26/44/30/1102264430.db2.gz YZPOCQUMIBAOAQ-KRWDZBQOSA-N 2 0 368.550 4.267 20 0 FIADRP O[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1c(Cl)cccc1Cl ZINC001167967527 1102287074 /nfs/dbraw/zinc/28/70/74/1102287074.db2.gz GQAZYGCBTHGMDH-MUSFGAPCSA-N 2 0 369.336 4.022 20 0 FIADRP Clc1ccc(C2CCC([NH2+]CC3CC[NH+](C4COC4)CC3)CC2)cc1 ZINC001168340781 1102298830 /nfs/dbraw/zinc/29/88/30/1102298830.db2.gz CVUVWQBSELRZHD-UHFFFAOYSA-N 2 0 362.945 4.067 20 0 FIADRP CN1CC[C@@H]([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000550796834 1102329355 /nfs/dbraw/zinc/32/93/55/1102329355.db2.gz CXTJJYSDAPWWDG-BJESRGMDSA-N 2 0 350.506 4.189 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3CCC[NH2+][C@@H]3c3ccccc3)n2)cc1 ZINC001211850195 1102376863 /nfs/dbraw/zinc/37/68/63/1102376863.db2.gz WLWLCGIDCKPFRT-VQTJNVASSA-N 2 0 362.477 4.007 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2ccccn2)CC1)c1cccc(Br)c1 ZINC000121368063 1102391445 /nfs/dbraw/zinc/39/14/45/1102391445.db2.gz VBOPHDJGUHLAAR-AWEZNQCLSA-N 2 0 360.299 4.164 20 0 FIADRP COc1cc(C)ccc1[C@H](C)NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485520 1102426049 /nfs/dbraw/zinc/42/60/49/1102426049.db2.gz SQTLPMXQBGSCJD-FPOVZHCZSA-N 2 0 352.522 4.219 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1cccc(Br)c1 ZINC000532488674 1102430501 /nfs/dbraw/zinc/43/05/01/1102430501.db2.gz XOWCKHHFOQVKMX-CPUCHLNUSA-N 2 0 353.348 4.045 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000121817622 1102477012 /nfs/dbraw/zinc/47/70/12/1102477012.db2.gz WFUQZTNGPKTYJD-JOCHJYFZSA-N 2 0 350.506 4.240 20 0 FIADRP Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000122143668 1102531157 /nfs/dbraw/zinc/53/11/57/1102531157.db2.gz DBMKIMQQZNBATP-FQEVSTJZSA-N 2 0 371.569 4.218 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000060366856 1102538558 /nfs/dbraw/zinc/53/85/58/1102538558.db2.gz WJUXIUPAOXTACM-ZDUSSCGKSA-N 2 0 355.309 4.091 20 0 FIADRP CC(C)(C[NH3+])c1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccccc12 ZINC001167974263 1102546884 /nfs/dbraw/zinc/54/68/84/1102546884.db2.gz SUEXQLMGRAOZRK-DFNIBXOVSA-N 2 0 351.538 4.456 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000122745714 1102620603 /nfs/dbraw/zinc/62/06/03/1102620603.db2.gz WEUSLEBTSVLFHU-HNNXBMFYSA-N 2 0 358.555 4.286 20 0 FIADRP COCC1(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000550861101 1102644992 /nfs/dbraw/zinc/64/49/92/1102644992.db2.gz WETNHCIGGUAJLC-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP CC1(C)C[N@H+](CCc2cncs2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836554 1102675856 /nfs/dbraw/zinc/67/58/56/1102675856.db2.gz LDXPYTVEWPUWLL-OAQYLSRUSA-N 2 0 369.578 4.308 20 0 FIADRP Fc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c2ncccc12 ZINC000537650454 1102691320 /nfs/dbraw/zinc/69/13/20/1102691320.db2.gz GARKNLWSLIWCKO-UHFFFAOYSA-N 2 0 355.501 4.462 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2-n2cccn2)CC1 ZINC000550939706 1102701473 /nfs/dbraw/zinc/70/14/73/1102701473.db2.gz DNCHZZGSTKPTQT-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP COc1ccc(OC)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000123003483 1102736402 /nfs/dbraw/zinc/73/64/02/1102736402.db2.gz OKNUHOLQSWLCAS-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@@H](c2cccs2)[NH+]2CCCC2)C[C@@H]1c1ccccc1 ZINC000550977392 1102739212 /nfs/dbraw/zinc/73/92/12/1102739212.db2.gz SZRQCIVKSMDKPC-HBMCJLEFSA-N 2 0 369.578 4.310 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000551051578 1102863339 /nfs/dbraw/zinc/86/33/39/1102863339.db2.gz RFQSEFCPURWJIC-VXNXHJTFSA-N 2 0 363.549 4.076 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000551176112 1102948923 /nfs/dbraw/zinc/94/89/23/1102948923.db2.gz UOJALELOZIIAHO-JBJBFBLISA-N 2 0 351.538 4.103 20 0 FIADRP COc1ccc(-c2nc(C[NH2+][C@H](CCC[NH3+])c3ccccc3)cs2)cc1 ZINC000666975983 1103043902 /nfs/dbraw/zinc/04/39/02/1103043902.db2.gz QACYNZRNZNZKJE-HXUWFJFHSA-N 2 0 367.518 4.389 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000459380166 1103048867 /nfs/dbraw/zinc/04/88/67/1103048867.db2.gz BSRUCKHAFLJMMT-CQSZACIVSA-N 2 0 365.399 4.300 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCc2ccc(Br)cc2Cl)CC1 ZINC000551306341 1103062507 /nfs/dbraw/zinc/06/25/07/1103062507.db2.gz LFQMDACMDIESJR-UHFFFAOYSA-N 2 0 359.739 4.109 20 0 FIADRP CC[N@H+]([C@H](C)Cc1ccc(OC)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167984748 1103220147 /nfs/dbraw/zinc/22/01/47/1103220147.db2.gz QOWUXKBSHRARAS-JIMIUWDKSA-N 2 0 356.554 4.354 20 0 FIADRP CC[C@H](Cc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001203214041 1103250945 /nfs/dbraw/zinc/25/09/45/1103250945.db2.gz BBZBVTZYTLUCDO-IAGOWNOFSA-N 2 0 353.348 4.233 20 0 FIADRP CC(C)(C)c1ncc(CNCc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000551547041 1103343537 /nfs/dbraw/zinc/34/35/37/1103343537.db2.gz GAIMGEXBJDLCRZ-UHFFFAOYSA-N 2 0 366.553 4.440 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000507418745 1103369392 /nfs/dbraw/zinc/36/93/92/1103369392.db2.gz BNRDCLVOBKLODS-SFHVURJKSA-N 2 0 354.542 4.180 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCCOC1 ZINC000507469525 1103415972 /nfs/dbraw/zinc/41/59/72/1103415972.db2.gz KNYJZZJHIBIXIK-GCJKJVERSA-N 2 0 352.522 4.320 20 0 FIADRP CN(CC[N@H+](C)C1CCCCC1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000551801592 1103647005 /nfs/dbraw/zinc/64/70/05/1103647005.db2.gz IRFJRUSYOPMSLH-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP C[C@H](Cc1ccccc1F)[NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1 ZINC000188047327 1103808329 /nfs/dbraw/zinc/80/83/29/1103808329.db2.gz NMFZWHPXQDWGPK-MOPGFXCFSA-N 2 0 370.512 4.246 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2cc(Cl)ccc2C)CC1 ZINC000520045132 1104050024 /nfs/dbraw/zinc/05/00/24/1104050024.db2.gz BNBRIOOLDQTBMY-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP COC(=O)c1oc([C@H](C)N2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1C ZINC000441319384 1104274411 /nfs/dbraw/zinc/27/44/11/1104274411.db2.gz UUMNAZTZAJNGGW-ZWKOTPCHSA-N 2 0 362.514 4.024 20 0 FIADRP c1ccc2c(c1)nc([C@@H]1CCCC[NH2+]1)n2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994457 1104491120 /nfs/dbraw/zinc/49/11/20/1104491120.db2.gz FJJOYKQJEPNNNC-VHRCFOOQSA-N 2 0 364.537 4.429 20 0 FIADRP Fc1cccc(OC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167996220 1104615003 /nfs/dbraw/zinc/61/50/03/1104615003.db2.gz ZSQHTRGKEWRSNQ-YOFSQIOKSA-N 2 0 358.501 4.074 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000388829658 1105044573 /nfs/dbraw/zinc/04/45/73/1105044573.db2.gz WZJIUXFKGGPFMS-SQGPQFPESA-N 2 0 356.485 4.396 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000152375633 1105061928 /nfs/dbraw/zinc/06/19/28/1105061928.db2.gz PYOHKYIQFNZOEA-KGLIPLIRSA-N 2 0 358.473 4.476 20 0 FIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152406612 1105087847 /nfs/dbraw/zinc/08/78/47/1105087847.db2.gz AIKTVXSDKUICLE-MSOLQXFVSA-N 2 0 350.506 4.497 20 0 FIADRP C[C@@H]1CC([NH2+][C@H](CCO)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168009139 1105208190 /nfs/dbraw/zinc/20/81/90/1105208190.db2.gz HAKOLKNKABZTPB-DNVFCKCGSA-N 2 0 352.522 4.141 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2CCn4ccnc4C2)CCC3)cc1 ZINC000427899701 1105308095 /nfs/dbraw/zinc/30/80/95/1105308095.db2.gz XBRWIWSXOFZRPB-SJORKVTESA-N 2 0 364.518 4.297 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[NH+]1[C@H](C)CC[C@H]1C ZINC000508204650 1105358463 /nfs/dbraw/zinc/35/84/63/1105358463.db2.gz IHDBRZNQAMWRHO-MKXGPGLRSA-N 2 0 357.542 4.118 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](COCC3CC3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168064253 1106855893 /nfs/dbraw/zinc/85/58/93/1106855893.db2.gz PLVFFGSHRNMPML-YDLSIGKMSA-N 2 0 356.554 4.177 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC(C)C ZINC000192922090 1106902959 /nfs/dbraw/zinc/90/29/59/1106902959.db2.gz XLXKIASPKRYCHT-NRFANRHFSA-N 2 0 368.521 4.094 20 0 FIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530221136 1106915296 /nfs/dbraw/zinc/91/52/96/1106915296.db2.gz NOOIICFUAVILAO-SFHLNBCPSA-N 2 0 354.881 4.173 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530241451 1106923094 /nfs/dbraw/zinc/92/30/94/1106923094.db2.gz PYMVBWRJEYAYQM-CZUORRHYSA-N 2 0 357.325 4.145 20 0 FIADRP Cc1[nH+]c2ccccc2c(N2CCCN(Cc3cscn3)CC2)c1C ZINC000302064034 1107283712 /nfs/dbraw/zinc/28/37/12/1107283712.db2.gz DHBILDOSRUFQRC-UHFFFAOYSA-N 2 0 352.507 4.020 20 0 FIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc2c(cnn2C(C)C)c1 ZINC000530952999 1107431058 /nfs/dbraw/zinc/43/10/58/1107431058.db2.gz LWVRSPIOYMVOOY-UYAOXDASSA-N 2 0 357.546 4.002 20 0 FIADRP Cc1ccc2[nH+]ccc(NCc3ccccc3C[N@@H+]3CCC[C@@H]3CO)c2c1 ZINC000302906190 1107485147 /nfs/dbraw/zinc/48/51/47/1107485147.db2.gz WOFBIGYJBBYFLC-HXUWFJFHSA-N 2 0 361.489 4.112 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+][C@@H]3CC[C@@H](c4cccc(F)c4)C3)sc2C1 ZINC000475555702 1107725530 /nfs/dbraw/zinc/72/55/30/1107725530.db2.gz NCYYTPABGNJFPX-SJLPKXTDSA-N 2 0 373.541 4.475 20 0 FIADRP c1ccc(COc2ccccc2CNC2CC([NH+]3CCCCC3)C2)cc1 ZINC000475577733 1107786472 /nfs/dbraw/zinc/78/64/72/1107786472.db2.gz HFGKVGBBVMBQIH-UHFFFAOYSA-N 2 0 350.506 4.372 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)CC(=O)Nc1ccccc1C ZINC000531726008 1108096383 /nfs/dbraw/zinc/09/63/83/1108096383.db2.gz ZBSJOVDVZKFZLQ-DYXWJJEUSA-N 2 0 359.558 4.202 20 0 FIADRP C[C@H](CC[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)[N@H+](C)Cc1ccccc1 ZINC000531725755 1108098498 /nfs/dbraw/zinc/09/84/98/1108098498.db2.gz BVGTZUNCEDYKDZ-MSOLQXFVSA-N 2 0 365.521 4.133 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000531717589 1108110133 /nfs/dbraw/zinc/11/01/33/1108110133.db2.gz IJXQVEXVGKAOPC-INIZCTEOSA-N 2 0 352.494 4.150 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccncc1 ZINC000453085286 1108155336 /nfs/dbraw/zinc/15/53/36/1108155336.db2.gz JSSNPLXGNWVBCZ-JOCHJYFZSA-N 2 0 353.510 4.043 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2sccc21 ZINC000453102615 1108171175 /nfs/dbraw/zinc/17/11/75/1108171175.db2.gz QDUANONEQDTSSJ-HRAATJIYSA-N 2 0 370.562 4.433 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cs1 ZINC000453112915 1108181021 /nfs/dbraw/zinc/18/10/21/1108181021.db2.gz UASKXSPRAPCOIM-HOTGVXAUSA-N 2 0 361.530 4.359 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453127596 1108206249 /nfs/dbraw/zinc/20/62/49/1108206249.db2.gz PPGBOQLOEPGLFB-ZLNRFVROSA-N 2 0 366.553 4.005 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453214566 1108284287 /nfs/dbraw/zinc/28/42/87/1108284287.db2.gz DNAFQOZSMDACHO-SJLPKXTDSA-N 2 0 356.535 4.167 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CCOC4(CCC4)C3)[C@@H]3CCC[C@H]32)cc1 ZINC000453331660 1108388648 /nfs/dbraw/zinc/38/86/48/1108388648.db2.gz ZQCFLUHLEUHZHB-WZYRSQIMSA-N 2 0 368.565 4.369 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@H](c3ccco3)[NH+]3CCCCC3)CC2)C1 ZINC000531947991 1108429890 /nfs/dbraw/zinc/42/98/90/1108429890.db2.gz DCAJTNNZECYQNC-BAGYTPMASA-N 2 0 373.585 4.439 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@H](c3ccco3)[NH+]3CCCCC3)CC2)C1 ZINC000531947992 1108430125 /nfs/dbraw/zinc/43/01/25/1108430125.db2.gz DCAJTNNZECYQNC-CEMLEFRQSA-N 2 0 373.585 4.439 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CCC2 ZINC000531960473 1108451157 /nfs/dbraw/zinc/45/11/57/1108451157.db2.gz POYMBLGTAPHQCR-HSZRJFAPSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc2ccccc21 ZINC000531965229 1108461037 /nfs/dbraw/zinc/46/10/37/1108461037.db2.gz ASLPAPCLUWEXFR-CJFMBICVSA-N 2 0 373.544 4.479 20 0 FIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000531971169 1108482948 /nfs/dbraw/zinc/48/29/48/1108482948.db2.gz BOLJYRRHCXNJMN-HXOBKFHXSA-N 2 0 368.496 4.323 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000531979276 1108495212 /nfs/dbraw/zinc/49/52/12/1108495212.db2.gz MLFUCBSPSFUIKM-HFAKWTLXSA-N 2 0 365.732 4.344 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CC1=Cc2ccccc2OC1 ZINC000532119772 1108679271 /nfs/dbraw/zinc/67/92/71/1108679271.db2.gz GMDFKBJPVSYSNJ-RTBURBONSA-N 2 0 362.517 4.209 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000532210718 1108712048 /nfs/dbraw/zinc/71/20/48/1108712048.db2.gz MUIDJHWWHGKEBL-KRWDZBQOSA-N 2 0 365.521 4.264 20 0 FIADRP CC[NH+]1CCC([NH2+]CCCCSc2ccccc2Br)CC1 ZINC000532224507 1108722669 /nfs/dbraw/zinc/72/26/69/1108722669.db2.gz FMCVMKWCRRXJGW-UHFFFAOYSA-N 2 0 371.388 4.395 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]C2CCN(C(=O)CC(C)(C)C)CC2)c1 ZINC000532301012 1108756428 /nfs/dbraw/zinc/75/64/28/1108756428.db2.gz SZZUIIZJUCTDQW-UHFFFAOYSA-N 2 0 373.585 4.044 20 0 FIADRP Cc1cc(N2CCC3(CCC[N@H+]3C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000445598931 1108910907 /nfs/dbraw/zinc/91/09/07/1108910907.db2.gz FLMKFRATHFKXOW-UHFFFAOYSA-N 2 0 361.436 4.209 20 0 FIADRP CN(C(=O)c1cccc(C[NH+]2CCCC2)c1)C(C)(C)C[NH+]1CCCCCC1 ZINC000428417135 1108973592 /nfs/dbraw/zinc/97/35/92/1108973592.db2.gz BMOGDCHZVMRTJK-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@H](C)c3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000524750885 1109137724 /nfs/dbraw/zinc/13/77/24/1109137724.db2.gz DVTPMUZUUMXOTN-KNQAVFIVSA-N 2 0 357.586 4.145 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822905 1109350286 /nfs/dbraw/zinc/35/02/86/1109350286.db2.gz ZEBWIQCHAMIYHQ-NFBKMPQASA-N 2 0 357.586 4.090 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446840698 1109361562 /nfs/dbraw/zinc/36/15/62/1109361562.db2.gz HYDQMINRONCJSO-MRXNPFEDSA-N 2 0 359.739 4.485 20 0 FIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000446933893 1109394072 /nfs/dbraw/zinc/39/40/72/1109394072.db2.gz QIJMYVLRVSNDCJ-HSZRJFAPSA-N 2 0 367.537 4.129 20 0 FIADRP CCC(CC)[C@H](CNC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCC1 ZINC000525694205 1109485231 /nfs/dbraw/zinc/48/52/31/1109485231.db2.gz IBKBGYZBXJSQLL-QHCPKHFHSA-N 2 0 357.586 4.141 20 0 FIADRP C[C@@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1cccc(Cl)c1 ZINC000525875037 1109542447 /nfs/dbraw/zinc/54/24/47/1109542447.db2.gz IVJSEPPIRICUNR-KRWDZBQOSA-N 2 0 350.934 4.020 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cnn1-c1cccc(Cl)c1 ZINC000447556146 1109580460 /nfs/dbraw/zinc/58/04/60/1109580460.db2.gz FFQGENIMGMFLLU-HNNXBMFYSA-N 2 0 372.944 4.359 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c2ccccc21 ZINC000447582092 1109585305 /nfs/dbraw/zinc/58/53/05/1109585305.db2.gz XWGUKZSINZXSSW-GPJHCHHRSA-N 2 0 356.554 4.229 20 0 FIADRP Fc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000447596562 1109591076 /nfs/dbraw/zinc/59/10/76/1109591076.db2.gz CSEOOJHMAMUUJE-HUUJSLGLSA-N 2 0 352.453 4.044 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1 ZINC000508603030 1109606506 /nfs/dbraw/zinc/60/65/06/1109606506.db2.gz GUFHJMBZWZPYIB-IBGZPJMESA-N 2 0 373.566 4.013 20 0 FIADRP C[C@@H](CC[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000447725026 1109634822 /nfs/dbraw/zinc/63/48/22/1109634822.db2.gz ABGBOJQVNGVVEB-NRFANRHFSA-N 2 0 371.613 4.308 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C[C@@H](C)c3ccccc3)CC2)cc1 ZINC000447818248 1109647611 /nfs/dbraw/zinc/64/76/11/1109647611.db2.gz VYUGQPFVDUNIIE-LJQANCHMSA-N 2 0 352.522 4.301 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](C/C=C/c2ccc(Cl)cc2)CC1 ZINC000527048366 1109679907 /nfs/dbraw/zinc/67/99/07/1109679907.db2.gz TXOYPYMYQWOXCQ-AATRIKPKSA-N 2 0 350.934 4.176 20 0 FIADRP Fc1cc(C(F)(F)F)cc(C2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC000527487712 1109767745 /nfs/dbraw/zinc/76/77/45/1109767745.db2.gz AIRNYVYZYQJDQK-UHFFFAOYSA-N 2 0 370.434 4.340 20 0 FIADRP C[C@@H]([NH2+]CCCOc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544422443 1109791691 /nfs/dbraw/zinc/79/16/91/1109791691.db2.gz XXIIEMIBPMVVNK-IAGOWNOFSA-N 2 0 350.934 4.352 20 0 FIADRP CC(C)c1cccc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000527859421 1109840874 /nfs/dbraw/zinc/84/08/74/1109840874.db2.gz QKJZGNOWUSRFIM-HYBUGGRVSA-N 2 0 365.565 4.449 20 0 FIADRP Fc1ccccc1-c1ncc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)s1 ZINC000449029030 1109959563 /nfs/dbraw/zinc/95/95/63/1109959563.db2.gz NKBIIPHVTNRJMA-MRXNPFEDSA-N 2 0 359.514 4.400 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(CCc3ccccc3)s2)[C@@H](C)C1 ZINC000449028944 1109959572 /nfs/dbraw/zinc/95/95/72/1109959572.db2.gz NHULIUGHTDNGAC-FXAWDEMLSA-N 2 0 357.567 4.090 20 0 FIADRP c1c2cccnc2oc1C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449034609 1109961250 /nfs/dbraw/zinc/96/12/50/1109961250.db2.gz CYKHMXZUTUBUKF-UHFFFAOYSA-N 2 0 361.489 4.316 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2cccc3cccnc32)CC1 ZINC000449076538 1109973936 /nfs/dbraw/zinc/97/39/36/1109973936.db2.gz UBXHLZGCDSDGEO-FQEVSTJZSA-N 2 0 373.544 4.463 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000449081243 1109975035 /nfs/dbraw/zinc/97/50/35/1109975035.db2.gz DAQHGRLKLLLLDK-VXKWHMMOSA-N 3 0 371.613 4.326 20 0 FIADRP COCc1cccc(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)c1 ZINC000449081976 1109975575 /nfs/dbraw/zinc/97/55/75/1109975575.db2.gz JJBSHXGAAWKABK-IBGZPJMESA-N 2 0 352.522 4.018 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CC(c3ccc(Br)cc3F)C2)C1 ZINC000449092102 1109978925 /nfs/dbraw/zinc/97/89/25/1109978925.db2.gz LHGMOZBZCZCZFW-HLIUYOAVSA-N 2 0 369.322 4.156 20 0 FIADRP COc1ccc(CC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)cc1F ZINC000449121432 1109980186 /nfs/dbraw/zinc/98/01/86/1109980186.db2.gz HSIFSULHJMAFJM-SFHVURJKSA-N 2 0 370.512 4.062 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3c(OC)cccc23)[C@@H](C)C1 ZINC000449137083 1109983976 /nfs/dbraw/zinc/98/39/76/1109983976.db2.gz DJJXNOLKXCRUQB-PGRDOPGGSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@H](CCc1cccn1C)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449149293 1109986089 /nfs/dbraw/zinc/98/60/89/1109986089.db2.gz NDFLDJMEGRPWJF-WOJBJXKFSA-N 2 0 353.554 4.031 20 0 FIADRP FC(F)(F)c1ncccc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000528424528 1109990435 /nfs/dbraw/zinc/99/04/35/1109990435.db2.gz ZVBYEZASBBLMOH-UHFFFAOYSA-N 2 0 355.448 4.188 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449186262 1109994281 /nfs/dbraw/zinc/99/42/81/1109994281.db2.gz JCUWQISXVOUBRM-SJORKVTESA-N 2 0 355.526 4.080 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC(NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000449185845 1109994532 /nfs/dbraw/zinc/99/45/32/1109994532.db2.gz OCPWIHJPHDOWCL-HXUWFJFHSA-N 2 0 369.597 4.079 20 0 FIADRP Cc1nn(C)c(C)c1CCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449208724 1109996476 /nfs/dbraw/zinc/99/64/76/1109996476.db2.gz SYYNHKBEQJIKJN-UHFFFAOYSA-N 2 0 362.606 4.238 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCc2cnc(C3CC3)nc2)CC1 ZINC000449201189 1109997728 /nfs/dbraw/zinc/99/77/28/1109997728.db2.gz DFSIAHBQXBYJME-UHFFFAOYSA-N 2 0 358.574 4.165 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cccnc32)CC1 ZINC000449218613 1109999732 /nfs/dbraw/zinc/99/97/32/1109999732.db2.gz JZQPQNNDCHMAGQ-LJQANCHMSA-N 2 0 359.517 4.420 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000449305232 1110022308 /nfs/dbraw/zinc/02/23/08/1110022308.db2.gz FJKOQXMIAPSDPB-MJGOQNOKSA-N 2 0 350.497 4.497 20 0 FIADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000449343040 1110034693 /nfs/dbraw/zinc/03/46/93/1110034693.db2.gz HFXDGLUAUMKDHU-FPOVZHCZSA-N 2 0 358.570 4.330 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000449342831 1110034807 /nfs/dbraw/zinc/03/48/07/1110034807.db2.gz FPURWCPKRWRPQF-FGZHOGPDSA-N 2 0 356.554 4.084 20 0 FIADRP CC1(C)C[N@H+](CC2CCOCC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413040 1110055235 /nfs/dbraw/zinc/05/52/35/1110055235.db2.gz HGWBWLXVAZHCOQ-QFIPXVFZSA-N 2 0 356.554 4.036 20 0 FIADRP COc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(-c2ccccc2)cc1OC ZINC000449554493 1110108921 /nfs/dbraw/zinc/10/89/21/1110108921.db2.gz BRESVHWLEVVWEQ-IHWFROFDSA-N 2 0 366.505 4.086 20 0 FIADRP CC(C)[N@H+](C)CC1CCN(Cc2ncc(Cl)cc2Br)CC1 ZINC000529526202 1110283709 /nfs/dbraw/zinc/28/37/09/1110283709.db2.gz IJGFEFJVEOZTHW-UHFFFAOYSA-N 2 0 374.754 4.050 20 0 FIADRP C[C@H](c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)cc1)C(F)(F)F ZINC000450599895 1110318375 /nfs/dbraw/zinc/31/83/75/1110318375.db2.gz LXSCPGWJCAMUJQ-DQEVTTJGSA-N 2 0 370.459 4.036 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCCC1(F)F ZINC000450644134 1110322209 /nfs/dbraw/zinc/32/22/09/1110322209.db2.gz BBCWLUFYNXBTPK-GOSISDBHSA-N 2 0 351.485 4.445 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2Cc1ccc(F)c(-c2cccs2)c1 ZINC000538799088 1111295456 /nfs/dbraw/zinc/29/54/56/1111295456.db2.gz MMWQXXMXTUHTMH-AHRSYUTCSA-N 2 0 374.525 4.238 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1sc(CCOC)nc1C ZINC000538869207 1111328514 /nfs/dbraw/zinc/32/85/14/1111328514.db2.gz IMVOTAZWICYZTF-NJAFHUGGSA-N 2 0 367.603 4.192 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000461794487 1111358929 /nfs/dbraw/zinc/35/89/29/1111358929.db2.gz GXSCATROTUREIH-GUDVDZBRSA-N 2 0 365.359 4.377 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1CNC1CC[NH+](CC)CC1 ZINC000461800241 1111368132 /nfs/dbraw/zinc/36/81/32/1111368132.db2.gz SEIYWDZQTMHPRC-UHFFFAOYSA-N 2 0 369.509 4.237 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCc1cccc(F)c1)c1ccccc1O2 ZINC000539395544 1111542257 /nfs/dbraw/zinc/54/22/57/1111542257.db2.gz QQECWBSPZITUEF-OAQYLSRUSA-N 2 0 368.496 4.336 20 0 FIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000552061394 1111562457 /nfs/dbraw/zinc/56/24/57/1111562457.db2.gz IXQGWRKFYKPTFC-SFHVURJKSA-N 2 0 355.526 4.071 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCOC5(CCC5)C4)[C@H]3C2)cc1 ZINC000552062591 1111562958 /nfs/dbraw/zinc/56/29/58/1111562958.db2.gz AGTKBNUBJBPMJL-BJESRGMDSA-N 2 0 368.565 4.369 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCOC5(CCC5)C4)[C@@H]3C2)cc1 ZINC000552062590 1111563008 /nfs/dbraw/zinc/56/30/08/1111563008.db2.gz AGTKBNUBJBPMJL-AFXVXQJMSA-N 2 0 368.565 4.369 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)CC1 ZINC000552067386 1111565585 /nfs/dbraw/zinc/56/55/85/1111565585.db2.gz IGUTUHUGTUSKFG-HDJSHQJTSA-N 2 0 356.554 4.224 20 0 FIADRP CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000552087480 1111569577 /nfs/dbraw/zinc/56/95/77/1111569577.db2.gz JHRIZYDTVDCJJE-WWPVKYPJSA-N 2 0 356.554 4.334 20 0 FIADRP C[C@@H](O)[C@@](C)(C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)Cc1ccccc1 ZINC000477858851 1111579930 /nfs/dbraw/zinc/57/99/30/1111579930.db2.gz MWUDVJKBELXPND-MYSJAJEPSA-N 2 0 372.597 4.249 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000477869549 1111591065 /nfs/dbraw/zinc/59/10/65/1111591065.db2.gz XUSZAONIWSWPDE-XHBSWPGZSA-N 2 0 354.325 4.336 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CC2(C[NH+](C)C)CCCC2)cc1 ZINC000552285143 1111647862 /nfs/dbraw/zinc/64/78/62/1111647862.db2.gz DQOSWCBRMWQVPT-JOCHJYFZSA-N 2 0 367.537 4.086 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000552325641 1111670413 /nfs/dbraw/zinc/67/04/13/1111670413.db2.gz XVSMJLLTFXMPCQ-YNVMFWSZSA-N 2 0 352.950 4.169 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2ccccc2)cc1 ZINC000643534710 1111766807 /nfs/dbraw/zinc/76/68/07/1111766807.db2.gz AQAAQPDQQBTXKR-OALUTQOASA-N 2 0 358.432 4.109 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535832 1111771454 /nfs/dbraw/zinc/77/14/54/1111771454.db2.gz JVUJZBNDGNVRNP-DLBZAZTESA-N 2 0 374.326 4.040 20 0 FIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)c2ccc(C(=O)OC)o2)CC1)CC(C)C ZINC000552858814 1111833737 /nfs/dbraw/zinc/83/37/37/1111833737.db2.gz MOIJPEWRVZXCEG-KRWDZBQOSA-N 2 0 364.530 4.207 20 0 FIADRP Cc1cc(C)cc(CC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000553149963 1111918578 /nfs/dbraw/zinc/91/85/78/1111918578.db2.gz RWKYXBCJFSUFMF-JOCHJYFZSA-N 2 0 364.533 4.424 20 0 FIADRP c1ccc(COc2ccccc2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000448549514 1111929336 /nfs/dbraw/zinc/92/93/36/1111929336.db2.gz AHWWPICOXWWNJW-UHFFFAOYSA-N 2 0 373.500 4.419 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc(F)ccc1F ZINC000479055248 1111937882 /nfs/dbraw/zinc/93/78/82/1111937882.db2.gz GXTOKFXUXLOGOY-YRNRMSPPSA-N 2 0 354.485 4.141 20 0 FIADRP Cc1ccc([C@@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479268209 1111982868 /nfs/dbraw/zinc/98/28/68/1111982868.db2.gz CFMGTHPPDDNCTN-REWPJTCUSA-N 2 0 357.586 4.090 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)C1 ZINC000479358114 1111998068 /nfs/dbraw/zinc/99/80/68/1111998068.db2.gz ITJOBOOUQXSMCA-DYVFJYSZSA-N 2 0 351.332 4.103 20 0 FIADRP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc(Br)ccc21 ZINC000479335856 1111999040 /nfs/dbraw/zinc/99/90/40/1111999040.db2.gz MWSWXZBFGCJHSM-DAYGRLMNSA-N 2 0 363.343 4.388 20 0 FIADRP CC(C)[C@H](NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1F ZINC000479396243 1112012049 /nfs/dbraw/zinc/01/20/49/1112012049.db2.gz VBGADQANYJCDLY-ACRUOGEOSA-N 2 0 366.496 4.019 20 0 FIADRP C[C@H](NC1CC([NH+]2CCCCC2)C1)c1ccc(F)c(Br)c1 ZINC000479542226 1112063393 /nfs/dbraw/zinc/06/33/93/1112063393.db2.gz WFXRMHFOSLMNRH-GRTSSRMGSA-N 2 0 355.295 4.256 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000553715921 1112064778 /nfs/dbraw/zinc/06/47/78/1112064778.db2.gz MUMSLNUMWDOWPN-RRPUWOKSSA-N 2 0 369.597 4.107 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCO[C@@H](C(F)(F)F)C3)c2)CC1 ZINC000554072895 1112183129 /nfs/dbraw/zinc/18/31/29/1112183129.db2.gz UWSWXKUVPZIUBN-RBUKOAKNSA-N 2 0 370.459 4.118 20 0 FIADRP Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480022873 1112235573 /nfs/dbraw/zinc/23/55/73/1112235573.db2.gz VZMOFSKHZKPDOL-HSALFYBXSA-N 2 0 352.522 4.455 20 0 FIADRP CC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000480165685 1112313377 /nfs/dbraw/zinc/31/33/77/1112313377.db2.gz IDXVZCAZBHVVPZ-HSZRJFAPSA-N 2 0 367.537 4.157 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)c3cccs3)CC2)c1 ZINC000480218512 1112336090 /nfs/dbraw/zinc/33/60/90/1112336090.db2.gz DBBSSXXXRXFYMR-IBGZPJMESA-N 2 0 357.567 4.310 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC000480426792 1112422868 /nfs/dbraw/zinc/42/28/68/1112422868.db2.gz ODDZCGDEJCMWEX-HSZRJFAPSA-N 2 0 350.506 4.458 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000480608500 1112498985 /nfs/dbraw/zinc/49/89/85/1112498985.db2.gz LFWQYAJSWPRNDU-GUDVDZBRSA-N 2 0 374.573 4.235 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000480612383 1112501195 /nfs/dbraw/zinc/50/11/95/1112501195.db2.gz LRTLBKCIECLMEP-APWZRJJASA-N 2 0 371.491 4.162 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000480618640 1112511304 /nfs/dbraw/zinc/51/13/04/1112511304.db2.gz YDGVTWPKCHUBPC-VQTJNVASSA-N 2 0 351.538 4.030 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1 ZINC000480645941 1112519730 /nfs/dbraw/zinc/51/97/30/1112519730.db2.gz YFCKGCXDUKPTJN-HYVLGVRCSA-N 2 0 371.613 4.245 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000554858678 1112533218 /nfs/dbraw/zinc/53/32/18/1112533218.db2.gz UDBLIZNJJBUCAE-BJKOFHAPSA-N 2 0 363.549 4.309 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccc(F)cc1 ZINC000480698271 1112560137 /nfs/dbraw/zinc/56/01/37/1112560137.db2.gz NHRXTROGMVNPET-HSZRJFAPSA-N 2 0 369.528 4.204 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccc(F)cc1 ZINC000480698272 1112560344 /nfs/dbraw/zinc/56/03/44/1112560344.db2.gz NHRXTROGMVNPET-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480712228 1112566096 /nfs/dbraw/zinc/56/60/96/1112566096.db2.gz SBIFGEVWOJJKAW-JOCHJYFZSA-N 2 0 366.553 4.019 20 0 FIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000480744285 1112583310 /nfs/dbraw/zinc/58/33/10/1112583310.db2.gz YFLYOXDUVBMKPJ-XNISGKROSA-N 2 0 357.325 4.366 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480755254 1112588472 /nfs/dbraw/zinc/58/84/72/1112588472.db2.gz GNGLXXYPOSAXAS-MELADBBJSA-N 2 0 357.325 4.223 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)C1 ZINC000481308036 1112881306 /nfs/dbraw/zinc/88/13/06/1112881306.db2.gz AFOPMMRLTRKIRB-AVRDEDQJSA-N 2 0 356.485 4.050 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](C)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000481418476 1112936641 /nfs/dbraw/zinc/93/66/41/1112936641.db2.gz LDSPMBVWEXLIOA-ATZDWAIDSA-N 2 0 371.491 4.018 20 0 FIADRP Cc1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555618215 1112950187 /nfs/dbraw/zinc/95/01/87/1112950187.db2.gz FBHRDQKHMIOMFA-QHCPKHFHSA-N 2 0 364.533 4.013 20 0 FIADRP C[NH+](C)C1CCC(Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC1 ZINC000899875122 1113038338 /nfs/dbraw/zinc/03/83/38/1113038338.db2.gz RQIYWSCIXVIINU-UHFFFAOYSA-N 2 0 353.388 4.418 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(F)c1 ZINC000481710377 1113050106 /nfs/dbraw/zinc/05/01/06/1113050106.db2.gz BQLDMIQDZXXXRO-OAHLLOKOSA-N 2 0 362.514 4.459 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2ccccc2n1 ZINC000481724322 1113055919 /nfs/dbraw/zinc/05/59/19/1113055919.db2.gz HCDHCLYXIZTPKB-AUSIDOKSSA-N 2 0 359.517 4.278 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)COC2 ZINC000481719448 1113059552 /nfs/dbraw/zinc/05/95/52/1113059552.db2.gz CHTPNGIUOHYMOC-INIZCTEOSA-N 2 0 356.535 4.341 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2c(s1)CCCC2 ZINC000481734128 1113059876 /nfs/dbraw/zinc/05/98/76/1113059876.db2.gz GOIWIKUDAUFXSN-MRXNPFEDSA-N 2 0 358.551 4.418 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000481738610 1113063288 /nfs/dbraw/zinc/06/32/88/1113063288.db2.gz FABDBCZICIWHNH-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCCO2 ZINC000481740828 1113063729 /nfs/dbraw/zinc/06/37/29/1113063729.db2.gz IPBLHPFNWRJCIU-NRFANRHFSA-N 2 0 368.521 4.247 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)[NH+](C)C)cc1 ZINC000481947676 1113142293 /nfs/dbraw/zinc/14/22/93/1113142293.db2.gz NFGVAJLGMKAEGI-QDSKXPNFSA-N 2 0 365.565 4.098 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)[NH+](C)C)cc1 ZINC000481947677 1113142424 /nfs/dbraw/zinc/14/24/24/1113142424.db2.gz NFGVAJLGMKAEGI-ZTCOLXNVSA-N 2 0 365.565 4.098 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)[NH+](C)C)cc1 ZINC000481947674 1113142505 /nfs/dbraw/zinc/14/25/05/1113142505.db2.gz NFGVAJLGMKAEGI-HUVFLSCGSA-N 2 0 365.565 4.098 20 0 FIADRP CC[NH+](CC)CCOC1CCN(c2cc(C)[nH+]c3ccc(F)cc32)CC1 ZINC000481985803 1113144948 /nfs/dbraw/zinc/14/49/48/1113144948.db2.gz YVOXNKCIQQRTDR-UHFFFAOYSA-N 2 0 359.489 4.010 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)sc1C ZINC000482076173 1113171979 /nfs/dbraw/zinc/17/19/79/1113171979.db2.gz CTWAVPBLZWTTGH-OXQOHEQNSA-N 2 0 357.567 4.057 20 0 FIADRP c1csc(CN2CCC[C@@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)c1 ZINC000482131242 1113184557 /nfs/dbraw/zinc/18/45/57/1113184557.db2.gz WWAVYYGBNOUZGL-PXNSSMCTSA-N 2 0 356.535 4.464 20 0 FIADRP COc1ccc(OC)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000162903427 1113207063 /nfs/dbraw/zinc/20/70/63/1113207063.db2.gz CXTUDVNJMGDYRS-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCCO2 ZINC000162908236 1113219188 /nfs/dbraw/zinc/21/91/88/1113219188.db2.gz UEPCMCOHSVHYRU-NRFANRHFSA-N 2 0 354.469 4.425 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000482339591 1113229494 /nfs/dbraw/zinc/22/94/94/1113229494.db2.gz VRUXCEIQJXEZJM-HYBUGGRVSA-N 3 0 365.565 4.139 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000482341780 1113229813 /nfs/dbraw/zinc/22/98/13/1113229813.db2.gz COCLZDZIPDTVDY-MRXNPFEDSA-N 2 0 357.567 4.425 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)C1 ZINC000482345929 1113230788 /nfs/dbraw/zinc/23/07/88/1113230788.db2.gz SURIJBXDBAMLFI-SCLBCKFNSA-N 2 0 369.322 4.286 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000482441434 1113257395 /nfs/dbraw/zinc/25/73/95/1113257395.db2.gz VBGJVNANOBGTBG-IFMALSPDSA-N 2 0 374.532 4.088 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cc1N(C)C ZINC000162932667 1113258261 /nfs/dbraw/zinc/25/82/61/1113258261.db2.gz FHHCQUAQUNPMTO-KRWDZBQOSA-N 2 0 355.501 4.338 20 0 FIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482445204 1113259058 /nfs/dbraw/zinc/25/90/58/1113259058.db2.gz AQDWNMJARJFAAJ-CTNGQTDRSA-N 2 0 352.522 4.301 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(OC)c1 ZINC000162934164 1113259525 /nfs/dbraw/zinc/25/95/25/1113259525.db2.gz PQQUEIYEBNHNDN-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000482462127 1113268567 /nfs/dbraw/zinc/26/85/67/1113268567.db2.gz UVTZSSFLJFSYGV-YADARESESA-N 2 0 374.532 4.028 20 0 FIADRP CC(C)CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482548246 1113291523 /nfs/dbraw/zinc/29/15/23/1113291523.db2.gz FDUFLAOHEQHQRV-YLJYHZDGSA-N 2 0 351.966 4.043 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccccc1 ZINC000482560425 1113295948 /nfs/dbraw/zinc/29/59/48/1113295948.db2.gz AHZXJLLYXVJDMP-DYESRHJHSA-N 2 0 355.501 4.379 20 0 FIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000482873125 1113385460 /nfs/dbraw/zinc/38/54/60/1113385460.db2.gz KELPWFXHHMLAIO-LEWJYISDSA-N 2 0 372.578 4.167 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(-c2cccs2)cc1 ZINC000482898713 1113394873 /nfs/dbraw/zinc/39/48/73/1113394873.db2.gz ZLAPUQWUVSUCBJ-XLIONFOSSA-N 2 0 358.551 4.303 20 0 FIADRP Cc1ccncc1C[NH+](C)Cc1cccc(C[N@@H+](C)Cc2cnccc2C)c1 ZINC000483014980 1113425198 /nfs/dbraw/zinc/42/51/98/1113425198.db2.gz HENHPYLHSQETIJ-UHFFFAOYSA-N 2 0 374.532 4.357 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)[C@H](C)C1 ZINC000483151711 1113455941 /nfs/dbraw/zinc/45/59/41/1113455941.db2.gz HHCVUOXTHHWUBR-HBFSDRIKSA-N 2 0 350.522 4.230 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)CC1 ZINC000486404282 1113560320 /nfs/dbraw/zinc/56/03/20/1113560320.db2.gz YLGWZTLKVIWUEB-IYSOMAHNSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)CC1 ZINC000486404284 1113560518 /nfs/dbraw/zinc/56/05/18/1113560518.db2.gz YLGWZTLKVIWUEB-MHADKKCISA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000668713662 1113680583 /nfs/dbraw/zinc/68/05/83/1113680583.db2.gz XAIXGMZKMHSPEF-SIKLNZKXSA-N 2 0 364.533 4.215 20 0 FIADRP CCOc1ccc(CNC2CC[NH+](Cc3ccccc3C)CC2)cc1F ZINC000486960900 1113687635 /nfs/dbraw/zinc/68/76/35/1113687635.db2.gz AKLIUNBOELADIL-UHFFFAOYSA-N 2 0 356.485 4.287 20 0 FIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488408249 1113921248 /nfs/dbraw/zinc/92/12/48/1113921248.db2.gz GUZPCYPGFJTBQE-AEFFLSMTSA-N 2 0 352.613 4.470 20 0 FIADRP C[C@@H]1[C@@H](NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000489912910 1114191830 /nfs/dbraw/zinc/19/18/30/1114191830.db2.gz XLDZSBFDLPZACK-XXBNENTESA-N 2 0 355.570 4.036 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000490151165 1114218867 /nfs/dbraw/zinc/21/88/67/1114218867.db2.gz POUPIAIDKCLTKQ-NRFANRHFSA-N 2 0 374.912 4.132 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cn1 ZINC000490120710 1114220540 /nfs/dbraw/zinc/22/05/40/1114220540.db2.gz WHTOZNPJXKEUIK-LZJOCLMNSA-N 2 0 371.500 4.071 20 0 FIADRP COC(=O)c1csc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000586789168 1114394104 /nfs/dbraw/zinc/39/41/04/1114394104.db2.gz ZFSHVYMUMXPJGS-INIZCTEOSA-N 2 0 372.534 4.098 20 0 FIADRP CCCc1nc(C)c(CN(C)C[C@@H]2CC[N@H+](Cc3ccc(C)s3)C2)o1 ZINC000572487640 1114649768 /nfs/dbraw/zinc/64/97/68/1114649768.db2.gz MPPZPXAODJEZJE-KRWDZBQOSA-N 2 0 361.555 4.259 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641808 1114819933 /nfs/dbraw/zinc/81/99/33/1114819933.db2.gz RVEIIZLGRUVTAL-HDICACEKSA-N 2 0 362.521 4.331 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000589837698 1114847944 /nfs/dbraw/zinc/84/79/44/1114847944.db2.gz YUZLRIGIONTQGV-IRXDYDNUSA-N 2 0 372.475 4.475 20 0 FIADRP COc1ccc(C)cc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000589998752 1114872484 /nfs/dbraw/zinc/87/24/84/1114872484.db2.gz HYBYCVUHRNFZPV-UHFFFAOYSA-N 2 0 352.522 4.348 20 0 FIADRP Cc1cc(-c2noc([C@@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)n2)ccc1F ZINC000590786166 1114974242 /nfs/dbraw/zinc/97/42/42/1114974242.db2.gz DSFZRUAFWKAAHE-MRXNPFEDSA-N 2 0 374.504 4.297 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2c(Cl)cccc2Cl)CC1 ZINC000590786650 1114974428 /nfs/dbraw/zinc/97/44/28/1114974428.db2.gz LFJOUBQACHZEJH-UHFFFAOYSA-N 2 0 359.341 4.424 20 0 FIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1C ZINC000591709019 1115125546 /nfs/dbraw/zinc/12/55/46/1115125546.db2.gz JMWZDIMISGUMPJ-UHFFFAOYSA-N 2 0 365.521 4.323 20 0 FIADRP OC1(c2ccccc2)CCC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000760908669 1115170285 /nfs/dbraw/zinc/17/02/85/1115170285.db2.gz QGMDPNNNJJFXSG-UHFFFAOYSA-N 2 0 356.554 4.204 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168401468 1115175179 /nfs/dbraw/zinc/17/51/79/1115175179.db2.gz WXAHNBUWDKXYGI-AUSIDOKSSA-N 2 0 352.497 4.185 20 0 FIADRP Cc1nc2scc(C3CC3)n2c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000574045143 1115286691 /nfs/dbraw/zinc/28/66/91/1115286691.db2.gz OQHUKFPVVAXVFY-UHFFFAOYSA-N 2 0 360.571 4.134 20 0 FIADRP CSC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000593320214 1115322362 /nfs/dbraw/zinc/32/23/62/1115322362.db2.gz ATTKQRWUWQFRKY-KRWDZBQOSA-N 2 0 372.431 4.497 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)CC[NH+](C)CC1 ZINC000593630417 1115336576 /nfs/dbraw/zinc/33/65/76/1115336576.db2.gz NQNIZEBQJMAPJG-QGZVFWFLSA-N 2 0 355.551 4.227 20 0 FIADRP CC(C)[NH+]1CCC(N[C@H]2C[C@H](C(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000593689353 1115342398 /nfs/dbraw/zinc/34/23/98/1115342398.db2.gz HVKNVIYGIWOJJL-PMACEKPBSA-N 2 0 358.526 4.019 20 0 FIADRP CSC1(C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+](C)CC1 ZINC000574560831 1115422112 /nfs/dbraw/zinc/42/21/12/1115422112.db2.gz RGYUJKVXMCZVRU-UHFFFAOYSA-N 2 0 364.555 4.471 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000669703971 1115831431 /nfs/dbraw/zinc/83/14/31/1115831431.db2.gz ZUTIUHNIKAXKHO-XZCBWCRCSA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)CCn1cccc1C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000606469828 1115948075 /nfs/dbraw/zinc/94/80/75/1115948075.db2.gz PZBFDACXLHNKGN-JOCHJYFZSA-N 2 0 353.554 4.188 20 0 FIADRP CC[NH+](CC)[C@@H](C(=O)Nc1cc(C)cc(C[NH+](C)C)c1)c1ccccc1 ZINC000533967735 1116075410 /nfs/dbraw/zinc/07/54/10/1116075410.db2.gz SIEHCLWDURWJFN-OAQYLSRUSA-N 2 0 353.510 4.078 20 0 FIADRP COc1ccccc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000608065487 1116080302 /nfs/dbraw/zinc/08/03/02/1116080302.db2.gz XFDFCMSWZCKYJB-SEJPIABJSA-N 2 0 350.506 4.467 20 0 FIADRP Cc1ccc(O[C@H](C)C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000608065365 1116080316 /nfs/dbraw/zinc/08/03/16/1116080316.db2.gz QLEPBJGVGZUVRV-HXUWFJFHSA-N 2 0 368.521 4.027 20 0 FIADRP CCOc1ccccc1OCC[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000608492362 1116112126 /nfs/dbraw/zinc/11/21/26/1116112126.db2.gz VFDLMQMOUIYVEL-UHFFFAOYSA-N 2 0 360.542 4.052 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000534059662 1116153578 /nfs/dbraw/zinc/15/35/78/1116153578.db2.gz SGSHKRDZOPZMKL-MRXNPFEDSA-N 2 0 357.723 4.021 20 0 FIADRP CC[N@@H+](Cc1ccc(OC)c(OC)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539861526 1116391948 /nfs/dbraw/zinc/39/19/48/1116391948.db2.gz CWHQXKCDFYQUHR-NRFANRHFSA-N 2 0 368.521 4.048 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3cc(-c4ccccc4)cs3)C2)CC1 ZINC000539861713 1116392026 /nfs/dbraw/zinc/39/20/26/1116392026.db2.gz JAKGFZCPNDCFMA-OAQYLSRUSA-N 2 0 369.578 4.015 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000462798216 1117779225 /nfs/dbraw/zinc/77/92/25/1117779225.db2.gz JYYAMEBOERRSGB-SFHVURJKSA-N 2 0 354.542 4.294 20 0 FIADRP C[C@H](C[C@H](C)O)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462801399 1117785171 /nfs/dbraw/zinc/78/51/71/1117785171.db2.gz GXRHXQJEKXCZDI-LQWHRVPQSA-N 2 0 350.522 4.128 20 0 FIADRP C[C@H](O)C[C@H](C)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462801401 1117785181 /nfs/dbraw/zinc/78/51/81/1117785181.db2.gz GXRHXQJEKXCZDI-WFXMLNOXSA-N 2 0 350.522 4.128 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H]2CCN(c3ccccc3F)C2)CC1 ZINC000462801556 1117785272 /nfs/dbraw/zinc/78/52/72/1117785272.db2.gz CKQSURSHAWEUPS-DXIQSLLYSA-N 2 0 373.560 4.285 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000462802751 1117785548 /nfs/dbraw/zinc/78/55/48/1117785548.db2.gz ADSQYGJYRYGIMR-MOIQIXESSA-N 2 0 351.332 4.015 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H]2CCC[C@H]21 ZINC000462820291 1117795818 /nfs/dbraw/zinc/79/58/18/1117795818.db2.gz VCATYQCAXUEJJG-RXABAKJHSA-N 2 0 363.343 4.158 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3cc(F)ccc3o2)CC1)CC1CC1 ZINC000540050047 1117839321 /nfs/dbraw/zinc/83/93/21/1117839321.db2.gz YYQGUJJXPZEIPT-UHFFFAOYSA-N 2 0 359.489 4.301 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(NC2CC[NH+](C3CC3)CC2)c1C ZINC000462919817 1117852633 /nfs/dbraw/zinc/85/26/33/1117852633.db2.gz NTRWHPUIBPJYJQ-UHFFFAOYSA-N 2 0 374.326 4.075 20 0 FIADRP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(OCC)c(OCC)cc32)C1 ZINC000462943480 1117871907 /nfs/dbraw/zinc/87/19/07/1117871907.db2.gz DAUZFKRDZQWIJF-KRWDZBQOSA-N 2 0 371.525 4.200 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000540136989 1117900582 /nfs/dbraw/zinc/90/05/82/1117900582.db2.gz COYFFVYXDSICKS-SQMBMXPBSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(-c2cccs2)cc1 ZINC000540159219 1117903018 /nfs/dbraw/zinc/90/30/18/1117903018.db2.gz ZVDMVJMKQZJWNT-NDXORKPFSA-N 2 0 370.562 4.444 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccccc1OC(F)F ZINC000540172692 1117913434 /nfs/dbraw/zinc/91/34/34/1117913434.db2.gz SBTCVUCLFZKZSR-BQFCYCMXSA-N 2 0 370.484 4.218 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1nc2ccc(Cl)cc2n1C ZINC000540259521 1117961754 /nfs/dbraw/zinc/96/17/54/1117961754.db2.gz WIRZALDCGGUYHY-JKSUJKDBSA-N 2 0 362.949 4.389 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463112714 1117970282 /nfs/dbraw/zinc/97/02/82/1117970282.db2.gz VVCJLCHTYWBIPV-GBXCKJPGSA-N 2 0 365.565 4.281 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)CCN1Cc1ccccc1 ZINC000463132612 1117983647 /nfs/dbraw/zinc/98/36/47/1117983647.db2.gz SLZFKAAHHDAHAM-GGAORHGYSA-N 2 0 357.586 4.285 20 0 FIADRP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cccc(OCc2ccccn2)c1 ZINC000540354100 1117998157 /nfs/dbraw/zinc/99/81/57/1117998157.db2.gz LETHXBGDORHPLX-WIYYLYMNSA-N 2 0 353.510 4.186 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2c3cc(Br)ccc3SC[C@H]2C)C1 ZINC000540409276 1118037890 /nfs/dbraw/zinc/03/78/90/1118037890.db2.gz UZFOLHSJSAKFIN-XNJGSVPQSA-N 2 0 369.372 4.163 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)c1ccccc1O2 ZINC000540491577 1118091052 /nfs/dbraw/zinc/09/10/52/1118091052.db2.gz FBPASDMLHHWQHO-BVSLBCMMSA-N 2 0 362.517 4.195 20 0 FIADRP Cc1cccc(COc2ccc([C@@H](C)[NH2+]CC3=CC[N@H+](C)CC3)cc2)c1 ZINC000540608812 1118148690 /nfs/dbraw/zinc/14/86/90/1118148690.db2.gz UHNUNVFFDYEIOP-LJQANCHMSA-N 2 0 350.506 4.487 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000540709405 1118196737 /nfs/dbraw/zinc/19/67/37/1118196737.db2.gz BXSRZPWGYDMHRE-FGZHOGPDSA-N 2 0 358.570 4.472 20 0 FIADRP c1cnc2c(c1)cccc2OCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540985154 1118338144 /nfs/dbraw/zinc/33/81/44/1118338144.db2.gz FXSPPOHNAVPFAF-UHFFFAOYSA-N 2 0 367.537 4.390 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000540988456 1118339226 /nfs/dbraw/zinc/33/92/26/1118339226.db2.gz LLWSMKWGBKXXDS-RBBKRZOGSA-N 2 0 370.924 4.074 20 0 FIADRP CCc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)C(C)C)cc1 ZINC000540988759 1118339532 /nfs/dbraw/zinc/33/95/32/1118339532.db2.gz OKZBKGBZNQCNEC-DNQXCXABSA-N 2 0 366.549 4.303 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000540990146 1118341594 /nfs/dbraw/zinc/34/15/94/1118341594.db2.gz DOHYCVOUZAJYIY-NTKDMRAZSA-N 2 0 366.549 4.447 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)CC2)cc1 ZINC000464070100 1118429897 /nfs/dbraw/zinc/42/98/97/1118429897.db2.gz ITBNTGCXWDMDHU-DNVJHFABSA-N 2 0 356.554 4.084 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Br)[C@@H](C)C1 ZINC000541281477 1118462410 /nfs/dbraw/zinc/46/24/10/1118462410.db2.gz HUCZHWNKDOUKRQ-YJBOKZPZSA-N 2 0 353.348 4.044 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000541548438 1118551844 /nfs/dbraw/zinc/55/18/44/1118551844.db2.gz DLWCNRROEDHMMP-JOCHJYFZSA-N 2 0 351.469 4.395 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000541849108 1118669982 /nfs/dbraw/zinc/66/99/82/1118669982.db2.gz QPTQKLNCWGCLPY-NRFANRHFSA-N 2 0 357.542 4.137 20 0 FIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312429941 1118676629 /nfs/dbraw/zinc/67/66/29/1118676629.db2.gz IBQRLTRSVLGVAN-JPYJTQIMSA-N 2 0 365.521 4.208 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCOCCc3ccccc3)C2)CC1 ZINC000303036465 1118775972 /nfs/dbraw/zinc/77/59/72/1118775972.db2.gz RCHUUKQMPDXZRB-HSZRJFAPSA-N 2 0 358.570 4.080 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1c[nH]c2ccc(Cl)cc12 ZINC000542304305 1118895459 /nfs/dbraw/zinc/89/54/59/1118895459.db2.gz MGRAKLQKLDHJHV-UHFFFAOYSA-N 2 0 365.868 4.043 20 0 FIADRP Clc1ccc2c(c1Cl)OC[C@@H]2[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC000542302255 1118901186 /nfs/dbraw/zinc/90/11/86/1118901186.db2.gz IADDJRVVMRTMPV-AWEZNQCLSA-N 2 0 366.273 4.464 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000173329730 1119033355 /nfs/dbraw/zinc/03/33/55/1119033355.db2.gz JFKGKCIINAJESE-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1 ZINC000173449209 1119041414 /nfs/dbraw/zinc/04/14/14/1119041414.db2.gz OYVSRZPPPFIOTB-GOSISDBHSA-N 2 0 361.599 4.009 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2ccccc2)c1 ZINC000492223659 1119050833 /nfs/dbraw/zinc/05/08/33/1119050833.db2.gz LTZJIRORCGNOPG-LADGPHEKSA-N 2 0 366.549 4.219 20 0 FIADRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c1 ZINC000177200085 1119316412 /nfs/dbraw/zinc/31/64/12/1119316412.db2.gz SRBNBPRDFAMYGZ-OTWHNJEPSA-N 2 0 368.521 4.155 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000311072873 1119357150 /nfs/dbraw/zinc/35/71/50/1119357150.db2.gz KLIAHLOXIYVSHG-VQIMIIECSA-N 2 0 358.913 4.349 20 0 FIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)C2CC[NH+](C(C)C)CC2)c1 ZINC000177933298 1119361281 /nfs/dbraw/zinc/36/12/81/1119361281.db2.gz VQZAOOHMAGOAKW-UHFFFAOYSA-N 2 0 373.585 4.045 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311590936 1119380486 /nfs/dbraw/zinc/38/04/86/1119380486.db2.gz AKZSJXYWOBYVSF-KNKQGSTJSA-N 2 0 352.522 4.214 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+]C2CCN(c3cc(C)nc(C)n3)CC2)cc1 ZINC000178322694 1119384142 /nfs/dbraw/zinc/38/41/42/1119384142.db2.gz YEYITWURVBVMIE-KRWDZBQOSA-N 2 0 368.525 4.202 20 0 FIADRP C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311863743 1119393011 /nfs/dbraw/zinc/39/30/11/1119393011.db2.gz VOPDMBSJSLOOHB-NNWRFLSQSA-N 2 0 356.554 4.369 20 0 FIADRP C[NH+](C)C1CCC([NH2+]CCc2ccc(NC(=O)OC(C)(C)C)cc2)CC1 ZINC000715173025 1119426544 /nfs/dbraw/zinc/42/65/44/1119426544.db2.gz CNJUEMRCZSWQKK-UHFFFAOYSA-N 2 0 361.530 4.039 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1 ZINC000493929434 1119510473 /nfs/dbraw/zinc/51/04/73/1119510473.db2.gz YKMYDLIEXXDRED-YPAWHYETSA-N 2 0 354.538 4.110 20 0 FIADRP Cc1cncc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000184379572 1119605767 /nfs/dbraw/zinc/60/57/67/1119605767.db2.gz BNLIGTYNROYIJF-HXUWFJFHSA-N 2 0 367.537 4.112 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000186097082 1119705896 /nfs/dbraw/zinc/70/58/96/1119705896.db2.gz PRRODFFBHOMAQS-ZACQAIPSSA-N 2 0 374.550 4.217 20 0 FIADRP COc1ccsc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000186137135 1119707577 /nfs/dbraw/zinc/70/75/77/1119707577.db2.gz RUWQXFOMIBDJAF-MRXNPFEDSA-N 2 0 374.550 4.328 20 0 FIADRP C[NH+](C)[C@H](CNC1CC[NH+](C(C)(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000186569678 1119737061 /nfs/dbraw/zinc/73/70/61/1119737061.db2.gz PFKQSOBCAHENAI-GOSISDBHSA-N 2 0 371.491 4.161 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000186584024 1119737844 /nfs/dbraw/zinc/73/78/44/1119737844.db2.gz FQXGDBKWDOPQJY-PMACEKPBSA-N 2 0 351.538 4.030 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000189379122 1119889919 /nfs/dbraw/zinc/88/99/19/1119889919.db2.gz QKLOHHZCUTZXOK-DYESRHJHSA-N 2 0 354.494 4.110 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(Br)cc2)CC1 ZINC000222842628 1119921529 /nfs/dbraw/zinc/92/15/29/1119921529.db2.gz PWXABDIXPGTWCO-HNNXBMFYSA-N 2 0 353.348 4.090 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)cn1 ZINC000190908963 1119953467 /nfs/dbraw/zinc/95/34/67/1119953467.db2.gz PSYQDMNVDYIEEZ-UHFFFAOYSA-N 2 0 366.553 4.204 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cc(Cl)cs3)cc2)C[C@@H](C)O1 ZINC000192994968 1120093788 /nfs/dbraw/zinc/09/37/88/1120093788.db2.gz FTMZYIMTJUXDLE-HUUCEWRRSA-N 2 0 364.942 4.301 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)CC2 ZINC000494745539 1120114675 /nfs/dbraw/zinc/11/46/75/1120114675.db2.gz MAYKWTKRDLKRID-INIZCTEOSA-N 2 0 351.332 4.066 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3nc(-c4ccccc4)c[nH]3)CC2)CC1 ZINC000194394649 1120266449 /nfs/dbraw/zinc/26/64/49/1120266449.db2.gz KBIFWQUTYLYQKV-UHFFFAOYSA-N 2 0 352.526 4.209 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000494989442 1120414406 /nfs/dbraw/zinc/41/44/06/1120414406.db2.gz SSUSNMGBXGCANO-FQEVSTJZSA-N 2 0 358.432 4.229 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000495261131 1120595310 /nfs/dbraw/zinc/59/53/10/1120595310.db2.gz UTUTXEBEDHZOEY-UTKZUKDTSA-N 2 0 355.913 4.093 20 0 FIADRP Cc1c(C[NH2+]CCC[N@@H+](C)C2CCCCC2)sc2nc(C)nc(C)c12 ZINC000915227321 1120883513 /nfs/dbraw/zinc/88/35/13/1120883513.db2.gz RVTGOOQHKQUJQA-UHFFFAOYSA-N 2 0 360.571 4.361 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000236761457 1120969353 /nfs/dbraw/zinc/96/93/53/1120969353.db2.gz IMNAAWYGVVOTCP-INIZCTEOSA-N 2 0 354.485 4.463 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(C)c(F)c2)CC1 ZINC000236984468 1120972343 /nfs/dbraw/zinc/97/23/43/1120972343.db2.gz JXJXMZYMRCCRGP-KRWDZBQOSA-N 2 0 373.491 4.266 20 0 FIADRP Cc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1C ZINC000237623164 1120980363 /nfs/dbraw/zinc/98/03/63/1120980363.db2.gz UPWDGXQFHPZYSP-OALUTQOASA-N 2 0 352.522 4.202 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc3oc4ccccc4c3c2)CC1 ZINC000732666914 1121106991 /nfs/dbraw/zinc/10/69/91/1121106991.db2.gz GNIQFSSMMUOBEG-UHFFFAOYSA-N 2 0 352.478 4.129 20 0 FIADRP CO[C@H]1C[C@@H](C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000624312512 1121230832 /nfs/dbraw/zinc/23/08/32/1121230832.db2.gz SUOMFQLPBRKEDE-BVYCBKJFSA-N 2 0 362.533 4.394 20 0 FIADRP CO[C@H]1C[C@@H](C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000624312513 1121231275 /nfs/dbraw/zinc/23/12/75/1121231275.db2.gz SUOMFQLPBRKEDE-BWAGFHJFSA-N 2 0 362.533 4.394 20 0 FIADRP Cn1cc(-c2ccc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)s2)cn1 ZINC000670262203 1121263551 /nfs/dbraw/zinc/26/35/51/1121263551.db2.gz DSNDNTIZBSUPQP-UHFFFAOYSA-N 2 0 372.582 4.237 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(SC(F)F)c(OC)c2)CC1 ZINC000765766279 1121378024 /nfs/dbraw/zinc/37/80/24/1121378024.db2.gz GLUNYKRBZONDAK-CYBMUJFWSA-N 2 0 358.498 4.392 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@H]1CC[NH+]2CCC[C@@H]2C1)C1CCCCC1 ZINC000166255605 1121452588 /nfs/dbraw/zinc/45/25/88/1121452588.db2.gz PHMAQJBTOWQZSJ-JTHBVZDNSA-N 3 0 355.570 4.168 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cccc4c3OCO4)cc2)C1 ZINC000060999995 1121503816 /nfs/dbraw/zinc/50/38/16/1121503816.db2.gz SGDOYEYKKLBZGE-ROUUACIJSA-N 2 0 366.505 4.183 20 0 FIADRP C[C@H](C[NH2+]C1CC(c2cccc(Br)c2)C1)C[NH+]1CCCC1 ZINC000062078469 1121596343 /nfs/dbraw/zinc/59/63/43/1121596343.db2.gz BUBHXJOPBRDJSM-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP CC[NH+]1CCC(N[C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000038097950 1121601380 /nfs/dbraw/zinc/60/13/80/1121601380.db2.gz YOSZDKVAQBDZNG-GFCCVEGCSA-N 2 0 351.288 4.330 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(Br)ccc32)c1 ZINC000123603494 1121617522 /nfs/dbraw/zinc/61/75/22/1121617522.db2.gz PSKWUAUNVQRAAS-IBGZPJMESA-N 2 0 359.311 4.288 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)CC1 ZINC000671740147 1121636174 /nfs/dbraw/zinc/63/61/74/1121636174.db2.gz LAXRGEYTPZIUOL-UHFFFAOYSA-N 2 0 356.485 4.367 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[C@@H]2CCC[C@H]21 ZINC000671740217 1121642708 /nfs/dbraw/zinc/64/27/08/1121642708.db2.gz TXSPYKUIHGZFPZ-VRPMWHRCSA-N 2 0 372.397 4.358 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000123934010 1121646472 /nfs/dbraw/zinc/64/64/72/1121646472.db2.gz FGBGARIWPOEPBS-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000671754079 1121753961 /nfs/dbraw/zinc/75/39/61/1121753961.db2.gz QLGLYCARKRWYNY-KMDXXIMOSA-N 2 0 363.549 4.213 20 0 FIADRP CCCC[N@H+](C)CC1CCN([C@@H](C)c2nc(-c3cccs3)no2)CC1 ZINC000066960579 1121762074 /nfs/dbraw/zinc/76/20/74/1121762074.db2.gz YZCHPXJBEMXDSY-HNNXBMFYSA-N 2 0 362.543 4.303 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)CCO2)cc1 ZINC001168597473 1121804625 /nfs/dbraw/zinc/80/46/25/1121804625.db2.gz BDCXCVBMAPFEOK-VFSLUADLSA-N 2 0 360.542 4.049 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)s1 ZINC000671764913 1121814607 /nfs/dbraw/zinc/81/46/07/1121814607.db2.gz UYKYVFXNUGVICK-UONOGXRCSA-N 2 0 369.372 4.149 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000126375329 1121950146 /nfs/dbraw/zinc/95/01/46/1121950146.db2.gz IVANUDCCIXMUNA-KRWDZBQOSA-N 2 0 359.514 4.258 20 0 FIADRP CCCC[NH+]1CCC(C[NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608797 1121970603 /nfs/dbraw/zinc/97/06/03/1121970603.db2.gz DNXJLCOXCMBZTC-RBBKRZOGSA-N 2 0 360.542 4.017 20 0 FIADRP CCC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000127328699 1122078893 /nfs/dbraw/zinc/07/88/93/1122078893.db2.gz HOIFANMSLUSUCM-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127833304 1122152107 /nfs/dbraw/zinc/15/21/07/1122152107.db2.gz NOJQRGFLZIUHSU-MSOLQXFVSA-N 2 0 361.599 4.008 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)C1 ZINC000655825603 1122202986 /nfs/dbraw/zinc/20/29/86/1122202986.db2.gz JNWHUNCTYGGTQC-AKAXFMLLSA-N 2 0 363.299 4.139 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630606 1122217549 /nfs/dbraw/zinc/21/75/49/1122217549.db2.gz QODCVAMIOVCXGE-VMBXEPDQSA-N 2 0 360.542 4.158 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[C@H]([NH3+])c1ccccc1 ZINC000262667283 1122409831 /nfs/dbraw/zinc/40/98/31/1122409831.db2.gz KUKFMOXPYXAXCX-SPEDKVCISA-N 2 0 365.521 4.336 20 0 FIADRP CC(C)Oc1ccccc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000128969791 1122479829 /nfs/dbraw/zinc/47/98/29/1122479829.db2.gz XSJBUTRCGYKTSF-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)C1 ZINC000556059633 1122629061 /nfs/dbraw/zinc/62/90/61/1122629061.db2.gz UMBYBLSCYIMBPV-IRMYBRCSSA-N 2 0 357.586 4.170 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cc(C(F)(F)F)ccn2)CC1 ZINC000556233361 1122751390 /nfs/dbraw/zinc/75/13/90/1122751390.db2.gz NRIWHJSECBUIIC-KXBFYZLASA-N 2 0 369.475 4.276 20 0 FIADRP C[C@H](CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[NH+]1CCCCC1 ZINC000556261216 1122770537 /nfs/dbraw/zinc/77/05/37/1122770537.db2.gz JRDSTMNVEXUANG-RDABAPPSSA-N 3 0 357.586 4.284 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC[C@H]2CCCC[C@@H]2O)CC1 ZINC000556263523 1122773273 /nfs/dbraw/zinc/77/32/73/1122773273.db2.gz ZMPNRNZFPOYXLP-PLYUQDFWSA-N 2 0 358.570 4.351 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC000132001759 1123207476 /nfs/dbraw/zinc/20/74/76/1123207476.db2.gz GCQCNQRISKZQLG-OFNKIYASSA-N 2 0 364.533 4.069 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC000132002150 1123208671 /nfs/dbraw/zinc/20/86/71/1123208671.db2.gz GCQCNQRISKZQLG-NFBKMPQASA-N 2 0 364.533 4.069 20 0 FIADRP C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@@H]1CCC[NH2+]C1 ZINC000556951941 1123262068 /nfs/dbraw/zinc/26/20/68/1123262068.db2.gz FCCPJIXOKDKMIA-HUUCEWRRSA-N 2 0 371.352 4.019 20 0 FIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N(C)c1ccccc1 ZINC000499141002 1123283370 /nfs/dbraw/zinc/28/33/70/1123283370.db2.gz IYKOJDCQSDIOSP-SJROBZAFSA-N 2 0 363.549 4.297 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCN[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000499144743 1123287053 /nfs/dbraw/zinc/28/70/53/1123287053.db2.gz XXLDIIADNBBAQY-NLTKNRQVSA-N 2 0 369.597 4.140 20 0 FIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1F ZINC000499235277 1123342682 /nfs/dbraw/zinc/34/26/82/1123342682.db2.gz PYZPTCJQGFDWIY-WJMWBRGCSA-N 2 0 368.496 4.378 20 0 FIADRP Fc1ccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499249034 1123357834 /nfs/dbraw/zinc/35/78/34/1123357834.db2.gz ZUCSQRHCKHQAGB-OWZKRDHZSA-N 2 0 372.459 4.129 20 0 FIADRP CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1c(C)nn(C)c1C ZINC000499245966 1123363667 /nfs/dbraw/zinc/36/36/67/1123363667.db2.gz BQVRPDHXXTYRTJ-CIAFKFPVSA-N 2 0 366.553 4.273 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000132882208 1123376176 /nfs/dbraw/zinc/37/61/76/1123376176.db2.gz UMZPIJBVVYCSNL-RHSMWYFYSA-N 2 0 355.448 4.188 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000133077573 1123409762 /nfs/dbraw/zinc/40/97/62/1123409762.db2.gz LOYKIIHRVJELOR-KRWDZBQOSA-N 2 0 355.448 4.189 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000133403111 1123484828 /nfs/dbraw/zinc/48/48/28/1123484828.db2.gz DESMLMRUPYGOMJ-KHCICDEESA-N 3 0 365.565 4.234 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCOC1 ZINC000133428197 1123485931 /nfs/dbraw/zinc/48/59/31/1123485931.db2.gz STIZAVCPOXSMJG-WMZHIEFXSA-N 2 0 364.533 4.464 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cc(-c3ccccc3)cs2)C[C@@H](C)O1 ZINC000237404012 1123627382 /nfs/dbraw/zinc/62/73/82/1123627382.db2.gz DXMUMCUGESPYOS-QZTJIDSGSA-N 2 0 358.551 4.394 20 0 FIADRP Cc1ccc(F)c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000237861789 1123662723 /nfs/dbraw/zinc/66/27/23/1123662723.db2.gz NNIUPSOZAGNNLB-UHFFFAOYSA-N 2 0 370.512 4.295 20 0 FIADRP CC(C)N(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(C)C ZINC000615316368 1123989103 /nfs/dbraw/zinc/98/91/03/1123989103.db2.gz RQGABZBZJNXPRF-UXHICEINSA-N 2 0 373.585 4.185 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(C)c(C)c2)c1 ZINC000615324197 1123989839 /nfs/dbraw/zinc/98/98/39/1123989839.db2.gz HJTOHTBYYZXMAR-LJQANCHMSA-N 2 0 367.537 4.262 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CCOc4ccccc42)C3)cc1 ZINC000245652511 1124167716 /nfs/dbraw/zinc/16/77/16/1124167716.db2.gz CUUINBMNHBWJSY-YUMYIRISSA-N 2 0 362.517 4.338 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2c(c1)OCO2 ZINC000245676168 1124187319 /nfs/dbraw/zinc/18/73/19/1124187319.db2.gz ICOQGBIDZGCHQU-RZXSNQJFSA-N 2 0 364.489 4.262 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1C ZINC000245752890 1124240177 /nfs/dbraw/zinc/24/01/77/1124240177.db2.gz UINMQDREPVZTRT-OWZKRDHZSA-N 2 0 355.551 4.088 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)c1ccc2ccccc2c1 ZINC000765881160 1124326389 /nfs/dbraw/zinc/32/63/89/1124326389.db2.gz NMYMKODQZMAEFV-UKDVSSAZSA-N 2 0 374.528 4.373 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc2c(s1)CCCC2 ZINC000542845581 1124445980 /nfs/dbraw/zinc/44/59/80/1124445980.db2.gz DAVXVJDWKWCNOP-JXFKEZNVSA-N 2 0 370.562 4.044 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(OC(F)F)c2)[C@@H](C)C1 ZINC000246844054 1124566509 /nfs/dbraw/zinc/56/65/09/1124566509.db2.gz CGWVNQMMIFGUCT-FCEWJHQRSA-N 2 0 370.484 4.076 20 0 FIADRP CCCCOc1cccc(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)c1 ZINC000246962777 1124577139 /nfs/dbraw/zinc/57/71/39/1124577139.db2.gz IRJBCWFVMJQBFL-AUSIDOKSSA-N 2 0 367.537 4.261 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)[C@H](C)C1 ZINC000247088372 1124589132 /nfs/dbraw/zinc/58/91/32/1124589132.db2.gz RKFVUAXRFXUNGU-XPGWFJOJSA-N 2 0 350.934 4.054 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000247236988 1124601304 /nfs/dbraw/zinc/60/13/04/1124601304.db2.gz YSEWEITXQISBED-QZTJIDSGSA-N 2 0 372.557 4.133 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(C(C)(C)C)cc1 ZINC000248454143 1124772961 /nfs/dbraw/zinc/77/29/61/1124772961.db2.gz QYFMMWWUCQWJLZ-FDDCHVKYSA-N 2 0 366.549 4.402 20 0 FIADRP COc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000248831902 1124817566 /nfs/dbraw/zinc/81/75/66/1124817566.db2.gz HRSPXRNOZAJDIV-WKCHPHFGSA-N 2 0 368.496 4.162 20 0 FIADRP Clc1cccc2c1C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001168686006 1124824171 /nfs/dbraw/zinc/82/41/71/1124824171.db2.gz VLHCVJMGQBIHAN-QUCCMNQESA-N 2 0 354.925 4.309 20 0 FIADRP Fc1cc(C(F)(F)F)cc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c1 ZINC000249117073 1124845255 /nfs/dbraw/zinc/84/52/55/1124845255.db2.gz SMNVHPMCUHJNRA-SJORKVTESA-N 2 0 356.407 4.093 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)F)c1 ZINC000089215103 1124891331 /nfs/dbraw/zinc/89/13/31/1124891331.db2.gz BYPDQNAMJSIWNT-OAHLLOKOSA-N 2 0 361.436 4.250 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc2ccccc2c1 ZINC000090525024 1125000883 /nfs/dbraw/zinc/00/08/83/1125000883.db2.gz DLYQYYRCBZXBOD-RTFZILSDSA-N 2 0 352.522 4.258 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000251535553 1125004219 /nfs/dbraw/zinc/00/42/19/1125004219.db2.gz BBUSTTIOUWKNMR-BRWVUGGUSA-N 2 0 350.934 4.222 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000090936987 1125027881 /nfs/dbraw/zinc/02/78/81/1125027881.db2.gz UHWLLSSNRRGOGH-KRWDZBQOSA-N 2 0 373.566 4.373 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000090937247 1125028239 /nfs/dbraw/zinc/02/82/39/1125028239.db2.gz ONILSZMXMYGOLS-CYBMUJFWSA-N 2 0 368.308 4.180 20 0 FIADRP Fc1ccccc1C1([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000076767081 1125034089 /nfs/dbraw/zinc/03/40/89/1125034089.db2.gz ZTQCWVPDUZDTMC-UHFFFAOYSA-N 2 0 354.469 4.079 20 0 FIADRP COCCc1nc(C)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)s1 ZINC000092739419 1125240275 /nfs/dbraw/zinc/24/02/75/1125240275.db2.gz YCHFQNXGYDPEEW-ULQDDVLXSA-N 2 0 367.603 4.049 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2)ccc1OC ZINC000182285300 1125321599 /nfs/dbraw/zinc/32/15/99/1125321599.db2.gz YKPZUTVBPOAWMG-IIBYNOLFSA-N 2 0 374.500 4.060 20 0 FIADRP CCCCC/C(=C\c1ccccc1)C[NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000602278696 567962720 /nfs/dbraw/zinc/96/27/20/567962720.db2.gz YDFYQMURUWZTKU-OILDRBDJSA-N 2 0 369.597 4.408 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000602564759 567995535 /nfs/dbraw/zinc/99/55/35/567995535.db2.gz OJAQVGHIWCHJAY-DGZHZOPBSA-N 2 0 374.594 4.024 20 0 FIADRP Cc1cc(C)c(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1C ZINC000303288106 568264504 /nfs/dbraw/zinc/26/45/04/568264504.db2.gz NQBWGYKVLHDSBH-LJQANCHMSA-N 2 0 369.528 4.354 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@@H]2C2CC[NH2+]CC2)nc1 ZINC001164419809 718893404 /nfs/dbraw/zinc/89/34/04/718893404.db2.gz RDBISPNAAPOEHH-FGZHOGPDSA-N 2 0 370.585 4.377 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCCC23CC[NH2+]CC3)nc1 ZINC001164420527 718912293 /nfs/dbraw/zinc/91/22/93/718912293.db2.gz KIURIBUXVCKFDU-FQEVSTJZSA-N 2 0 356.558 4.131 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1C[NH+]1CCCCC1 ZINC000182838025 1125647317 /nfs/dbraw/zinc/64/73/17/1125647317.db2.gz IZKZVPDTSPNNJY-IBGZPJMESA-N 3 0 373.585 4.064 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)c2ccccc21 ZINC000619822286 1125710314 /nfs/dbraw/zinc/71/03/14/1125710314.db2.gz KGBMONAHSDRMMU-PMACEKPBSA-N 2 0 358.526 4.021 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccsc2)cc1C[NH+]1CCCCC1 ZINC000183004036 1125717841 /nfs/dbraw/zinc/71/78/41/1125717841.db2.gz ILQYNXMJSSALJO-OXJNMPFZSA-N 2 0 374.550 4.127 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC001648785951 1079583045 /nfs/dbraw/zinc/58/30/45/1079583045.db2.gz NCEKPRJJHFRPGE-ROUUACIJSA-N 2 0 356.485 4.033 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)ccc1OCCC(C)C ZINC000643547787 1079682146 /nfs/dbraw/zinc/68/21/46/1079682146.db2.gz GQPHZIHGJINXLX-OJAHFUOMSA-N 2 0 360.542 4.159 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000065996802 1079979312 /nfs/dbraw/zinc/97/93/12/1079979312.db2.gz LSMPBZMEWDEUEL-UHFFFAOYSA-N 2 0 355.507 4.378 20 0 FIADRP COCCc1nc(C)c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)s1 ZINC000092766895 1080056707 /nfs/dbraw/zinc/05/67/07/1080056707.db2.gz SFOPAOWAQIWGGW-ZLPCBKJTSA-N 2 0 365.587 4.088 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274808425 1080161875 /nfs/dbraw/zinc/16/18/75/1080161875.db2.gz XGECVZSNQFFGFO-GDKQOWJMSA-N 2 0 364.533 4.407 20 0 FIADRP COc1ccc([C@H]([NH2+]CCCn2ccnc2)c2ccccc2Cl)cc1 ZINC000179963459 1080388410 /nfs/dbraw/zinc/38/84/10/1080388410.db2.gz DWXYSVMDIBNKTE-FQEVSTJZSA-N 2 0 355.869 4.314 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC000180711452 1080541096 /nfs/dbraw/zinc/54/10/96/1080541096.db2.gz VHVOOTYAKNJGRZ-XMMPIXPASA-N 2 0 365.565 4.008 20 0 FIADRP C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683347307 1080701006 /nfs/dbraw/zinc/70/10/06/1080701006.db2.gz OBRMVIJNJREULN-PMJAUZGISA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3COCC[C@@H]3C2)cc1 ZINC001648795413 1080793864 /nfs/dbraw/zinc/79/38/64/1080793864.db2.gz OGUORQJEHUUYKZ-RLLPEYFOSA-N 2 0 356.554 4.356 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC(F)F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000237574547 1080975570 /nfs/dbraw/zinc/97/55/70/1080975570.db2.gz JCGOLNRAIJXZIA-APWZRJJASA-N 2 0 360.448 4.431 20 0 FIADRP CCOc1cncc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)c1 ZINC001648808659 1081114145 /nfs/dbraw/zinc/11/41/45/1081114145.db2.gz YYKMENCLEGULEY-KDURUIRLSA-N 2 0 367.537 4.248 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc(O)ccc2Br)C1 ZINC001648811132 1081125155 /nfs/dbraw/zinc/12/51/55/1081125155.db2.gz FGFAVANTHTVPOK-GJZGRUSLSA-N 2 0 369.347 4.002 20 0 FIADRP Clc1ccc(C2([NH2+]C3CCN(C[C@H]4CCCO4)CC3)CC2)cc1Cl ZINC000655741011 1081158312 /nfs/dbraw/zinc/15/83/12/1081158312.db2.gz BPMUXVKYUPSPEO-MRXNPFEDSA-N 2 0 369.336 4.216 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1 ZINC001648817128 1081239488 /nfs/dbraw/zinc/23/94/88/1081239488.db2.gz VZHJSUNVZLHZLI-SFHVURJKSA-N 2 0 360.542 4.386 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000655848608 1081256955 /nfs/dbraw/zinc/25/69/55/1081256955.db2.gz JEFWVMMYWFOEMV-JRGCBEDISA-N 2 0 357.542 4.134 20 0 FIADRP Cc1cccc(C)c1OCCC[NH2+]C1CCN(Cc2ccccc2)CC1 ZINC000580106844 1081598344 /nfs/dbraw/zinc/59/83/44/1081598344.db2.gz XMTRUFRABHWVMS-UHFFFAOYSA-N 2 0 352.522 4.327 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]C3CCN(c4ccccc4)CC3)CC2)c1 ZINC000125485531 1081932954 /nfs/dbraw/zinc/93/29/54/1081932954.db2.gz GGBDTZNFWPMTTQ-UHFFFAOYSA-N 2 0 369.578 4.219 20 0 FIADRP COC1CCC([N@H+](C)CCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC001167398534 1081943479 /nfs/dbraw/zinc/94/34/79/1081943479.db2.gz SHTPWFXSSOJTBG-UHFFFAOYSA-N 2 0 358.570 4.221 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 ZINC000580570536 1082021529 /nfs/dbraw/zinc/02/15/29/1082021529.db2.gz BXOZNOQPCRZLDB-HUUCEWRRSA-N 2 0 365.399 4.252 20 0 FIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 ZINC000580570534 1082021867 /nfs/dbraw/zinc/02/18/67/1082021867.db2.gz BXOZNOQPCRZLDB-CABCVRRESA-N 2 0 365.399 4.252 20 0 FIADRP CC(C)c1ccc(-c2noc(CN3CCC(C[NH+]4CCCC4)CC3)n2)cc1 ZINC000047968568 1082040671 /nfs/dbraw/zinc/04/06/71/1082040671.db2.gz PSXNTCLQZRFSEE-UHFFFAOYSA-N 2 0 368.525 4.168 20 0 FIADRP C[C@H](NC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000471601585 1082042295 /nfs/dbraw/zinc/04/22/95/1082042295.db2.gz JURLHZKSXPNEPE-FUKQBSRTSA-N 2 0 357.586 4.311 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000471613498 1082097788 /nfs/dbraw/zinc/09/77/88/1082097788.db2.gz QRCUAVADPXVSJS-KRWDZBQOSA-N 2 0 374.550 4.125 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312974719 1082109403 /nfs/dbraw/zinc/10/94/03/1082109403.db2.gz KSVRTPXZODJCHA-NJNPRVFISA-N 2 0 365.521 4.206 20 0 FIADRP COc1ccc2oc([C@@H](C)[NH2+]CC3(SC)CC[NH+](C)CC3)c(C)c2c1 ZINC000580803836 1082149675 /nfs/dbraw/zinc/14/96/75/1082149675.db2.gz UUBTWVHLCYWZPQ-OAHLLOKOSA-N 2 0 362.539 4.228 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2ccccc2)s1 ZINC000471619844 1082161332 /nfs/dbraw/zinc/16/13/32/1082161332.db2.gz ODXDOEAOIUQDOX-QZTJIDSGSA-N 2 0 357.567 4.092 20 0 FIADRP [NH3+]C[C@@H](Cc1ccccc1)[C@H]1CCCC[N@@H+]1Cc1scnc1C1CC1 ZINC000581429538 1082572590 /nfs/dbraw/zinc/57/25/90/1082572590.db2.gz PQYOHUZEVONNKQ-RTBURBONSA-N 2 0 355.551 4.193 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656784796 1082768396 /nfs/dbraw/zinc/76/83/96/1082768396.db2.gz HKVXFFYLXNBHAW-FQEVSTJZSA-N 2 0 353.485 4.099 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656787514 1082771684 /nfs/dbraw/zinc/77/16/84/1082771684.db2.gz ZWKSHGQZGQNMBC-FQEVSTJZSA-N 2 0 353.485 4.099 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2c1ccc(OC)c2F ZINC000581876804 1082948610 /nfs/dbraw/zinc/94/86/10/1082948610.db2.gz VSWDNABGDSPHJG-HXUWFJFHSA-N 2 0 356.485 4.453 20 0 FIADRP Cc1ccc(-c2nn(C)cc2C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)o1 ZINC000647196218 1082996999 /nfs/dbraw/zinc/99/69/99/1082996999.db2.gz TZJPLGDNSVCOIU-UHFFFAOYSA-N 2 0 370.541 4.121 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000090418763 1083004443 /nfs/dbraw/zinc/00/44/43/1083004443.db2.gz HJUSRXBBAXTJER-QGZVFWFLSA-N 2 0 373.566 4.173 20 0 FIADRP Cc1cccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2cccc(F)c2)c1 ZINC000510716023 1083259196 /nfs/dbraw/zinc/25/91/96/1083259196.db2.gz OFPIXZMNUYPZSK-GOTSBHOMSA-N 2 0 370.512 4.050 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000510733602 1083282770 /nfs/dbraw/zinc/28/27/70/1083282770.db2.gz LWRIISGVVLUGAF-GOSISDBHSA-N 2 0 351.332 4.146 20 0 FIADRP C[C@@H]1[C@H](C(F)(F)F)CC[NH+]1CCCC[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000548427662 1083297838 /nfs/dbraw/zinc/29/78/38/1083297838.db2.gz XGNFURTYHORUTP-AAVRWANBSA-N 2 0 360.386 4.312 20 0 FIADRP C[C@@H]1[C@H](C(F)(F)F)CC[NH+]1CCCC[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000548427663 1083298075 /nfs/dbraw/zinc/29/80/75/1083298075.db2.gz XGNFURTYHORUTP-KPWCQOOUSA-N 2 0 360.386 4.312 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCCC[NH+]2CCCC[C@H]2C)cc1)C1CC1 ZINC000510830989 1083334403 /nfs/dbraw/zinc/33/44/03/1083334403.db2.gz BYNQOGQXJYCBFJ-LJQANCHMSA-N 2 0 371.569 4.055 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)[C@H]2CCCO[C@@H]21 ZINC000658320205 1083405735 /nfs/dbraw/zinc/40/57/35/1083405735.db2.gz RDLCAJRDBZVETR-YSFYHYPLSA-N 2 0 368.565 4.082 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCC4)C[C@H]2C1 ZINC000658318865 1083406287 /nfs/dbraw/zinc/40/62/87/1083406287.db2.gz TVRUZLWZWVEGDR-KCSJKLDESA-N 2 0 368.565 4.082 20 0 FIADRP C[C@H](CC1CCOCC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320169 1083406542 /nfs/dbraw/zinc/40/65/42/1083406542.db2.gz PHEBTDGCLWULMO-DENIHFKCSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658318611 1083406888 /nfs/dbraw/zinc/40/68/88/1083406888.db2.gz QQQXTHFNBGCCGN-PKOBYXMFSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(CO)c1 ZINC000658320351 1083408593 /nfs/dbraw/zinc/40/85/93/1083408593.db2.gz SPAGBBHRCUASOG-WMZHIEFXSA-N 2 0 364.533 4.132 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)ccc1OC(F)F ZINC000658358798 1083430236 /nfs/dbraw/zinc/43/02/36/1083430236.db2.gz YTVUZHWMATVSNV-AWEZNQCLSA-N 2 0 368.468 4.069 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1 ZINC000092561391 1083438571 /nfs/dbraw/zinc/43/85/71/1083438571.db2.gz BZRYKOGFUJCBJK-VIQWUECVSA-N 2 0 352.563 4.131 20 0 FIADRP CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(OCC[NH+](C)C)cc2)s1 ZINC000093612374 1083483851 /nfs/dbraw/zinc/48/38/51/1083483851.db2.gz KNSVONRCWHBCMF-MRXNPFEDSA-N 2 0 361.555 4.147 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[N@H+](Cc2ccccn2)C(C)C)CC1 ZINC000535812510 1083683392 /nfs/dbraw/zinc/68/33/92/1083683392.db2.gz PCYXAFPVOQYRBO-UHFFFAOYSA-N 2 0 366.553 4.024 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000535808494 1083694322 /nfs/dbraw/zinc/69/43/22/1083694322.db2.gz IKYBXVNTYPRJTK-IFMALSPDSA-N 2 0 360.505 4.049 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2F)s1 ZINC000535809888 1083698511 /nfs/dbraw/zinc/69/85/11/1083698511.db2.gz OCLLZWBGWZWIFE-XPGWFJOJSA-N 2 0 374.525 4.238 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+]CCCc3ccc4c(c3)CCO4)C2)cc1 ZINC000684614360 1083780724 /nfs/dbraw/zinc/78/07/24/1083780724.db2.gz VSGPYDSSUPZJDS-QFIPXVFZSA-N 2 0 364.533 4.056 20 0 FIADRP COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000163341641 1083813381 /nfs/dbraw/zinc/81/33/81/1083813381.db2.gz FQRWBBSEDOUBIE-CVEARBPZSA-N 2 0 360.473 4.187 20 0 FIADRP Fc1cccc(OCc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)c1 ZINC000647230520 1083991131 /nfs/dbraw/zinc/99/11/31/1083991131.db2.gz VOQRMCQUEAJNFI-SFTDATJTSA-N 2 0 354.469 4.121 20 0 FIADRP C[N@H+](CCC[NH3+])Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000647497004 1084241370 /nfs/dbraw/zinc/24/13/70/1084241370.db2.gz NPQMCMGYDRZEOV-UHFFFAOYSA-N 2 0 366.292 4.026 20 0 FIADRP CC(C)[NH+]1CCN(C2CC[NH+](CCc3ccc(C(C)(C)C)cc3)CC2)CC1 ZINC000685839624 1084317958 /nfs/dbraw/zinc/31/79/58/1084317958.db2.gz UVJMXMZVSCVLIM-UHFFFAOYSA-N 2 0 371.613 4.017 20 0 FIADRP Cc1ccc(-c2cccc(C[NH2+]C(C)(C)CCN3CC[NH+](C)CC3)c2)cc1 ZINC000472131076 1084439825 /nfs/dbraw/zinc/43/98/25/1084439825.db2.gz VMQQVTWJQFOXBO-UHFFFAOYSA-N 2 0 365.565 4.168 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)Nc1ccccc1 ZINC000511055542 1084453452 /nfs/dbraw/zinc/45/34/52/1084453452.db2.gz ALCZYZOYYOWKGF-IBGZPJMESA-N 2 0 365.521 4.035 20 0 FIADRP C[C@H](NCc1ccc(C[NH+]2CCCCCC2)cc1)c1cc2n(n1)CCC2 ZINC000414079124 1084467073 /nfs/dbraw/zinc/46/70/73/1084467073.db2.gz RLXUOPRVPPSSHU-SFHVURJKSA-N 2 0 352.526 4.056 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cc2n(n1)CCC2 ZINC000414108953 1084578152 /nfs/dbraw/zinc/57/81/52/1084578152.db2.gz GSTHIOVKBIXIRM-INIZCTEOSA-N 2 0 372.944 4.046 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(OC)c(OC)cc1C ZINC000582089360 1084602805 /nfs/dbraw/zinc/60/28/05/1084602805.db2.gz BOQYIVOBROCMGI-UHFFFAOYSA-N 2 0 356.510 4.096 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000657332985 1084610333 /nfs/dbraw/zinc/61/03/33/1084610333.db2.gz WOOABSNTURKZLH-UHFFFAOYSA-N 2 0 356.485 4.497 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)CSc1ccc(C)cc1 ZINC000472162326 1084612292 /nfs/dbraw/zinc/61/22/92/1084612292.db2.gz YNZCTBWSDIWWKC-INIZCTEOSA-N 2 0 352.507 4.155 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3cc4ccncc4s3)CC2)c1 ZINC000657338027 1084631882 /nfs/dbraw/zinc/63/18/82/1084631882.db2.gz GQCMNMZUYBFQDV-UHFFFAOYSA-N 2 0 357.548 4.360 20 0 FIADRP Fc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(F)c1F ZINC000657337826 1084633342 /nfs/dbraw/zinc/63/33/42/1084633342.db2.gz CCGOITKNPNWVNY-UHFFFAOYSA-N 2 0 354.441 4.167 20 0 FIADRP CCCOc1c(Cl)cc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1OC ZINC000511502722 1084693384 /nfs/dbraw/zinc/69/33/84/1084693384.db2.gz DWWLZCKHQFNDLU-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414161712 1084718174 /nfs/dbraw/zinc/71/81/74/1084718174.db2.gz CBYSIYVMNARVKI-QGZVFWFLSA-N 2 0 372.266 4.100 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CC1 ZINC000414162434 1084720502 /nfs/dbraw/zinc/72/05/02/1084720502.db2.gz DNDCDUYIVYFYFU-GOSISDBHSA-N 2 0 374.257 4.477 20 0 FIADRP c1cc(C[NH2+]CCc2nc(C3CCCCC3)cs2)n(-c2cc[nH+]cc2)n1 ZINC000657366095 1084751387 /nfs/dbraw/zinc/75/13/87/1084751387.db2.gz COJUULAQVFHJTI-UHFFFAOYSA-N 2 0 367.522 4.104 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)c1 ZINC000414190425 1084778776 /nfs/dbraw/zinc/77/87/76/1084778776.db2.gz RRHRFOXZZDNNNY-GOSISDBHSA-N 2 0 361.367 4.474 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2c(C3CCC3)cnn2C)C[N@@H+]1Cc1ccccc1 ZINC000657415904 1084952943 /nfs/dbraw/zinc/95/29/43/1084952943.db2.gz OVQYVYXLJVCZOL-AZUAARDMSA-N 2 0 366.553 4.078 20 0 FIADRP CC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000414300385 1084991318 /nfs/dbraw/zinc/99/13/18/1084991318.db2.gz IUANONVUJBYFQI-NRFANRHFSA-N 2 0 374.475 4.033 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC000657431178 1085011000 /nfs/dbraw/zinc/01/10/00/1085011000.db2.gz YAJJEAYNPUURIE-DEOSSOPVSA-N 2 0 364.533 4.201 20 0 FIADRP CCc1ccc([C@H]2CCCCC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000472584595 1085047237 /nfs/dbraw/zinc/04/72/37/1085047237.db2.gz VLJUMWKWDZFUDS-OAQYLSRUSA-N 2 0 361.574 4.175 20 0 FIADRP CC[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CO1 ZINC000657462088 1085123432 /nfs/dbraw/zinc/12/34/32/1085123432.db2.gz CKHFXPKFQKGDLR-LDSNPUHRSA-N 2 0 362.945 4.411 20 0 FIADRP C[C@@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCC[NH2+]C1 ZINC000237345186 1085403690 /nfs/dbraw/zinc/40/36/90/1085403690.db2.gz KASOZLHTUOAVST-RBUKOAKNSA-N 2 0 371.569 4.415 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@@H]([NH3+])c2ccccc2)cc1 ZINC000237351117 1085404387 /nfs/dbraw/zinc/40/43/87/1085404387.db2.gz XJBCYXNBYOJVKQ-DYESRHJHSA-N 2 0 351.494 4.090 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000657535348 1085444109 /nfs/dbraw/zinc/44/41/09/1085444109.db2.gz KYIFITFMRZTWES-SAPNQHFASA-N 2 0 362.945 4.224 20 0 FIADRP Cc1nc2ccc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)cc2s1 ZINC000657612933 1085691079 /nfs/dbraw/zinc/69/10/79/1085691079.db2.gz FUIOURIERCHCOC-UHFFFAOYSA-N 2 0 366.534 4.002 20 0 FIADRP Clc1cccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1Cl ZINC000657613102 1085691345 /nfs/dbraw/zinc/69/13/45/1085691345.db2.gz WAEOLIUZVVMICZ-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP Clc1cccc(Cl)c1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657612738 1085698270 /nfs/dbraw/zinc/69/82/70/1085698270.db2.gz QRODIFYOXXNXOQ-UHFFFAOYSA-N 2 0 364.320 4.390 20 0 FIADRP C[C@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCC[NH2+]C1 ZINC000237534860 1085717725 /nfs/dbraw/zinc/71/77/25/1085717725.db2.gz KASOZLHTUOAVST-RTBURBONSA-N 2 0 371.569 4.415 20 0 FIADRP CC(C)(CO)[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000090657612 1085871511 /nfs/dbraw/zinc/87/15/11/1085871511.db2.gz RVSCKBMJCHEBJW-QFIPXVFZSA-N 2 0 358.570 4.175 20 0 FIADRP CSC1(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC[NH+](C)CC1 ZINC000582875249 1085873941 /nfs/dbraw/zinc/87/39/41/1085873941.db2.gz PGACLJSAFUSDRV-FQEVSTJZSA-N 2 0 358.526 4.332 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1cccc(CO)c1 ZINC000121948123 1086017666 /nfs/dbraw/zinc/01/76/66/1086017666.db2.gz FDYWTUXDEPCYAL-SFHVURJKSA-N 2 0 364.489 4.255 20 0 FIADRP CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1cccc2c1CC[NH2+]C2 ZINC000662260327 1086380508 /nfs/dbraw/zinc/38/05/08/1086380508.db2.gz LJGCUBNWNJTZRW-QFIPXVFZSA-N 2 0 360.505 4.039 20 0 FIADRP c1ccc(Oc2cccnc2)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1 ZINC000662293928 1086398383 /nfs/dbraw/zinc/39/83/83/1086398383.db2.gz VGFOIXUAYUOBGO-IBGZPJMESA-N 2 0 351.494 4.086 20 0 FIADRP CC(C)c1cccc(C[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1 ZINC000663316025 1086404297 /nfs/dbraw/zinc/40/42/97/1086404297.db2.gz SFJROXFILXWKDT-UHFFFAOYSA-N 2 0 352.522 4.057 20 0 FIADRP CC(C)c1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1 ZINC000663318816 1086405532 /nfs/dbraw/zinc/40/55/32/1086405532.db2.gz NRWVBIMCFHUMRU-UHFFFAOYSA-N 2 0 352.522 4.057 20 0 FIADRP C[C@@H](c1c(F)cccc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662328742 1086419210 /nfs/dbraw/zinc/41/92/10/1086419210.db2.gz UOSZROVCEAWXRP-AWEZNQCLSA-N 2 0 374.479 4.096 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC[N@@H+]1C ZINC000165551045 1086537150 /nfs/dbraw/zinc/53/71/50/1086537150.db2.gz LYBXJEPTPYGUER-XXBNENTESA-N 2 0 374.532 4.171 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(Br)cs1 ZINC000663465835 1086564748 /nfs/dbraw/zinc/56/47/48/1086564748.db2.gz LRVLCSPCXWZJRZ-TZMCWYRMSA-N 2 0 357.361 4.283 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)CCC1CC[NH2+]CC1)C1CCCCC1 ZINC000155848787 1086593128 /nfs/dbraw/zinc/59/31/28/1086593128.db2.gz CEJRGSADFXQQGB-UHFFFAOYSA-N 2 0 357.542 4.169 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC000511993389 1086599727 /nfs/dbraw/zinc/59/97/27/1086599727.db2.gz XIMQYFAOZPKLHL-IRYQMKRQSA-N 2 0 356.460 4.478 20 0 FIADRP CC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000150960014 1086641178 /nfs/dbraw/zinc/64/11/78/1086641178.db2.gz WJAJMCHBMBBUGJ-GOSISDBHSA-N 2 0 358.357 4.060 20 0 FIADRP CCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cn1 ZINC000512021471 1086656387 /nfs/dbraw/zinc/65/63/87/1086656387.db2.gz CSQDPUDXTCUDKU-UHFFFAOYSA-N 2 0 357.929 4.299 20 0 FIADRP c1ccc(CC2CC[NH+](CCCC[NH2+][C@@H]3CCC34CCOCC4)CC2)cc1 ZINC000548793795 1086660620 /nfs/dbraw/zinc/66/06/20/1086660620.db2.gz DVKQKGKAHUORIX-HSZRJFAPSA-N 2 0 370.581 4.270 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167833458 1086665896 /nfs/dbraw/zinc/66/58/96/1086665896.db2.gz BHTZUCORNZFWOM-JTHBVZDNSA-N 3 0 357.586 4.095 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167834822 1086690152 /nfs/dbraw/zinc/69/01/52/1086690152.db2.gz NAYQAPAUOKBXST-MOPGFXCFSA-N 2 0 369.594 4.217 20 0 FIADRP COc1cccc(OC)c1C[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000512044828 1086699775 /nfs/dbraw/zinc/69/97/75/1086699775.db2.gz ICOXYVGPPOBXJR-UYAOXDASSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@H](C1)c1cc3nccnc3cc12 ZINC001167837519 1086710885 /nfs/dbraw/zinc/71/08/85/1086710885.db2.gz MBEOKWYYPPCVEM-KURKYZTESA-N 2 0 352.526 4.027 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(C(=O)c2ccc(OC)cc2)CC1 ZINC001167837506 1086711403 /nfs/dbraw/zinc/71/14/03/1086711403.db2.gz LSHHAJBRFUVEIB-SFHVURJKSA-N 2 0 360.542 4.100 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432412890 1086735297 /nfs/dbraw/zinc/73/52/97/1086735297.db2.gz IZFJEJRRPULFJW-UHFFFAOYSA-N 2 0 365.359 4.405 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)CCCO1 ZINC000432416899 1086742381 /nfs/dbraw/zinc/74/23/81/1086742381.db2.gz JJMHIDIIPOLLET-QAPCUYQASA-N 2 0 368.974 4.358 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cc(Br)ccc1Cl ZINC000925807361 1086745222 /nfs/dbraw/zinc/74/52/22/1086745222.db2.gz ACEOPZMHSKWCNB-SNVBAGLBSA-N 2 0 368.706 4.115 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cn(-c2ccccc2)nc1C(C)(C)C ZINC000650719203 1086800452 /nfs/dbraw/zinc/80/04/52/1086800452.db2.gz HOGNIIUETZYEAJ-UHFFFAOYSA-N 2 0 362.521 4.179 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1c(C)nn(-c2ccc(Cl)cc2)c1C ZINC000650719195 1086801187 /nfs/dbraw/zinc/80/11/87/1086801187.db2.gz HFYAYNHYBMQNLJ-UHFFFAOYSA-N 2 0 368.912 4.152 20 0 FIADRP Fc1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1F ZINC000512135414 1086813158 /nfs/dbraw/zinc/81/31/58/1086813158.db2.gz JYGATWGJJDFPOJ-FDIFFNORSA-N 2 0 356.460 4.132 20 0 FIADRP CC(C)(C)c1n[nH]cc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657772122 1086814086 /nfs/dbraw/zinc/81/40/86/1086814086.db2.gz ROXDOIQNXJVBMX-HXUWFJFHSA-N 2 0 366.553 4.099 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)cc1 ZINC000512137523 1086816126 /nfs/dbraw/zinc/81/61/26/1086816126.db2.gz VAKAYGNBRJMOMJ-HYXAFXHYSA-N 2 0 360.448 4.098 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000650722570 1086819244 /nfs/dbraw/zinc/81/92/44/1086819244.db2.gz WRNDGROPTKXVQS-LMNJBCLMSA-N 2 0 374.912 4.461 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3F)s2)C1 ZINC000650721988 1086825489 /nfs/dbraw/zinc/82/54/89/1086825489.db2.gz HYNFJGFYTZHEQN-CDHQVMDDSA-N 2 0 374.525 4.415 20 0 FIADRP c1c2cccnc2oc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657774403 1086849797 /nfs/dbraw/zinc/84/97/97/1086849797.db2.gz YPWFMWURUSJDSO-HXUWFJFHSA-N 2 0 361.489 4.220 20 0 FIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000583663668 1086907089 /nfs/dbraw/zinc/90/70/89/1086907089.db2.gz QEXOWUIFHAMUMQ-IFMALSPDSA-N 2 0 368.569 4.287 20 0 FIADRP c1cc2cccc(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)c2s1 ZINC000650741071 1086916133 /nfs/dbraw/zinc/91/61/33/1086916133.db2.gz XFOGQYLMWBGZAI-GHTZIAJQSA-N 2 0 350.487 4.247 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000650747209 1086934905 /nfs/dbraw/zinc/93/49/05/1086934905.db2.gz URVQOJBYRVXURF-GOSISDBHSA-N 2 0 359.311 4.257 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000151313224 1087084891 /nfs/dbraw/zinc/08/48/91/1087084891.db2.gz VMYHMKQXRDEFRX-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC000584195623 1087213602 /nfs/dbraw/zinc/21/36/02/1087213602.db2.gz JXKTUUWJORXLRL-AWEZNQCLSA-N 2 0 365.880 4.055 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(Br)c(Cl)c1 ZINC000657836566 1087226455 /nfs/dbraw/zinc/22/64/55/1087226455.db2.gz WIGNQCNXYSZIDF-NEPJUHHUSA-N 2 0 357.723 4.237 20 0 FIADRP COc1cc2ccc([C@H](C)N[C@H]3CC[N@@H+]4CCCC[C@@H]34)cc2cc1OC ZINC000657837235 1087243888 /nfs/dbraw/zinc/24/38/88/1087243888.db2.gz FMHDZDIMDAYRCM-YSSFQJQWSA-N 2 0 354.494 4.134 20 0 FIADRP c1c[nH]c([C@@H]2CCC[N@@H+](Cc3c(-c4ccccc4)nc4ccccn43)C2)n1 ZINC000080974646 1087290895 /nfs/dbraw/zinc/29/08/95/1087290895.db2.gz MSZDLTBYJNUCKN-GOSISDBHSA-N 2 0 357.461 4.104 20 0 FIADRP CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000584425950 1087381081 /nfs/dbraw/zinc/38/10/81/1087381081.db2.gz VDEQYIQUAVRLNO-OAQYLSRUSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cc2cnccc2o1 ZINC000657860112 1087397299 /nfs/dbraw/zinc/39/72/99/1087397299.db2.gz AWQIVFXVPKQGKL-HNNXBMFYSA-N 2 0 355.507 4.452 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(Cl)cc(Cl)c1 ZINC000090937142 1087411588 /nfs/dbraw/zinc/41/15/88/1087411588.db2.gz CVEQBLWIBOTSOI-ZDUSSCGKSA-N 2 0 368.308 4.180 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC1 ZINC000091285545 1087426893 /nfs/dbraw/zinc/42/68/93/1087426893.db2.gz IRVIQSILHTYCJW-LPHOPBHVSA-N 2 0 371.491 4.018 20 0 FIADRP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000657865623 1087430115 /nfs/dbraw/zinc/43/01/15/1087430115.db2.gz BLCVGFLQNXZXOZ-SFHVURJKSA-N 2 0 372.475 4.117 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2CCCSCC2)CC1 ZINC000657877043 1087521256 /nfs/dbraw/zinc/52/12/56/1087521256.db2.gz BGHOJWKYOZOKSD-SFHVURJKSA-N 2 0 352.975 4.427 20 0 FIADRP C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000685470345 1087577493 /nfs/dbraw/zinc/57/74/93/1087577493.db2.gz HIVURJHGMAQTIL-WMZHIEFXSA-N 2 0 361.533 4.462 20 0 FIADRP Brc1cccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000062426692 1087598840 /nfs/dbraw/zinc/59/88/40/1087598840.db2.gz SBIDJOAKUZFYII-LJQANCHMSA-N 2 0 373.338 4.451 20 0 FIADRP CC[NH+](C/C=C\C[N@@H+](CC)[C@H]1CCOC(C)(C)C1)[C@@H]1CCOC(C)(C)C1 ZINC000685589918 1087634435 /nfs/dbraw/zinc/63/44/35/1087634435.db2.gz AEFZJLHSTRAIRH-CUYMVUPESA-N 2 0 366.590 4.102 20 0 FIADRP CCOC1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000657970522 1087683087 /nfs/dbraw/zinc/68/30/87/1087683087.db2.gz FNEOXJNFXCLEER-VXGVFTFCSA-N 2 0 356.554 4.224 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]CCCC[N@H+](C)C3CC3)cc2cc1OC ZINC000658030525 1087699697 /nfs/dbraw/zinc/69/96/97/1087699697.db2.gz DJLSDIWLTCMALL-INIZCTEOSA-N 2 0 356.510 4.382 20 0 FIADRP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658066488 1087709952 /nfs/dbraw/zinc/70/99/52/1087709952.db2.gz BAJUDDHAYBFSIY-DHIUTWEWSA-N 2 0 356.554 4.112 20 0 FIADRP CCc1ccc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)cc1 ZINC000658067113 1087710027 /nfs/dbraw/zinc/71/00/27/1087710027.db2.gz JVLPPKNBLRZGEX-HSZRJFAPSA-N 2 0 358.570 4.427 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc(F)ccc1F ZINC000658134552 1087727938 /nfs/dbraw/zinc/72/79/38/1087727938.db2.gz BGCZWMRGJAFLNG-SIKLNZKXSA-N 2 0 374.475 4.018 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]C(c3ccccc3)c3ccccc3)cc2)C1 ZINC000658137492 1087742228 /nfs/dbraw/zinc/74/22/28/1087742228.db2.gz HHCKDYHZJLMLMJ-DEOSSOPVSA-N 2 0 372.512 4.132 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[N@@H+]3CCCC[C@@H]3C)C[C@H]2C1 ZINC000424260727 1087880170 /nfs/dbraw/zinc/88/01/70/1087880170.db2.gz DLEQASDLDJUYKF-GBCNUAAFSA-N 2 0 356.554 4.354 20 0 FIADRP C[C@H]1CC2(C[N@@H+]1Cc1nc(-c3ccccc3Cl)cs1)CC[NH2+]CC2 ZINC000424289660 1087899854 /nfs/dbraw/zinc/89/98/54/1087899854.db2.gz MGIFNTTVDXABLZ-AWEZNQCLSA-N 2 0 361.942 4.428 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]CC[C@@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424308346 1087931513 /nfs/dbraw/zinc/93/15/13/1087931513.db2.gz ZVDPDQFIMIUHSP-JBTVTMNCSA-N 2 0 356.554 4.080 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]CC[C@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000424308348 1087931635 /nfs/dbraw/zinc/93/16/35/1087931635.db2.gz ZVDPDQFIMIUHSP-VSCRBORPSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1nccs1 ZINC000186727199 1087972946 /nfs/dbraw/zinc/97/29/46/1087972946.db2.gz XBKCRDIMYFWTBY-BTHPGYMESA-N 2 0 355.551 4.137 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)nc1 ZINC000423375656 1088182386 /nfs/dbraw/zinc/18/23/86/1088182386.db2.gz UOKGXUXBKOPVLY-NNWRFLSQSA-N 2 0 371.956 4.311 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OC ZINC000414813584 1088213835 /nfs/dbraw/zinc/21/38/35/1088213835.db2.gz UAVKVYWTBXLPMY-AWEZNQCLSA-N 2 0 362.901 4.447 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000414812125 1088220065 /nfs/dbraw/zinc/22/00/65/1088220065.db2.gz KKYYGEQFYKONGH-ZDUSSCGKSA-N 2 0 374.410 4.405 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(OCC(F)(F)F)c(F)c2)cc1 ZINC000414813233 1088230128 /nfs/dbraw/zinc/23/01/28/1088230128.db2.gz SWODHYQIIRMFNJ-LBPRGKRZSA-N 2 0 356.363 4.076 20 0 FIADRP COc1ccccc1-c1cc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3)cc2)on1 ZINC000685933033 1088233069 /nfs/dbraw/zinc/23/30/69/1088233069.db2.gz LIZRAYPSWDURIW-INIZCTEOSA-N 2 0 374.444 4.387 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000311427431 1088376724 /nfs/dbraw/zinc/37/67/24/1088376724.db2.gz GFMNDPZIAUVGNT-MJGOQNOKSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000177886077 1088453163 /nfs/dbraw/zinc/45/31/63/1088453163.db2.gz KVUZBGMTVQBHEE-AWEZNQCLSA-N 2 0 353.348 4.233 20 0 FIADRP CC(C)c1ccc([C@@H]([NH3+])CNC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000414846648 1088687929 /nfs/dbraw/zinc/68/79/29/1088687929.db2.gz NSZJDZOIQSOTAC-DEOSSOPVSA-N 2 0 365.565 4.107 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000589836695 1088765035 /nfs/dbraw/zinc/76/50/35/1088765035.db2.gz QQEJKSMRVNZOOJ-MRXNPFEDSA-N 2 0 368.949 4.492 20 0 FIADRP COc1ccc(Br)c(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415054963 1089099898 /nfs/dbraw/zinc/09/98/98/1089099898.db2.gz OFTICOYMQQEMAO-GOSISDBHSA-N 2 0 363.299 4.028 20 0 FIADRP COc1ccc(Br)cc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415056640 1089102708 /nfs/dbraw/zinc/10/27/08/1089102708.db2.gz QARLIRMHKRWUJN-KRWDZBQOSA-N 2 0 363.299 4.028 20 0 FIADRP C[C@@H](c1ccncc1)[NH+]1CCC(Nc2cc[nH+]c3cc(F)ccc23)CC1 ZINC000425232239 1089104110 /nfs/dbraw/zinc/10/41/10/1089104110.db2.gz FJBJFVSPLWOHQT-HNNXBMFYSA-N 2 0 350.441 4.406 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cn2)c1 ZINC000415107305 1089168222 /nfs/dbraw/zinc/16/82/22/1089168222.db2.gz NQPGKINCARXWDM-HSALFYBXSA-N 2 0 355.457 4.023 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C)C[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000415113007 1089174081 /nfs/dbraw/zinc/17/40/81/1089174081.db2.gz SECQYNBGRKEYIH-KEYYUXOJSA-N 2 0 359.539 4.308 20 0 FIADRP C[C@H]1CC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@H]1C[NH3+] ZINC000415131975 1089198229 /nfs/dbraw/zinc/19/82/29/1089198229.db2.gz SWKHJKMNNAETOO-DOTOQJQBSA-N 2 0 371.912 4.009 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000415139376 1089199894 /nfs/dbraw/zinc/19/98/94/1089199894.db2.gz ZNFMHMQEYFVUBI-FPOVZHCZSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000415137792 1089200267 /nfs/dbraw/zinc/20/02/67/1089200267.db2.gz YLEKUYWXDQGFLA-LEWJYISDSA-N 2 0 356.535 4.133 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1cccc2c1OCC[C@@H]2[NH+](C)C ZINC000435041540 1089219653 /nfs/dbraw/zinc/21/96/53/1089219653.db2.gz JOQKLURLHLTZOX-YHYVQYDKSA-N 2 0 365.521 4.004 20 0 FIADRP O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000549213422 1089247138 /nfs/dbraw/zinc/24/71/38/1089247138.db2.gz CQLSFVIVCADKRM-UHFFFAOYSA-N 2 0 363.505 4.131 20 0 FIADRP CC[N@H+](C)Cc1cccc(CNCc2[nH+]c(C(C)C)n3ccccc23)c1 ZINC000514609667 1089264892 /nfs/dbraw/zinc/26/48/92/1089264892.db2.gz TUGUXXFTPQNUQX-UHFFFAOYSA-N 2 0 350.510 4.199 20 0 FIADRP Cc1ccc(C[N@@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000505605583 1089293588 /nfs/dbraw/zinc/29/35/88/1089293588.db2.gz DHUCHLDGCFFERX-UHFFFAOYSA-N 2 0 351.538 4.157 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000472766043 1089359863 /nfs/dbraw/zinc/35/98/63/1089359863.db2.gz FISQKEPWNAXMQC-INIZCTEOSA-N 2 0 372.384 4.402 20 0 FIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(C)c1 ZINC000514827881 1089504971 /nfs/dbraw/zinc/50/49/71/1089504971.db2.gz DUGAWLIYUNPBHT-XZOQPEGZSA-N 2 0 351.538 4.024 20 0 FIADRP C[NH2+]CC1CC[NH+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000435386413 1089591231 /nfs/dbraw/zinc/59/12/31/1089591231.db2.gz WYFLJVJBFDWMKU-UHFFFAOYSA-N 2 0 371.912 4.024 20 0 FIADRP COc1ccc2[nH]cc(C3CC[NH+](CC[C@H]4CCCC[N@@H+]4C)CC3)c2c1 ZINC000472855355 1089778306 /nfs/dbraw/zinc/77/83/06/1089778306.db2.gz HDQOLDPIYLQSOJ-GOSISDBHSA-N 2 0 355.526 4.230 20 0 FIADRP c1ccc(C[NH+]2CCC(NC[C@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000435745648 1089921534 /nfs/dbraw/zinc/92/15/34/1089921534.db2.gz OVPBNYGBQIVAIM-HSZRJFAPSA-N 2 0 355.570 4.038 20 0 FIADRP CO[C@H](C[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000549392953 1090017894 /nfs/dbraw/zinc/01/78/94/1090017894.db2.gz FUBBJGNKRPTJHF-CNNODRBYSA-N 2 0 352.522 4.120 20 0 FIADRP CCC(CC)(CNC(=O)Nc1ccc(C[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000415979996 1090059230 /nfs/dbraw/zinc/05/92/30/1090059230.db2.gz RTSOSNWWPMAKDL-QGZVFWFLSA-N 2 0 368.525 4.176 20 0 FIADRP CCC[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccn1 ZINC000179464965 1090070823 /nfs/dbraw/zinc/07/08/23/1090070823.db2.gz XIFKRVSJLINKCC-JOCHJYFZSA-N 2 0 366.553 4.115 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(C)cc2-c2cnn(C)c2)CC1 ZINC000549402835 1090232832 /nfs/dbraw/zinc/23/28/32/1090232832.db2.gz COLRLKWSRNQALL-UHFFFAOYSA-N 2 0 368.569 4.339 20 0 FIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000182376717 1090349002 /nfs/dbraw/zinc/34/90/02/1090349002.db2.gz QSEHEKCIXZMVOZ-ACJLOTCBSA-N 2 0 352.494 4.453 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccsc2)cc1C[NH+]1CCCCC1 ZINC000183004053 1090386173 /nfs/dbraw/zinc/38/61/73/1090386173.db2.gz ILQYNXMJSSALJO-OXQOHEQNSA-N 2 0 374.550 4.127 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000378613941 1090443913 /nfs/dbraw/zinc/44/39/13/1090443913.db2.gz ALWKKKNHTLHEBX-HXUWFJFHSA-N 2 0 351.425 4.074 20 0 FIADRP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2cnc4ccccc4n2)CC3)cc1 ZINC000660149243 1090649116 /nfs/dbraw/zinc/64/91/16/1090649116.db2.gz HFJVAEXADDMBGT-UHFFFAOYSA-N 2 0 372.516 4.118 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312429944 1090719095 /nfs/dbraw/zinc/71/90/95/1090719095.db2.gz IBQRLTRSVLGVAN-MBSDFSHPSA-N 2 0 365.521 4.208 20 0 FIADRP C[C@@H](c1ccc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)cc1)C(F)(F)F ZINC000660474366 1091592879 /nfs/dbraw/zinc/59/28/79/1091592879.db2.gz IDDUSTUFLFTNHK-LPHOPBHVSA-N 2 0 370.459 4.039 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512345378 1092092280 /nfs/dbraw/zinc/09/22/80/1092092280.db2.gz GJPRSEWLEJCQHF-KSHLTGEWSA-N 2 0 356.554 4.479 20 0 FIADRP Cc1cc(N2CCC[C@H]3C[N@H+](C)CC[C@H]32)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428166780 1092220467 /nfs/dbraw/zinc/22/04/67/1092220467.db2.gz STHQMSRRQKCQLQ-KBXCAEBGSA-N 2 0 361.436 4.065 20 0 FIADRP CCC[NH+]1CCC(N[C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428233213 1092272831 /nfs/dbraw/zinc/27/28/31/1092272831.db2.gz XUCPJZLBVDKYIN-YFNKSVMNSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2ccccc2N(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011902 1092302052 /nfs/dbraw/zinc/30/20/52/1092302052.db2.gz UFVBHDQYMSMFSU-RTBURBONSA-N 2 0 351.538 4.284 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2CCC3(COC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012825 1092377322 /nfs/dbraw/zinc/37/73/22/1092377322.db2.gz FOWGVZDJIPYLLS-HATOLVCRSA-N 2 0 356.554 4.224 20 0 FIADRP C[C@@H]1C[C@H]1c1ccc(C[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)o1 ZINC000237465048 1092499519 /nfs/dbraw/zinc/49/95/19/1092499519.db2.gz PLSYEMBLULVYGF-IIBYNOLFSA-N 2 0 353.510 4.228 20 0 FIADRP Cc1ncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000428248514 1092573655 /nfs/dbraw/zinc/57/36/55/1092573655.db2.gz LXAAIIDQNFNGDM-HMXCVIKNSA-N 2 0 355.551 4.232 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2cc(OC(F)(F)F)ccc2F)CC1 ZINC001143543267 1092754704 /nfs/dbraw/zinc/75/47/04/1092754704.db2.gz PNZNYLDGTLZAIY-UHFFFAOYSA-N 2 0 362.411 4.277 20 0 FIADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000442777665 1092757881 /nfs/dbraw/zinc/75/78/81/1092757881.db2.gz DRSDRNILTBDASW-HPUBIQBYSA-N 2 0 369.475 4.052 20 0 FIADRP c1cc2cc(CC[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)ccc2[nH]1 ZINC000442806912 1092765647 /nfs/dbraw/zinc/76/56/47/1092765647.db2.gz CVZYTKQKBWXWRO-WBDAEOGXSA-N 2 0 359.517 4.496 20 0 FIADRP CSCc1cnc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)s1 ZINC000549780515 1092767427 /nfs/dbraw/zinc/76/74/27/1092767427.db2.gz WWPXMZZNBQUYJF-UHFFFAOYSA-N 2 0 353.601 4.139 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1)C(C)C ZINC000110172754 1092787181 /nfs/dbraw/zinc/78/71/81/1092787181.db2.gz QKVAPYSWDDQCAU-PMACEKPBSA-N 2 0 373.585 4.015 20 0 FIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000442896172 1092847753 /nfs/dbraw/zinc/84/77/53/1092847753.db2.gz BMPZFQGIBXLIJC-MRXNPFEDSA-N 2 0 371.912 4.153 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000443063956 1092924865 /nfs/dbraw/zinc/92/48/65/1092924865.db2.gz XNRHJLNQETVDAP-ROUUACIJSA-N 2 0 351.494 4.061 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(C)c(C)c2)CC1 ZINC000521828179 1092932436 /nfs/dbraw/zinc/93/24/36/1092932436.db2.gz IFTANYYLIFJURH-IBGZPJMESA-N 2 0 369.528 4.435 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2c(F)cccc2N2CCCC2)C1 ZINC000521818492 1092935803 /nfs/dbraw/zinc/93/58/03/1092935803.db2.gz UAYOJBDVMQYGBC-RTBURBONSA-N 2 0 361.549 4.274 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(Br)cc1F ZINC000521816801 1092935894 /nfs/dbraw/zinc/93/58/94/1092935894.db2.gz ITIXRTDTMNNSKY-AWEZNQCLSA-N 2 0 357.311 4.332 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2c(C)nn(Cc3ccccc3)c2Cl)CC1 ZINC000236915853 1092942713 /nfs/dbraw/zinc/94/27/13/1092942713.db2.gz YEPLJBFUPHKUOP-UHFFFAOYSA-N 2 0 374.960 4.105 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@H](C)C1 ZINC000443099749 1092950005 /nfs/dbraw/zinc/95/00/05/1092950005.db2.gz UZWKNXUJISYUOL-CXAGYDPISA-N 2 0 358.423 4.196 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@H](C)C1 ZINC000443099751 1092950303 /nfs/dbraw/zinc/95/03/03/1092950303.db2.gz UZWKNXUJISYUOL-DYVFJYSZSA-N 2 0 358.423 4.196 20 0 FIADRP C[N@H+](CCOC(c1ccccc1)c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512573690 1092952487 /nfs/dbraw/zinc/95/24/87/1092952487.db2.gz NSOGKGOVAYLHKP-AIZNXBIQSA-N 2 0 364.533 4.350 20 0 FIADRP Cc1nc(C)c(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000512614121 1092992765 /nfs/dbraw/zinc/99/27/65/1092992765.db2.gz UXGIGPGNHMPXGI-PCCBWWKXSA-N 2 0 369.578 4.193 20 0 FIADRP C[C@@H]1C[C@@H](NCCC[N@H+]2CCCC[C@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168015282 1092997262 /nfs/dbraw/zinc/99/72/62/1092997262.db2.gz QMDRBHSAFFVSEB-CUDBPUKSSA-N 2 0 357.586 4.282 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000512659447 1093095514 /nfs/dbraw/zinc/09/55/14/1093095514.db2.gz HATYFYVYOVJUAI-BHIFYINESA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H]3CCC34CCCC4)CC2)cc1 ZINC000474054917 1093159968 /nfs/dbraw/zinc/15/99/68/1093159968.db2.gz IVAZSEPLYZXIHS-QFIPXVFZSA-N 2 0 356.554 4.370 20 0 FIADRP C[C@H](CC[N@@H+]1CCC[C@]2(CCSC2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000451963975 1093160544 /nfs/dbraw/zinc/16/05/44/1093160544.db2.gz IJUJKIBKINCSLS-AABGKKOBSA-N 2 0 368.656 4.203 20 0 FIADRP C[C@H](CC[N@@H+]1CCC[C@@]2(CCSC2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000451963985 1093161997 /nfs/dbraw/zinc/16/19/97/1093161997.db2.gz IJUJKIBKINCSLS-VAMGGRTRSA-N 2 0 368.656 4.203 20 0 FIADRP C[C@H]1CC(n2nc(CC[NH3+])c3ccccc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168019824 1093190782 /nfs/dbraw/zinc/19/07/82/1093190782.db2.gz KFNLJQPSDLHWDM-ROUUACIJSA-N 2 0 362.521 4.152 20 0 FIADRP C[C@@H](C[NH+]1CCC(C)CC1)NC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168020208 1093201782 /nfs/dbraw/zinc/20/17/82/1093201782.db2.gz LJSFXNJUKPNKCN-PWRODBHTSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1CC([NH2+]CCCCC[NH+]2CCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020382 1093212103 /nfs/dbraw/zinc/21/21/03/1093212103.db2.gz MUAFSTKDJYBUGY-NHCUHLMSSA-N 3 0 357.586 4.284 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000443623547 1093344445 /nfs/dbraw/zinc/34/44/45/1093344445.db2.gz PURMMEJMIAMNBI-OXJNMPFZSA-N 2 0 372.944 4.410 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168024243 1093383014 /nfs/dbraw/zinc/38/30/14/1093383014.db2.gz CTCIOWWHGDTTIW-VWNVYAMZSA-N 2 0 352.522 4.354 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H]2COCc3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025871 1093442327 /nfs/dbraw/zinc/44/23/27/1093442327.db2.gz KDZWUWICMYUGNL-OXHIVJRSSA-N 2 0 350.506 4.289 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000389141372 1093454152 /nfs/dbraw/zinc/45/41/52/1093454152.db2.gz VHIMAEBOXPJVON-QKLQHJQFSA-N 2 0 356.485 4.396 20 0 FIADRP COCCc1cccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168028670 1093539778 /nfs/dbraw/zinc/53/97/78/1093539778.db2.gz PZVGXRMIBJOZLX-PMACEKPBSA-N 2 0 366.549 4.407 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3CCC[C@H](c4ccccc4)N3)n2)cc1 ZINC001211884879 1093631185 /nfs/dbraw/zinc/63/11/85/1093631185.db2.gz ICKYJEUEVBLSBE-UXHICEINSA-N 2 0 362.477 4.354 20 0 FIADRP C[C@H]1CC(N[C@H]2CC[N@H+](CC(C)(C)C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032291 1093652652 /nfs/dbraw/zinc/65/26/52/1093652652.db2.gz HHHDHVJVLRNGLS-ZJOUEHCJSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2cnn3C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031839 1093655820 /nfs/dbraw/zinc/65/58/20/1093655820.db2.gz CPOCSKFDUXWLLJ-RMFSNUHRSA-N 2 0 362.521 4.105 20 0 FIADRP C[C@@H]1CC([NH2+]C(C)(C)Cc2ccncc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031740 1093656460 /nfs/dbraw/zinc/65/64/60/1093656460.db2.gz DSOXRJBOHYDKNL-RTBURBONSA-N 2 0 351.538 4.434 20 0 FIADRP C[C@@H]1CC([N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@@H](C)N1Cc1ccccc1 ZINC001168032536 1093660131 /nfs/dbraw/zinc/66/01/31/1093660131.db2.gz HWAXIILUEVWSIO-DAVBRLECSA-N 2 0 369.597 4.410 20 0 FIADRP C[C@H]1CC([N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)N1Cc1ccccc1 ZINC001168032539 1093661132 /nfs/dbraw/zinc/66/11/32/1093661132.db2.gz HWAXIILUEVWSIO-ZZTDLJEGSA-N 2 0 369.597 4.410 20 0 FIADRP C[C@@H](NCC(C)(C)C[NH+](C)C)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433405915 1093672675 /nfs/dbraw/zinc/67/26/75/1093672675.db2.gz JZLNWXLYXWBGJH-SJLPKXTDSA-N 2 0 366.521 4.012 20 0 FIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc4ccccc4n3)CC2)C1 ZINC000513052515 1093697372 /nfs/dbraw/zinc/69/73/72/1093697372.db2.gz RERTWTHWKWBPER-AVRDEDQJSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)C1 ZINC000614387523 1093805551 /nfs/dbraw/zinc/80/55/51/1093805551.db2.gz JSIRMWSWZZCBGY-SFHVURJKSA-N 2 0 360.505 4.152 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)C2CCSCC2)cc1 ZINC000474487904 1093834068 /nfs/dbraw/zinc/83/40/68/1093834068.db2.gz LJOJWRSFHAHCAD-QGZVFWFLSA-N 2 0 350.572 4.029 20 0 FIADRP C[N@H+](CCCOc1cccc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513144597 1093902207 /nfs/dbraw/zinc/90/22/07/1093902207.db2.gz MFPRWIKYXOKJLE-SJPCQFCGSA-N 2 0 356.432 4.031 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CCCC[NH+]2CCCC2)cc1 ZINC000729321119 1093962398 /nfs/dbraw/zinc/96/23/98/1093962398.db2.gz SIHQYFHZYDNJRN-LJQANCHMSA-N 2 0 357.542 4.266 20 0 FIADRP c1nc2c(n1[C@H]1CC[N@@H+](Cc3cccc(-c4ccncc4)c3)C1)CCCC2 ZINC000433758684 1094082369 /nfs/dbraw/zinc/08/23/69/1094082369.db2.gz NRHQZKMWMQKNHU-NRFANRHFSA-N 2 0 358.489 4.271 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(Br)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000513407690 1094105474 /nfs/dbraw/zinc/10/54/74/1094105474.db2.gz HFWFWQWIHNUXPR-HOCLYGCPSA-N 2 0 351.332 4.192 20 0 FIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1OC ZINC000513495744 1094163570 /nfs/dbraw/zinc/16/35/70/1094163570.db2.gz UPRKDIZMMIZCBM-AZUAARDMSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)[C@H](C)c1ccc(Cl)cc1 ZINC000474596999 1094376443 /nfs/dbraw/zinc/37/64/43/1094376443.db2.gz IHBMSHGEOMAMJQ-ZJPYXAASSA-N 2 0 352.950 4.311 20 0 FIADRP C[NH+]1CCN(CCC[NH2+][C@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000500992688 1094408928 /nfs/dbraw/zinc/40/89/28/1094408928.db2.gz OQKUMFORAQJWIU-NRFANRHFSA-N 2 0 363.977 4.189 20 0 FIADRP CCCCc1nc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cs1 ZINC000501027915 1094443408 /nfs/dbraw/zinc/44/34/08/1094443408.db2.gz XMTQOYHMYARDHD-UHFFFAOYSA-N 2 0 358.555 4.229 20 0 FIADRP C[N@@H+](Cc1ccc(OC(F)F)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501053343 1094484681 /nfs/dbraw/zinc/48/46/81/1094484681.db2.gz RDIWNKQIWLWUKD-UHFFFAOYSA-N 2 0 361.436 4.031 20 0 FIADRP COc1ccc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000501080165 1094495920 /nfs/dbraw/zinc/49/59/20/1094495920.db2.gz NBJLSWMWBPHHJY-UHFFFAOYSA-N 2 0 359.901 4.092 20 0 FIADRP C[C@H]1CC([NH2+]CC2(C(=O)OC(C)(C)C)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040480 1094513601 /nfs/dbraw/zinc/51/36/01/1094513601.db2.gz NHNQEXXWRYRELC-ROUUACIJSA-N 2 0 372.553 4.140 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467295236 1094580338 /nfs/dbraw/zinc/58/03/38/1094580338.db2.gz KXOXHLXYNPVNLX-OAQYLSRUSA-N 2 0 363.977 4.189 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccnn3-c3ccc(F)cc3)CC2)CC1 ZINC000474811291 1094634837 /nfs/dbraw/zinc/63/48/37/1094634837.db2.gz OFGYTPVLAXOOOX-UHFFFAOYSA-N 2 0 370.516 4.144 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474800499 1094636486 /nfs/dbraw/zinc/63/64/86/1094636486.db2.gz MPGGRWRHIFFPQT-XTCWOQMQSA-N 2 0 364.961 4.190 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474800496 1094637466 /nfs/dbraw/zinc/63/74/66/1094637466.db2.gz MPGGRWRHIFFPQT-VAKZPMALSA-N 2 0 364.961 4.190 20 0 FIADRP Fc1ccc(C(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccc(F)cc2)cc1 ZINC000501377257 1094668228 /nfs/dbraw/zinc/66/82/28/1094668228.db2.gz KBTSBMDEWOFMCT-INIZCTEOSA-N 2 0 356.460 4.171 20 0 FIADRP Cc1ccc(CCC[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000474881346 1094844286 /nfs/dbraw/zinc/84/42/86/1094844286.db2.gz VWQQKVARSJIZRM-REWPJTCUSA-N 2 0 351.538 4.213 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000420321414 1094881790 /nfs/dbraw/zinc/88/17/90/1094881790.db2.gz RFVRABUNELJADC-OALUTQOASA-N 2 0 354.542 4.186 20 0 FIADRP Clc1ccccc1-c1csc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)n1 ZINC000420340936 1094885529 /nfs/dbraw/zinc/88/55/29/1094885529.db2.gz UCEBIFLRZNETCL-KRWDZBQOSA-N 2 0 361.942 4.428 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccccc3Oc3ccccc3)CC2)C1 ZINC000420386643 1094907113 /nfs/dbraw/zinc/90/71/13/1094907113.db2.gz JBPMWPQZQLCKKH-OFNKIYASSA-N 2 0 366.505 4.197 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000474923470 1094924216 /nfs/dbraw/zinc/92/42/16/1094924216.db2.gz GABBJTKOLCPADY-LXZJYRNTSA-N 2 0 374.569 4.438 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000502277585 1095298140 /nfs/dbraw/zinc/29/81/40/1095298140.db2.gz BIPWEYMVFHKNQH-UGKGYDQZSA-N 2 0 356.554 4.500 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H](c3nnc[nH]3)C3CCCCC3)CC2)CC1 ZINC000330253427 1095438008 /nfs/dbraw/zinc/43/80/08/1095438008.db2.gz IVWQQQHMPQKVKI-SOAGJPPSSA-N 2 0 359.562 4.059 20 0 FIADRP C[C@@H]1C[C@@H]([N@H+]2C[C@H]3c4ccccc4C(=O)[C@H]3C2)C[C@H](C)N1Cc1ccccc1 ZINC001168048298 1095445405 /nfs/dbraw/zinc/44/54/05/1095445405.db2.gz VFTJWXUGZKUTJV-JFDOVZFRSA-N 2 0 374.528 4.340 20 0 FIADRP CC[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC(F)(F)F ZINC000414512887 1095548102 /nfs/dbraw/zinc/54/81/02/1095548102.db2.gz DVZDMWKJRXQDMY-MRXNPFEDSA-N 2 0 371.491 4.285 20 0 FIADRP CCC[C@H](C[N@@H+]1CCCN(C2CC[NH+](CC)CC2)CC1)c1ccccc1 ZINC000421380458 1095579917 /nfs/dbraw/zinc/57/99/17/1095579917.db2.gz VUZUUEXCPVRAGP-JOCHJYFZSA-N 2 0 357.586 4.062 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1 ZINC000522799479 1095690427 /nfs/dbraw/zinc/69/04/27/1095690427.db2.gz DSWPFAVZROZDKE-PCCBWWKXSA-N 2 0 365.565 4.391 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cc(C)c(C)o3)CC2)cc1 ZINC000502724432 1095761284 /nfs/dbraw/zinc/76/12/84/1095761284.db2.gz UOKMBHCRYYAOPJ-KRWDZBQOSA-N 2 0 356.510 4.468 20 0 FIADRP C[C@@H](c1ncc(C(C)(C)C)o1)N1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000281952745 1095777279 /nfs/dbraw/zinc/77/72/79/1095777279.db2.gz FRFGAJNLIKLSGC-HOTGVXAUSA-N 2 0 356.514 4.446 20 0 FIADRP CC[NH+](CC)C1CCN([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051872 1095855718 /nfs/dbraw/zinc/85/57/18/1095855718.db2.gz JRHQNJNFTXNQME-JHDGKUDLSA-N 2 0 357.586 4.234 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000421882260 1095974359 /nfs/dbraw/zinc/97/43/59/1095974359.db2.gz RRSKROOQJRCCJR-XVAXZDLZSA-N 2 0 357.929 4.481 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)CC1 ZINC000271749980 1096124661 /nfs/dbraw/zinc/12/46/61/1096124661.db2.gz RNFDPQIXRCJRIB-HSZRJFAPSA-N 2 0 368.496 4.023 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cnn1C(C)C ZINC000469200296 1096301119 /nfs/dbraw/zinc/30/11/19/1096301119.db2.gz UBFIRMZXOIHDJL-LVCYWYKZSA-N 2 0 354.542 4.334 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422710858 1096459528 /nfs/dbraw/zinc/45/95/28/1096459528.db2.gz GGPSXIGDVIRGDC-URXFXBBRSA-N 2 0 374.532 4.206 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)NCC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000422760735 1096476362 /nfs/dbraw/zinc/47/63/62/1096476362.db2.gz LFLUPUXOKWAHJG-ZWKOTPCHSA-N 2 0 366.553 4.163 20 0 FIADRP C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)CC1 ZINC000422747205 1096480545 /nfs/dbraw/zinc/48/05/45/1096480545.db2.gz PMCLBCJLKAMUGC-TWHAJKEOSA-N 2 0 355.570 4.112 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000422753817 1096484192 /nfs/dbraw/zinc/48/41/92/1096484192.db2.gz GNTUHJLBBAIIOE-MSOLQXFVSA-N 2 0 370.459 4.003 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000422780058 1096489307 /nfs/dbraw/zinc/48/93/07/1096489307.db2.gz JSVUYTWCVOWAIT-JXFKEZNVSA-N 2 0 364.892 4.220 20 0 FIADRP CSc1cccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2cc(F)ccc2F)c1 ZINC000422785351 1096489840 /nfs/dbraw/zinc/48/98/40/1096489840.db2.gz JKTBDKCVVVSARW-DJJJIMSYSA-N 2 0 350.478 4.493 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)c(OC)c1 ZINC000422799991 1096493529 /nfs/dbraw/zinc/49/35/29/1096493529.db2.gz YZQOMENTRYMVBT-ZGDBYOLNSA-N 2 0 374.912 4.306 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422837273 1096503001 /nfs/dbraw/zinc/50/30/01/1096503001.db2.gz LTHQNIJTJFIRCT-OYGALRCHSA-N 2 0 366.480 4.295 20 0 FIADRP c1ccc(COCc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2)cc1 ZINC000422859908 1096506722 /nfs/dbraw/zinc/50/67/22/1096506722.db2.gz KNQRHXPFGGKBOA-WXFUMESZSA-N 2 0 364.533 4.414 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)c(Oc2ccccc2)c1 ZINC000422864716 1096508136 /nfs/dbraw/zinc/50/81/36/1096508136.db2.gz NVULFOFWKCHQPQ-BHIFYINESA-N 2 0 366.505 4.034 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000422880931 1096510915 /nfs/dbraw/zinc/51/09/15/1096510915.db2.gz XVDNKVNBKKXYNA-WBMJQRKESA-N 2 0 367.946 4.176 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000422884260 1096512458 /nfs/dbraw/zinc/51/24/58/1096512458.db2.gz WPYNXNRTNRDHQM-WBMJQRKESA-N 2 0 367.946 4.176 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 ZINC000422887217 1096514163 /nfs/dbraw/zinc/51/41/63/1096514163.db2.gz AMAHCESMPKMTHC-RYUDHWBXSA-N 2 0 368.344 4.351 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 ZINC000422887215 1096514197 /nfs/dbraw/zinc/51/41/97/1096514197.db2.gz AMAHCESMPKMTHC-NEPJUHHUSA-N 2 0 368.344 4.351 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+][C@H]1CCSc2ccccc21 ZINC000422870413 1096516276 /nfs/dbraw/zinc/51/62/76/1096516276.db2.gz YSZFIUZWADCLBP-WAOWUJCRSA-N 2 0 352.503 4.069 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000422874194 1096517032 /nfs/dbraw/zinc/51/70/32/1096517032.db2.gz CGCVMMYVGXBXSX-IRXDYDNUSA-N 2 0 371.500 4.175 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000422874671 1096518416 /nfs/dbraw/zinc/51/84/16/1096518416.db2.gz OCMXHEFAWNIHSZ-ZIAGYGMSSA-N 2 0 357.473 4.188 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422901372 1096518952 /nfs/dbraw/zinc/51/89/52/1096518952.db2.gz BWTUJDSERDUYPN-IBGZPJMESA-N 2 0 362.521 4.206 20 0 FIADRP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cn2)cc1 ZINC000422900925 1096519469 /nfs/dbraw/zinc/51/94/69/1096519469.db2.gz RBWLXIXHMFHPNG-XUVXKRRUSA-N 2 0 355.457 4.023 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000422900887 1096519711 /nfs/dbraw/zinc/51/97/11/1096519711.db2.gz KGCOVIXZNHIREX-STQMWFEESA-N 2 0 367.415 4.202 20 0 FIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H](C)CCCC[NH3+])c(C(F)(F)F)c2)n1 ZINC000422907568 1096521170 /nfs/dbraw/zinc/52/11/70/1096521170.db2.gz XCILMOPEHKCQOR-ZDUSSCGKSA-N 2 0 368.447 4.115 20 0 FIADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422909867 1096521545 /nfs/dbraw/zinc/52/15/45/1096521545.db2.gz PDDMTAIKFKDGEP-NTKDMRAZSA-N 2 0 374.532 4.076 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2C[C@H]4CC[C@@H](C2)[NH2+]4)CCC3)cc1 ZINC000422913037 1096522537 /nfs/dbraw/zinc/52/25/37/1096522537.db2.gz XMVZLHCNWNBUDJ-IXEWLPCDSA-N 2 0 369.534 4.069 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCS2 ZINC000422911741 1096522756 /nfs/dbraw/zinc/52/27/56/1096522756.db2.gz LHHZOEPJRGUAKP-LVCYWYKZSA-N 2 0 370.493 4.208 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(C)cc1)c1ccc(F)cc1Cl ZINC000422892428 1096523677 /nfs/dbraw/zinc/52/36/77/1096523677.db2.gz YNPSYAORIQNLCH-XLIONFOSSA-N 2 0 364.892 4.220 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)nc1-c1ccccc1 ZINC000422925646 1096525833 /nfs/dbraw/zinc/52/58/33/1096525833.db2.gz BWXIMSLTHBKBPX-OTWHNJEPSA-N 2 0 355.551 4.171 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OCC(C)C ZINC000422944545 1096535740 /nfs/dbraw/zinc/53/57/40/1096535740.db2.gz SHEJUIZVAYDVHR-JKSUJKDBSA-N 2 0 371.525 4.304 20 0 FIADRP Clc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422947454 1096536847 /nfs/dbraw/zinc/53/68/47/1096536847.db2.gz QDCLOUHFSAEJKS-UEXGIBASSA-N 2 0 370.880 4.009 20 0 FIADRP CC(C)c1ccccc1OCC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422960322 1096539698 /nfs/dbraw/zinc/53/96/98/1096539698.db2.gz VUAIRGKYALFVQN-OFNKIYASSA-N 2 0 366.505 4.034 20 0 FIADRP c1ccc(COc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)ccn2)cc1 ZINC000422972083 1096543244 /nfs/dbraw/zinc/54/32/44/1096543244.db2.gz KOTHHHCNWMMYNQ-BHIFYINESA-N 2 0 365.521 4.061 20 0 FIADRP FC(F)(F)COCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423000699 1096546764 /nfs/dbraw/zinc/54/67/64/1096546764.db2.gz HEMJRCWGXKUGTE-GUDVDZBRSA-N 2 0 370.459 4.166 20 0 FIADRP Cc1cc([C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)ccc1F ZINC000423009855 1096549390 /nfs/dbraw/zinc/54/93/90/1096549390.db2.gz FEQPAABCBBNGHC-MDNUFGMLSA-N 2 0 366.480 4.431 20 0 FIADRP Cc1cc([C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)ccc1F ZINC000423009856 1096549601 /nfs/dbraw/zinc/54/96/01/1096549601.db2.gz FEQPAABCBBNGHC-MZYLBHOOSA-N 2 0 366.480 4.431 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000423019422 1096550079 /nfs/dbraw/zinc/55/00/79/1096550079.db2.gz VNOOEKVDOPIYOM-CJNGLKHVSA-N 2 0 364.839 4.153 20 0 FIADRP Cc1ccccc1O[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422996186 1096553039 /nfs/dbraw/zinc/55/30/39/1096553039.db2.gz LFCSECNWNIJUSM-RBDMOPTHSA-N 2 0 353.510 4.198 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423037183 1096556030 /nfs/dbraw/zinc/55/60/30/1096556030.db2.gz VQAQDCQFIBICNQ-RPLLJCPNSA-N 2 0 355.929 4.108 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](CC(F)(F)F)c2ccc(Br)cc2)CC1 ZINC000423042457 1096558612 /nfs/dbraw/zinc/55/86/12/1096558612.db2.gz ZHICFBRTQIQZGG-JXQTWKCFSA-N 2 0 365.237 4.302 20 0 FIADRP Cc1oc2ccccc2c1CC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423051602 1096565066 /nfs/dbraw/zinc/56/50/66/1096565066.db2.gz OTIMMDCLHKXZLA-NFBKMPQASA-N 2 0 362.473 4.129 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000423052645 1096565600 /nfs/dbraw/zinc/56/56/00/1096565600.db2.gz RAQXKMJRFXFQRT-LADGPHEKSA-N 2 0 371.484 4.094 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000423077653 1096566136 /nfs/dbraw/zinc/56/61/36/1096566136.db2.gz MNTXFWXNKUDGLF-AWEZNQCLSA-N 2 0 359.464 4.290 20 0 FIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423093516 1096571911 /nfs/dbraw/zinc/57/19/11/1096571911.db2.gz HVBFISRCWSRWPA-XFUTXVRSSA-N 2 0 352.444 4.462 20 0 FIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423093515 1096572063 /nfs/dbraw/zinc/57/20/63/1096572063.db2.gz HVBFISRCWSRWPA-WSIUPNEHSA-N 2 0 352.444 4.462 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097829 1096574117 /nfs/dbraw/zinc/57/41/17/1096574117.db2.gz RGNSIOOXNGPJLL-DDUZABMNSA-N 2 0 363.427 4.464 20 0 FIADRP CC(F)(F)c1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423125797 1096580033 /nfs/dbraw/zinc/58/00/33/1096580033.db2.gz AHMZEZJELVKRQY-GHTZIAJQSA-N 2 0 358.432 4.144 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423125465 1096580380 /nfs/dbraw/zinc/58/03/80/1096580380.db2.gz QNPDEEZBOGMIKP-BDJLRTHQSA-N 2 0 350.304 4.025 20 0 FIADRP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423104016 1096582105 /nfs/dbraw/zinc/58/21/05/1096582105.db2.gz PMUDPNVXMUEXIA-BRWVUGGUSA-N 2 0 364.942 4.110 20 0 FIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000503915968 1096586162 /nfs/dbraw/zinc/58/61/62/1096586162.db2.gz YOPYVUDUZDQHCJ-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1OC(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503909252 1096592643 /nfs/dbraw/zinc/59/26/43/1096592643.db2.gz LEIKDJJSYKQBRF-GDAAHCPNSA-N 2 0 352.469 4.037 20 0 FIADRP c1c2ccccc2sc1CC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423140923 1096594733 /nfs/dbraw/zinc/59/47/33/1096594733.db2.gz ZSOZLXJNTJVRDP-SIKLNZKXSA-N 2 0 364.514 4.289 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH+]1CCC(Cc2cccc(F)c2F)CC1 ZINC000423166334 1096600078 /nfs/dbraw/zinc/60/00/78/1096600078.db2.gz VNENSDVNPRYBEE-HNNXBMFYSA-N 2 0 359.464 4.143 20 0 FIADRP COCCC[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(Br)cc1 ZINC000423180409 1096606763 /nfs/dbraw/zinc/60/67/63/1096606763.db2.gz NNYLLUQZSGPPLQ-QGZVFWFLSA-N 2 0 369.347 4.168 20 0 FIADRP Brc1cccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2)c1 ZINC000423238741 1096618465 /nfs/dbraw/zinc/61/84/65/1096618465.db2.gz AUNRSWDYFGCLRC-HNAYVOBHSA-N 2 0 359.311 4.128 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc2cc(Br)ccc2o1 ZINC000423219787 1096621549 /nfs/dbraw/zinc/62/15/49/1096621549.db2.gz ULIROEOKMAHMLQ-AVGNSLFASA-N 2 0 351.288 4.234 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423258932 1096632814 /nfs/dbraw/zinc/63/28/14/1096632814.db2.gz NDIDTBZNLLWUSY-QAPCUYQASA-N 2 0 371.550 4.175 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423258933 1096632972 /nfs/dbraw/zinc/63/29/72/1096632972.db2.gz NDIDTBZNLLWUSY-YJBOKZPZSA-N 2 0 371.550 4.175 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)ccc2F)cc1 ZINC000423291052 1096635665 /nfs/dbraw/zinc/63/56/65/1096635665.db2.gz GLJJVRMZLVLERB-NEPJUHHUSA-N 2 0 351.263 4.459 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000423293160 1096637377 /nfs/dbraw/zinc/63/73/77/1096637377.db2.gz QASAPGUGVSJZCA-IINYFYTJSA-N 2 0 351.313 4.307 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]CC1 ZINC000423319693 1096642172 /nfs/dbraw/zinc/64/21/72/1096642172.db2.gz DRMFRHQYCVBXNW-MRXNPFEDSA-N 2 0 359.514 4.306 20 0 FIADRP CC1(C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC[NH2+]CC1 ZINC000423317068 1096642473 /nfs/dbraw/zinc/64/24/73/1096642473.db2.gz BJSYWOMAGABQCR-JOCHJYFZSA-N 2 0 363.480 4.443 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000423319966 1096643655 /nfs/dbraw/zinc/64/36/55/1096643655.db2.gz FUXILNRVIMJBQT-KRWDZBQOSA-N 2 0 351.263 4.006 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000423296214 1096644440 /nfs/dbraw/zinc/64/44/40/1096644440.db2.gz YPKWEABVQDPWPI-KPZWWZAWSA-N 2 0 350.384 4.382 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)CCC3)cc1 ZINC000423344802 1096646809 /nfs/dbraw/zinc/64/68/09/1096646809.db2.gz YEAULUVWWBUYPG-LAUBAEHRSA-N 2 0 371.550 4.175 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[NH+]3CCC(C)CC3)cc2)cc1 ZINC000423333154 1096649743 /nfs/dbraw/zinc/64/97/43/1096649743.db2.gz OCHIZHLFQKOACL-KRWDZBQOSA-N 2 0 351.494 4.191 20 0 FIADRP Brc1ccc([C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)s1 ZINC000423366643 1096658305 /nfs/dbraw/zinc/65/83/05/1096658305.db2.gz BXJJSPZBHXZLAV-QGZVFWFLSA-N 2 0 363.324 4.355 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccco1)c1ccc(Br)cc1 ZINC000423445582 1096678145 /nfs/dbraw/zinc/67/81/45/1096678145.db2.gz YDJUVNPRWVDOBZ-SUMWQHHRSA-N 2 0 351.288 4.239 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H](C)CCC[NH3+])nc1 ZINC000423450572 1096680448 /nfs/dbraw/zinc/68/04/48/1096680448.db2.gz HLXDOYVUKAQKSY-KKSFZXQISA-N 2 0 359.945 4.168 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000423428936 1096682728 /nfs/dbraw/zinc/68/27/28/1096682728.db2.gz GWMNWHLVKSQHIP-CGTJXYLNSA-N 2 0 367.306 4.017 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]Cc2ccc4c(c2)CCCN4)C3)cc1 ZINC000423437134 1096685944 /nfs/dbraw/zinc/68/59/44/1096685944.db2.gz GCUFCDFCNQMZJQ-NUNAXRQHSA-N 2 0 361.533 4.330 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000423464765 1096691899 /nfs/dbraw/zinc/69/18/99/1096691899.db2.gz HGLUTCGILRTWQD-BAGYTPMASA-N 2 0 353.485 4.045 20 0 FIADRP Brc1ccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccco2)cc1 ZINC000423470838 1096693193 /nfs/dbraw/zinc/69/31/93/1096693193.db2.gz DMKGCVHBEAZBEA-AEFFLSMTSA-N 2 0 363.299 4.253 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cnn1C(C)(C)C ZINC000423480375 1096698699 /nfs/dbraw/zinc/69/86/99/1096698699.db2.gz VXILPKYKTNKXJN-MOXGXCLJSA-N 2 0 372.532 4.130 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(-c2cccs2)cc1 ZINC000423506031 1096701949 /nfs/dbraw/zinc/70/19/49/1096701949.db2.gz IHBASXZADNEFID-RPCJCACASA-N 2 0 369.578 4.282 20 0 FIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000423509958 1096702962 /nfs/dbraw/zinc/70/29/62/1096702962.db2.gz RTGFKLOPWBBAKF-DNVCBOLYSA-N 2 0 351.494 4.047 20 0 FIADRP COC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000423518081 1096711885 /nfs/dbraw/zinc/71/18/85/1096711885.db2.gz ZFXKQCBTQSGIQX-MOPGFXCFSA-N 2 0 366.427 4.463 20 0 FIADRP [NH3+]CCC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000423518622 1096712015 /nfs/dbraw/zinc/71/20/15/1096712015.db2.gz PFLOXMMJLDLOSJ-KIHHCIJBSA-N 3 0 363.549 4.252 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423524379 1096713095 /nfs/dbraw/zinc/71/30/95/1096713095.db2.gz WYXILDGHXOHNGY-YPAWHYETSA-N 2 0 366.505 4.238 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C1CCC([NH+]2CCNCC2)CC1 ZINC000423525780 1096713305 /nfs/dbraw/zinc/71/33/05/1096713305.db2.gz YQBFUHXFVOKSFD-LBXVMSDZSA-N 2 0 369.578 4.085 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2cnc3ccccc3c2)cc1 ZINC000423536654 1096715398 /nfs/dbraw/zinc/71/53/98/1096715398.db2.gz IBJHWAFKBSRWKP-HSZRJFAPSA-N 2 0 361.464 4.363 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423540319 1096716496 /nfs/dbraw/zinc/71/64/96/1096716496.db2.gz JRGIRQRHDHCCJI-INDMIFKZSA-N 2 0 367.562 4.474 20 0 FIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423540318 1096716813 /nfs/dbraw/zinc/71/68/13/1096716813.db2.gz JRGIRQRHDHCCJI-FCGDIQPGSA-N 2 0 367.562 4.474 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(OCc2ccccc2)cc1 ZINC000423544482 1096717312 /nfs/dbraw/zinc/71/73/12/1096717312.db2.gz OGFUKCIABAELIB-GUGJDKNPSA-N 2 0 350.506 4.304 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(OCc2ccccc2)cc1 ZINC000423544481 1096717439 /nfs/dbraw/zinc/71/74/39/1096717439.db2.gz OGFUKCIABAELIB-AGOPTVSRSA-N 2 0 350.506 4.304 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@@H]3C1)CCC2 ZINC000423543574 1096717708 /nfs/dbraw/zinc/71/77/08/1096717708.db2.gz NGGMAFTWCSWMRF-BASYENTBSA-N 2 0 371.525 4.304 20 0 FIADRP FC(F)(F)COc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000533075672 1098742365 /nfs/dbraw/zinc/74/23/65/1098742365.db2.gz WZNJINPVDNNXRH-LPHOPBHVSA-N 2 0 368.443 4.076 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccsc2)c1 ZINC000436228287 1098836112 /nfs/dbraw/zinc/83/61/12/1098836112.db2.gz AHWXWDYJQDARCA-UHFFFAOYSA-N 2 0 354.523 4.268 20 0 FIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000515702535 1098846447 /nfs/dbraw/zinc/84/64/47/1098846447.db2.gz NZVODVDQEJUBJE-HXUWFJFHSA-N 2 0 354.469 4.207 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)cc1OC ZINC000436296606 1098910254 /nfs/dbraw/zinc/91/02/54/1098910254.db2.gz VFUZGRDKELLIDE-PXNSSMCTSA-N 2 0 360.542 4.022 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC1 ZINC000436305671 1098918369 /nfs/dbraw/zinc/91/83/69/1098918369.db2.gz IYJKHWCDSNGXNL-JOCHJYFZSA-N 2 0 357.586 4.098 20 0 FIADRP COc1ccc(F)c(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c1 ZINC000516096464 1099188578 /nfs/dbraw/zinc/18/85/78/1099188578.db2.gz JSYJIVYUBFGRMQ-UHFFFAOYSA-N 2 0 356.485 4.356 20 0 FIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459389773 1099364159 /nfs/dbraw/zinc/36/41/59/1099364159.db2.gz MQWIYDAATPKBDC-LJQANCHMSA-N 2 0 367.537 4.449 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000505925545 1099505978 /nfs/dbraw/zinc/50/59/78/1099505978.db2.gz USIZCAVTWHOTKN-LEWJYISDSA-N 2 0 365.606 4.002 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC1 ZINC000516770507 1099789208 /nfs/dbraw/zinc/78/92/08/1099789208.db2.gz MYTWHVZAHGOHNK-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP CCOCc1ccccc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508694339 1099826996 /nfs/dbraw/zinc/82/69/96/1099826996.db2.gz CPYNMDKYTMWMRC-DENIHFKCSA-N 2 0 352.522 4.223 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000508695412 1099827669 /nfs/dbraw/zinc/82/76/69/1099827669.db2.gz FKIRDUFWWYDLQR-IKLNAOFOSA-N 2 0 350.506 4.051 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000508702554 1099854160 /nfs/dbraw/zinc/85/41/60/1099854160.db2.gz ZKXCZHZWMQHWIP-IITNATTFSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1Cl ZINC000162551085 1099860515 /nfs/dbraw/zinc/86/05/15/1099860515.db2.gz KEGMLPSZHGZNOS-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710628 1099894042 /nfs/dbraw/zinc/89/40/42/1099894042.db2.gz NAZDZNSHSMPOJW-QUCCMNQESA-N 2 0 352.497 4.358 20 0 FIADRP C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710627 1099895204 /nfs/dbraw/zinc/89/52/04/1099895204.db2.gz NAZDZNSHSMPOJW-ICSRJNTNSA-N 2 0 352.497 4.358 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508709950 1099899341 /nfs/dbraw/zinc/89/93/41/1099899341.db2.gz KMABGVMTWSFDSH-DENIHFKCSA-N 2 0 351.538 4.379 20 0 FIADRP C[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508711771 1099904237 /nfs/dbraw/zinc/90/42/37/1099904237.db2.gz PDVKWNNWWQQBIQ-IEBWSBKVSA-N 2 0 369.578 4.065 20 0 FIADRP C[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508719423 1099909104 /nfs/dbraw/zinc/90/91/04/1099909104.db2.gz PMBGZVHOMMMZBP-PKOBYXMFSA-N 2 0 371.594 4.483 20 0 FIADRP C[C@@H]([NH2+]CCCN(C)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721441 1099937616 /nfs/dbraw/zinc/93/76/16/1099937616.db2.gz USOMYRFZJVVIBK-IFMALSPDSA-N 2 0 351.538 4.013 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722901 1099943318 /nfs/dbraw/zinc/94/33/18/1099943318.db2.gz YQTRHQVGUUTNIR-PZJWPPBQSA-N 2 0 364.533 4.227 20 0 FIADRP Cc1ccc2ncc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)n2c1 ZINC000536663751 1100138672 /nfs/dbraw/zinc/13/86/72/1100138672.db2.gz SRHUSJYPORZCQW-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP COc1ccc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccco2)cc1 ZINC000459567910 1100315772 /nfs/dbraw/zinc/31/57/72/1100315772.db2.gz YMTMXOFRJADFDS-QFIPXVFZSA-N 2 0 363.461 4.031 20 0 FIADRP CCn1cc([C@@H](C)[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000536827321 1100325003 /nfs/dbraw/zinc/32/50/03/1100325003.db2.gz OHJWUCHZUMIOTR-LJQANCHMSA-N 2 0 354.542 4.246 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccccc1Br ZINC000536831259 1100368923 /nfs/dbraw/zinc/36/89/23/1100368923.db2.gz GVMBOJVPWFZMDZ-KEYYUXOJSA-N 2 0 353.348 4.045 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccccc1Br ZINC000536831258 1100370050 /nfs/dbraw/zinc/37/00/50/1100370050.db2.gz GVMBOJVPWFZMDZ-JKIFEVAISA-N 2 0 353.348 4.045 20 0 FIADRP CCSc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000536855086 1100372177 /nfs/dbraw/zinc/37/21/77/1100372177.db2.gz YHXLYEYVGOAFDR-NDXORKPFSA-N 2 0 362.583 4.217 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(OC(F)(F)F)c1 ZINC000536859468 1100376054 /nfs/dbraw/zinc/37/60/54/1100376054.db2.gz UYNXXYJSRUBJBP-XHSDSOJGSA-N 2 0 374.447 4.125 20 0 FIADRP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459657691 1100401093 /nfs/dbraw/zinc/40/10/93/1100401093.db2.gz IJLOVUIISFQIPV-UHFFFAOYSA-N 2 0 359.477 4.107 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000438093288 1100415795 /nfs/dbraw/zinc/41/57/95/1100415795.db2.gz BUIKPXMIUOOSRJ-GGAORHGYSA-N 2 0 358.570 4.320 20 0 FIADRP CN(Cc1cc2c(cccc2F)[nH]1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000438112015 1100436737 /nfs/dbraw/zinc/43/67/37/1100436737.db2.gz XYYRDBFXAAPAFS-SFHVURJKSA-N 2 0 351.469 4.261 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]CC2=Cc3ccccc3OC2)C1 ZINC000517537486 1100473334 /nfs/dbraw/zinc/47/33/34/1100473334.db2.gz UFDUAFUOTHVDJW-LJQANCHMSA-N 2 0 362.517 4.484 20 0 FIADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414932709 1100695761 /nfs/dbraw/zinc/69/57/61/1100695761.db2.gz DESFIFFQVGKRAE-KBXCAEBGSA-N 2 0 360.933 4.046 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1O ZINC000426175973 1100948219 /nfs/dbraw/zinc/94/82/19/1100948219.db2.gz XAKGWVVEFXOYRA-GOSISDBHSA-N 2 0 362.558 4.070 20 0 FIADRP c1cc(-c2nc3ccccc3s2)oc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000261964331 1101054557 /nfs/dbraw/zinc/05/45/57/1101054557.db2.gz HPEYDXBFKOQFNW-UHFFFAOYSA-N 2 0 353.491 4.132 20 0 FIADRP FC(F)(F)c1cc(Br)ccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414973343 1101061443 /nfs/dbraw/zinc/06/14/43/1101061443.db2.gz ZHRFCZBIEKEAMI-ZDUSSCGKSA-N 2 0 365.237 4.090 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOCCc2ccccc2)C1 ZINC000506474789 1101111051 /nfs/dbraw/zinc/11/10/51/1101111051.db2.gz PPFKYGICIASALG-GMAHTHKFSA-N 2 0 358.570 4.222 20 0 FIADRP C[C@@H](C[NH2+][C@@H](c1ccc(Br)s1)C1CC1)C[NH+]1CCCC1 ZINC000439133814 1101188474 /nfs/dbraw/zinc/18/84/74/1101188474.db2.gz SWOZVBKONYIFCD-BLLLJJGKSA-N 2 0 357.361 4.283 20 0 FIADRP C[C@H](C[NH2+][C@H](c1ccc(Br)s1)C1CC1)C[NH+]1CCCC1 ZINC000439133817 1101189946 /nfs/dbraw/zinc/18/99/46/1101189946.db2.gz SWOZVBKONYIFCD-WBMJQRKESA-N 2 0 357.361 4.283 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)s1 ZINC000439146572 1101200451 /nfs/dbraw/zinc/20/04/51/1101200451.db2.gz NCKPQBPJXULECY-HEHGZKQESA-N 2 0 355.345 4.178 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439146965 1101201481 /nfs/dbraw/zinc/20/14/81/1101201481.db2.gz PGMFRFAHCOAVBB-INIZCTEOSA-N 2 0 357.361 4.283 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)C1 ZINC000414991871 1101285301 /nfs/dbraw/zinc/28/53/01/1101285301.db2.gz BHBZWQSPAQDPMZ-GWCFXTLKSA-N 2 0 365.237 4.075 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000536947248 1101369554 /nfs/dbraw/zinc/36/95/54/1101369554.db2.gz PLUDHHQQZYVPRZ-INIZCTEOSA-N 2 0 362.949 4.389 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013844 1101393320 /nfs/dbraw/zinc/39/33/20/1101393320.db2.gz SKVHNSHPAWIEIK-VSKRKVRLSA-N 2 0 360.517 4.024 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000537012585 1101394662 /nfs/dbraw/zinc/39/46/62/1101394662.db2.gz XJSRFGSNIGZLAT-HXUWFJFHSA-N 2 0 361.917 4.162 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000537117292 1101462558 /nfs/dbraw/zinc/46/25/58/1101462558.db2.gz BBJUTUWXNFHRRP-IBGZPJMESA-N 2 0 374.912 4.284 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(Br)ccc1F ZINC000518765571 1101522574 /nfs/dbraw/zinc/52/25/74/1101522574.db2.gz NCSOIKXJYZAILS-CQSZACIVSA-N 2 0 357.311 4.332 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000518765631 1101523236 /nfs/dbraw/zinc/52/32/36/1101523236.db2.gz SBCFFXULRJIEEU-HZPDHXFCSA-N 2 0 358.448 4.085 20 0 FIADRP CCc1ccccc1C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537197902 1101532505 /nfs/dbraw/zinc/53/25/05/1101532505.db2.gz KUKIKQUTAXVZTC-NRFANRHFSA-N 2 0 350.506 4.327 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1 ZINC000537292242 1101611366 /nfs/dbraw/zinc/61/13/66/1101611366.db2.gz HGFGVTLLGMFWAI-PMACEKPBSA-N 2 0 350.522 4.130 20 0 FIADRP C[C@@H](C[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CC[NH+](C)CC1 ZINC000537295450 1101617713 /nfs/dbraw/zinc/61/77/13/1101617713.db2.gz LJPGBIQXTHZDCL-PXNSSMCTSA-N 2 0 365.993 4.290 20 0 FIADRP CCC1(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000537307389 1101634351 /nfs/dbraw/zinc/63/43/51/1101634351.db2.gz NQWVNSPNMFFRAL-BDTNDASRSA-N 2 0 368.565 4.226 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](Cc2cccnc2)CC1 ZINC001168165822 1101762577 /nfs/dbraw/zinc/76/25/77/1101762577.db2.gz JMRNVLXBZUNIMR-KRWDZBQOSA-N 2 0 357.929 4.168 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000519012029 1101827043 /nfs/dbraw/zinc/82/70/43/1101827043.db2.gz LDOMTBARBLGVIZ-UHFFFAOYSA-N 2 0 360.505 4.051 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168168723 1101829565 /nfs/dbraw/zinc/82/95/65/1101829565.db2.gz UTSMHIZLCMMOGJ-NDXORKPFSA-N 2 0 357.929 4.438 20 0 FIADRP FC(F)(F)c1cc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc(C(F)(F)F)c1 ZINC000262005423 1102003977 /nfs/dbraw/zinc/00/39/77/1102003977.db2.gz LTSXRZPUXPRUGQ-UHFFFAOYSA-N 2 0 366.349 4.300 20 0 FIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000440104592 1102032713 /nfs/dbraw/zinc/03/27/13/1102032713.db2.gz LCMFPEXMHQBSIJ-QFIPXVFZSA-N 2 0 369.553 4.061 20 0 FIADRP COc1ccc2c(c1)C[C@H]([N@H+](C)CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168284119 1102054741 /nfs/dbraw/zinc/05/47/41/1102054741.db2.gz RPDKLDNXMBGCLX-HSZRJFAPSA-N 2 0 364.533 4.006 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2OC)cc1 ZINC000120581080 1102235216 /nfs/dbraw/zinc/23/52/16/1102235216.db2.gz QJPJHXGBSRZZSL-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H](C)CCCC[NH3+])o1 ZINC000415012485 1102245133 /nfs/dbraw/zinc/24/51/33/1102245133.db2.gz IYHGSAQBAVJMSP-INIZCTEOSA-N 2 0 352.482 4.048 20 0 FIADRP Cc1ccc2cc(C[NH2+]C[C@@H]3C[NH2+]CC[C@@H]3c3ccc(F)cc3)ccc2n1 ZINC000415013992 1102261548 /nfs/dbraw/zinc/26/15/48/1102261548.db2.gz ZCSIFBWHYHTPHN-RBBKRZOGSA-N 2 0 363.480 4.165 20 0 FIADRP C[N@H+](CCC[NH2+]C1CCC2(CC1)c1ccccc1NC2=O)C1CCCCC1 ZINC000120782955 1102264570 /nfs/dbraw/zinc/26/45/70/1102264570.db2.gz BWFUEAHNXBLCPI-UHFFFAOYSA-N 2 0 369.553 4.063 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(CO)c1 ZINC000121085435 1102323652 /nfs/dbraw/zinc/32/36/52/1102323652.db2.gz YGELMPGCHQYDMH-IBGZPJMESA-N 2 0 352.522 4.262 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1 ZINC000532446326 1102338052 /nfs/dbraw/zinc/33/80/52/1102338052.db2.gz FTYFJNNBCHUJQI-JKIFEVAISA-N 2 0 353.348 4.045 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1sccc1Br ZINC000532454280 1102346152 /nfs/dbraw/zinc/34/61/52/1102346152.db2.gz FJWFJDHRSANRBR-LBPRGKRZSA-N 2 0 353.329 4.423 20 0 FIADRP Cc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1Br ZINC001168202477 1102385923 /nfs/dbraw/zinc/38/59/23/1102385923.db2.gz VDMIQFJCYXFJKH-UHFFFAOYSA-N 2 0 353.348 4.311 20 0 FIADRP COc1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1OC ZINC000537636405 1102390867 /nfs/dbraw/zinc/39/08/67/1102390867.db2.gz MQWUERQYPOXRGY-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP CC[NH+](CC)Cc1ccccc1CNCc1conc1Cc1ccccc1 ZINC000550074798 1102391626 /nfs/dbraw/zinc/39/16/26/1102391626.db2.gz DTLWSBVTBAZQIE-UHFFFAOYSA-N 2 0 363.505 4.397 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000121750685 1102449985 /nfs/dbraw/zinc/44/99/85/1102449985.db2.gz BZPGQBQWGKCTKR-HNNXBMFYSA-N 2 0 358.555 4.286 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1OC(F)F ZINC000122324812 1102556742 /nfs/dbraw/zinc/55/67/42/1102556742.db2.gz KQFKPSMRTWUTED-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)ccc1SC ZINC000122371304 1102569006 /nfs/dbraw/zinc/56/90/06/1102569006.db2.gz OGHSYUNSFJKGRA-MRXNPFEDSA-N 2 0 374.550 4.208 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OC(F)F)c(OC)c2)CC1 ZINC000122682985 1102611666 /nfs/dbraw/zinc/61/16/66/1102611666.db2.gz JSYXPFGOCYHQSQ-AWEZNQCLSA-N 2 0 356.457 4.069 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000122745955 1102620070 /nfs/dbraw/zinc/62/00/70/1102620070.db2.gz WEUSLEBTSVLFHU-OAHLLOKOSA-N 2 0 358.555 4.286 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1 ZINC000550881685 1102651754 /nfs/dbraw/zinc/65/17/54/1102651754.db2.gz BDYZAMNLLFVBIF-OFNKIYASSA-N 2 0 364.533 4.266 20 0 FIADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550881906 1102653333 /nfs/dbraw/zinc/65/33/33/1102653333.db2.gz FVONANQCVCXADB-BDTNDASRSA-N 2 0 370.581 4.330 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CCS[C@H]2CCCC[C@H]21)C1CC[NH+](C)CC1 ZINC000537649687 1102684047 /nfs/dbraw/zinc/68/40/47/1102684047.db2.gz VOCWBGUMCAFOHV-YADHBBJMSA-N 2 0 373.610 4.077 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCCc4c(O)cccc43)cc2)CC1 ZINC000550932421 1102712859 /nfs/dbraw/zinc/71/28/59/1102712859.db2.gz WOBHNVNVBICDCW-QFIPXVFZSA-N 2 0 366.505 4.032 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)OCCO2 ZINC000123019307 1102746669 /nfs/dbraw/zinc/74/66/69/1102746669.db2.gz QMFCZBPSYBZIDI-NRFANRHFSA-N 2 0 366.505 4.295 20 0 FIADRP Clc1ccc(Cl)c(-c2csc(C[NH2+][C@@H]3CC34CC[NH2+]CC4)n2)c1 ZINC000666953506 1102747751 /nfs/dbraw/zinc/74/77/51/1102747751.db2.gz ADWMFCMMZIGKCN-OAHLLOKOSA-N 2 0 368.333 4.349 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[NH+](C)C)cc1 ZINC000551014267 1102790629 /nfs/dbraw/zinc/79/06/29/1102790629.db2.gz QVTVMSDUIKGDRF-VABKMULXSA-N 2 0 351.538 4.023 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC000459343560 1102866364 /nfs/dbraw/zinc/86/63/64/1102866364.db2.gz MEPNVMMUYXAFSN-UHFFFAOYSA-N 2 0 364.537 4.394 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(C)n2-c2ccccc2)CC1 ZINC000506863161 1102925550 /nfs/dbraw/zinc/92/55/50/1102925550.db2.gz UYDFDCDEBBMIET-UHFFFAOYSA-N 2 0 354.542 4.125 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc(C3CC3)nc2)cc1 ZINC000459366257 1102931121 /nfs/dbraw/zinc/93/11/21/1102931121.db2.gz BMYLXJRPHJHOGU-KRWDZBQOSA-N 2 0 350.510 4.018 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccncc3)s2)CC1 ZINC000506873476 1102935396 /nfs/dbraw/zinc/93/53/96/1102935396.db2.gz GJDNRTGLJLGEAS-UHFFFAOYSA-N 2 0 358.555 4.149 20 0 FIADRP Cc1ccc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)s2)cc1 ZINC000506909085 1102961642 /nfs/dbraw/zinc/96/16/42/1102961642.db2.gz JCUUVKJAJXXWRV-UHFFFAOYSA-N 2 0 355.551 4.426 20 0 FIADRP CCOc1c(Cl)cc(C[NH+]2CCC(C[NH+](CC)CC)CC2)cc1OC ZINC000506926039 1102961899 /nfs/dbraw/zinc/96/18/99/1102961899.db2.gz CHQHKLOBQIDRNR-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cnn(-c3ccc(Cl)cc3)c2)CC1 ZINC000506942868 1102962957 /nfs/dbraw/zinc/96/29/57/1102962957.db2.gz LTSKHRRNCUMNDW-UHFFFAOYSA-N 2 0 360.933 4.080 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000551211477 1102981006 /nfs/dbraw/zinc/98/10/06/1102981006.db2.gz IRAWTARNEDXRAZ-LRQRDZAKSA-N 2 0 356.485 4.363 20 0 FIADRP C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)o1 ZINC000551221255 1102990212 /nfs/dbraw/zinc/99/02/12/1102990212.db2.gz MGVDBCXKGFWDEU-KKSFZXQISA-N 2 0 354.494 4.166 20 0 FIADRP C[C@H](C(=O)N(C)c1ccccc1)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000476985654 1103003738 /nfs/dbraw/zinc/00/37/38/1103003738.db2.gz OJTFPMZTAADFNR-VQTJNVASSA-N 2 0 371.569 4.014 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CC[C@H]3C3CCC3)C3(C2)CCOCC3)cc1 ZINC000551265618 1103025270 /nfs/dbraw/zinc/02/52/70/1103025270.db2.gz WZSJKWBFFVXCFF-RJGXRXQPSA-N 2 0 368.565 4.084 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C/c3ccc(F)cc3)cc2)CC1 ZINC000551271251 1103033453 /nfs/dbraw/zinc/03/34/53/1103033453.db2.gz MTNXOACNFCHKQS-NSCUHMNNSA-N 2 0 354.469 4.102 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2c(C)nn(Cc3ccc(C)cc3)c2Cl)CC1 ZINC000729681619 1103034796 /nfs/dbraw/zinc/03/47/96/1103034796.db2.gz FOQIDOFGXMHAAE-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](CO)CC2CCCC2)CC1 ZINC000551302731 1103059114 /nfs/dbraw/zinc/05/91/14/1103059114.db2.gz YBYIGTPJVUZVTH-UVKLAMSESA-N 2 0 358.570 4.208 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)ccc1O ZINC000459382720 1103105050 /nfs/dbraw/zinc/10/50/50/1103105050.db2.gz WXHIJUKBVBUZOO-SFHVURJKSA-N 2 0 368.521 4.313 20 0 FIADRP COc1ncc([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)cc1Cl ZINC000551533212 1103331244 /nfs/dbraw/zinc/33/12/44/1103331244.db2.gz LSFNZAOVGYPZBK-CQSZACIVSA-N 2 0 351.922 4.191 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000507403536 1103360382 /nfs/dbraw/zinc/36/03/82/1103360382.db2.gz NSZHUTRWUZZODL-CJNGLKHVSA-N 2 0 351.332 4.319 20 0 FIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551563905 1103364408 /nfs/dbraw/zinc/36/44/08/1103364408.db2.gz LWRDJBGPESEEEY-SFHVURJKSA-N 2 0 368.521 4.327 20 0 FIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000507464022 1103409542 /nfs/dbraw/zinc/40/95/42/1103409542.db2.gz WAZISVKBHFEFDX-OTWHNJEPSA-N 2 0 367.537 4.104 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000551617826 1103442617 /nfs/dbraw/zinc/44/26/17/1103442617.db2.gz ZGFRSQHDDQXEME-KRWDZBQOSA-N 2 0 356.485 4.192 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(Cl)c(F)c3)cc2)CC1 ZINC000551620554 1103445376 /nfs/dbraw/zinc/44/53/76/1103445376.db2.gz XXYQMDAVFFWNQQ-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1Cl ZINC000551778469 1103624550 /nfs/dbraw/zinc/62/45/50/1103624550.db2.gz ITGDRIZJWDDVMX-IAGOWNOFSA-N 2 0 368.949 4.279 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cnc(C(C)(C)C)nc2)CC1)CC1CC1 ZINC000551787431 1103642559 /nfs/dbraw/zinc/64/25/59/1103642559.db2.gz PZGQJDLDFVEGCW-UHFFFAOYSA-N 2 0 358.574 4.108 20 0 FIADRP C[C@@H](Cc1ccccc1F)[NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1 ZINC000188047306 1103808279 /nfs/dbraw/zinc/80/82/79/1103808279.db2.gz NMFZWHPXQDWGPK-OALUTQOASA-N 2 0 370.512 4.246 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000519816569 1103881789 /nfs/dbraw/zinc/88/17/89/1103881789.db2.gz OSNZGBJQDLKMQI-PZJWPPBQSA-N 2 0 351.538 4.168 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccn(C2CCCC2)n1 ZINC000537840797 1103964054 /nfs/dbraw/zinc/96/40/54/1103964054.db2.gz GTBQMTHHBISUCH-UHFFFAOYSA-N 2 0 367.541 4.132 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1cscn1 ZINC000538193966 1104028960 /nfs/dbraw/zinc/02/89/60/1104028960.db2.gz GCSDCCBGVPGJQR-FGTMMUONSA-N 2 0 373.566 4.003 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000520210967 1104188119 /nfs/dbraw/zinc/18/81/19/1104188119.db2.gz HRQVXEWJNBSIBW-INIZCTEOSA-N 2 0 374.960 4.390 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCOc2ccc(SC)cc2)CC1 ZINC000441216678 1104200562 /nfs/dbraw/zinc/20/05/62/1104200562.db2.gz FDNNYNXVFKRJOG-UHFFFAOYSA-N 2 0 350.572 4.231 20 0 FIADRP COC(=O)c1oc([C@@H](C)N2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1C ZINC000441319380 1104274089 /nfs/dbraw/zinc/27/40/89/1104274089.db2.gz UUMNAZTZAJNGGW-QZTJIDSGSA-N 2 0 362.514 4.024 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ncc(Br)cc1F ZINC000427604221 1105044710 /nfs/dbraw/zinc/04/47/10/1105044710.db2.gz OEVCOYGXUQZREK-ZIAGYGMSSA-N 2 0 372.326 4.288 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000152375738 1105061539 /nfs/dbraw/zinc/06/15/39/1105061539.db2.gz PYOHKYIQFNZOEA-UONOGXRCSA-N 2 0 358.473 4.476 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152396549 1105082429 /nfs/dbraw/zinc/08/24/29/1105082429.db2.gz CIESYYXQQVODRH-DZGCQCFKSA-N 2 0 359.514 4.393 20 0 FIADRP C[C@H]1CC(NC(=[NH2+])c2cc(F)cc(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168007281 1105131224 /nfs/dbraw/zinc/13/12/24/1105131224.db2.gz ADZCJJOZQJXOHV-GJZGRUSLSA-N 2 0 357.448 4.321 20 0 FIADRP C[C@@H]1C[C@@H](NC(=[NH2+])c2ccc(Cl)nc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008127 1105158934 /nfs/dbraw/zinc/15/89/34/1105158934.db2.gz CTJRMMJYALOGQE-JLVBRIDZSA-N 2 0 356.901 4.092 20 0 FIADRP COc1c2ccccc2oc1CNC1CC[NH+](Cc2ccccc2)CC1 ZINC000474013296 1105181945 /nfs/dbraw/zinc/18/19/45/1105181945.db2.gz ATBNWCXHKCHSBW-UHFFFAOYSA-N 2 0 350.462 4.196 20 0 FIADRP Clc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000665228786 1105224275 /nfs/dbraw/zinc/22/42/75/1105224275.db2.gz HFWYKTJTHMSLCB-IEBWSBKVSA-N 2 0 363.288 4.339 20 0 FIADRP Clc1cc(Cl)cc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000665228785 1105224400 /nfs/dbraw/zinc/22/44/00/1105224400.db2.gz HFWYKTJTHMSLCB-HKUYNNGSSA-N 2 0 363.288 4.339 20 0 FIADRP c1cc(C2CCCCC2)ccc1CC[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000665235805 1105232661 /nfs/dbraw/zinc/23/26/61/1105232661.db2.gz AOOJYYRHRWRVES-DNVJHFABSA-N 2 0 356.554 4.024 20 0 FIADRP COCCC[C@@H](Cc1ccccc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000475353682 1106748972 /nfs/dbraw/zinc/74/89/72/1106748972.db2.gz XHPFXPVALKPSBJ-QFIPXVFZSA-N 2 0 358.570 4.411 20 0 FIADRP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530241009 1106922535 /nfs/dbraw/zinc/92/25/35/1106922535.db2.gz OVPKIIAHLLZTSP-BBRMVZONSA-N 2 0 357.325 4.145 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c2ccccc21 ZINC000643455506 1106980028 /nfs/dbraw/zinc/98/00/28/1106980028.db2.gz NOFUJUCUKALBKN-NIKGAXFTSA-N 2 0 361.411 4.019 20 0 FIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H]3CSCCc4ccccc43)C2)cc1 ZINC000530364374 1106985854 /nfs/dbraw/zinc/98/58/54/1106985854.db2.gz IQRMUUYLMKXDGV-UGKGYDQZSA-N 2 0 352.547 4.129 20 0 FIADRP CCCOc1ccc(C(C)(C)[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000475669418 1107005971 /nfs/dbraw/zinc/00/59/71/1107005971.db2.gz SATKOVUHNHTHAI-UHFFFAOYSA-N 2 0 364.493 4.389 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000530714520 1107260733 /nfs/dbraw/zinc/26/07/33/1107260733.db2.gz HOLBCCPUVQANLJ-PZJWPPBQSA-N 2 0 368.525 4.259 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[N@@H+]1C ZINC000152433975 1107434914 /nfs/dbraw/zinc/43/49/14/1107434914.db2.gz BLFCHZNKVUXLLN-GOEBONIOSA-N 2 0 371.352 4.114 20 0 FIADRP C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475558029 1107732144 /nfs/dbraw/zinc/73/21/44/1107732144.db2.gz GQJUZKSCBNAAAC-ZLPCBKJTSA-N 2 0 352.469 4.216 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152468442 1107774352 /nfs/dbraw/zinc/77/43/52/1107774352.db2.gz YSDKGPANRGLMSL-RDTXWAMCSA-N 2 0 371.525 4.401 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000531676619 1108063499 /nfs/dbraw/zinc/06/34/99/1108063499.db2.gz YVWQTMPPUVIJQC-DNVFCKCGSA-N 2 0 374.532 4.358 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000531704828 1108083399 /nfs/dbraw/zinc/08/33/99/1108083399.db2.gz RBLLGKAFCXYZCD-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000531705508 1108083557 /nfs/dbraw/zinc/08/35/57/1108083557.db2.gz CZEWRWWHWABVMI-AOMKIAJQSA-N 2 0 356.485 4.179 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2sccc21 ZINC000453102621 1108170622 /nfs/dbraw/zinc/17/06/22/1108170622.db2.gz QDUANONEQDTSSJ-IIBYNOLFSA-N 2 0 370.562 4.433 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cs1 ZINC000453112917 1108181074 /nfs/dbraw/zinc/18/10/74/1108181074.db2.gz UASKXSPRAPCOIM-HZPDHXFCSA-N 2 0 361.530 4.359 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2sccc21 ZINC000453198627 1108266674 /nfs/dbraw/zinc/26/66/74/1108266674.db2.gz QHUUNOIGCCPYCJ-BPAFIMBUSA-N 2 0 356.535 4.043 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21)c1nccs1 ZINC000453204119 1108272894 /nfs/dbraw/zinc/27/28/94/1108272894.db2.gz VTZSLLVIJNCCBA-AFYVEPGGSA-N 2 0 355.551 4.279 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453214569 1108284994 /nfs/dbraw/zinc/28/49/94/1108284994.db2.gz DNAFQOZSMDACHO-WMZOPIPTSA-N 2 0 356.535 4.167 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453224702 1108297574 /nfs/dbraw/zinc/29/75/74/1108297574.db2.gz UZERQUUTKPOIMZ-AEFFLSMTSA-N 2 0 356.535 4.167 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2sccc21 ZINC000453231170 1108306205 /nfs/dbraw/zinc/30/62/05/1108306205.db2.gz QDVHROIPFYFQFS-MAUKXSAKSA-N 2 0 359.539 4.202 20 0 FIADRP CC(C)[C@@H]1C[C@@H](C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000453313931 1108402420 /nfs/dbraw/zinc/40/24/20/1108402420.db2.gz DYMKUZNZCHRMJW-SBOSXTITSA-N 2 0 358.570 4.470 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453602529 1108653630 /nfs/dbraw/zinc/65/36/30/1108653630.db2.gz WNZLNHHONAGNQR-UHFFFAOYSA-N 2 0 360.933 4.107 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@H]3CCc4c3cccc4Cl)c2)CCO1 ZINC000532207230 1108695138 /nfs/dbraw/zinc/69/51/38/1108695138.db2.gz UZUWLWGAYDECAZ-ZHRRBRCNSA-N 2 0 370.924 4.338 20 0 FIADRP CC(C)c1ccc([C@H](C)[NH2+]Cc2ccc(CN3CCOCC3)cc2)cc1 ZINC000532188188 1108698712 /nfs/dbraw/zinc/69/87/12/1108698712.db2.gz IPHZRKJPAWJIJT-IBGZPJMESA-N 2 0 352.522 4.493 20 0 FIADRP C[C@H]1C[C@H]1c1ccc(CNC2CC[NH+](CCc3ccc(F)cc3)CC2)o1 ZINC000532210912 1108713033 /nfs/dbraw/zinc/71/30/33/1108713033.db2.gz DHMPQOFENDTCAJ-HRAATJIYSA-N 2 0 356.485 4.339 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCCC2(C)C)c1)C1CCOCC1 ZINC000532214014 1108715817 /nfs/dbraw/zinc/71/58/17/1108715817.db2.gz NTCHXMWAWHFEAT-JOCHJYFZSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)CCCCC2)cc1OC ZINC000532223340 1108722402 /nfs/dbraw/zinc/72/24/02/1108722402.db2.gz KCCIVBBCVYPITK-WSTZPKSXSA-N 2 0 374.569 4.224 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000524812106 1109162033 /nfs/dbraw/zinc/16/20/33/1109162033.db2.gz OMWYUTXFAYSGLR-OALUTQOASA-N 2 0 352.522 4.161 20 0 FIADRP Cc1cc(C(C)(C)C)cc(C)c1C[N@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000525267187 1109324686 /nfs/dbraw/zinc/32/46/86/1109324686.db2.gz OFLQPXBLEQCHBT-JOCHJYFZSA-N 2 0 371.613 4.201 20 0 FIADRP Clc1ccc(Br)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446882464 1109371659 /nfs/dbraw/zinc/37/16/59/1109371659.db2.gz FFIVQDBGSSPHNZ-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)o1 ZINC000525708989 1109488097 /nfs/dbraw/zinc/48/80/97/1109488097.db2.gz APKHJHHBYBCRQT-QFBILLFUSA-N 2 0 364.493 4.013 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000447555758 1109579471 /nfs/dbraw/zinc/57/94/71/1109579471.db2.gz CYRPVAKMIAUBFW-AWEZNQCLSA-N 2 0 356.432 4.153 20 0 FIADRP CCOC(=O)c1oc2c(c1C)[C@@H]([NH2+]CCCCNc1ccccn1)CCC2 ZINC000447563016 1109583076 /nfs/dbraw/zinc/58/30/76/1109583076.db2.gz NLZNBGHFRCBCFT-INIZCTEOSA-N 2 0 371.481 4.019 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000447565583 1109584346 /nfs/dbraw/zinc/58/43/46/1109584346.db2.gz MGYUOHNKGOATKF-ACJLOTCBSA-N 2 0 363.343 4.461 20 0 FIADRP CCO[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000447577577 1109593779 /nfs/dbraw/zinc/59/37/79/1109593779.db2.gz IIYLVXGPLIGTLE-AJSBUHFISA-N 2 0 352.522 4.264 20 0 FIADRP C[C@H](C[NH+]1CCCCCC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447608316 1109601417 /nfs/dbraw/zinc/60/14/17/1109601417.db2.gz VCHTZRKNOSJPNO-ADHNFCLRSA-N 2 0 355.570 4.036 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(C)c(OC)c3)CC2)cc1 ZINC000447817894 1109646939 /nfs/dbraw/zinc/64/69/39/1109646939.db2.gz SYAXBZJYMLDNRY-UHFFFAOYSA-N 2 0 368.521 4.014 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(SC)cc2)CC1 ZINC000527118635 1109699717 /nfs/dbraw/zinc/69/97/17/1109699717.db2.gz LCLQFGIDQSWEAD-UHFFFAOYSA-N 2 0 369.578 4.230 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1 ZINC000527222464 1109716571 /nfs/dbraw/zinc/71/65/71/1109716571.db2.gz XGXLRSTVNSSIFK-DNQXCXABSA-N 2 0 365.565 4.005 20 0 FIADRP C[C@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)c1cc(F)cc(F)c1 ZINC000449014885 1109954388 /nfs/dbraw/zinc/95/43/88/1109954388.db2.gz AKAFNUQDDBNVHX-QGZVFWFLSA-N 2 0 373.491 4.102 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000449084109 1109970495 /nfs/dbraw/zinc/97/04/95/1109970495.db2.gz WOAVNHSDEOZESG-YADHBBJMSA-N 3 0 371.613 4.184 20 0 FIADRP COCc1ccc(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)cc1 ZINC000449069435 1109971873 /nfs/dbraw/zinc/97/18/73/1109971873.db2.gz GSJRNDNMKQCOJY-LJQANCHMSA-N 2 0 352.522 4.018 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2cccc3cccnc32)CC1 ZINC000449076539 1109973805 /nfs/dbraw/zinc/97/38/05/1109973805.db2.gz UBXHLZGCDSDGEO-HXUWFJFHSA-N 2 0 373.544 4.463 20 0 FIADRP C[C@H](COCC(F)(F)F)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449098549 1109975966 /nfs/dbraw/zinc/97/59/66/1109975966.db2.gz JQNUIPSCTZDMNO-CQSZACIVSA-N 2 0 352.485 4.223 20 0 FIADRP c1cc2cccc(C[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)c2o1 ZINC000449141742 1109984530 /nfs/dbraw/zinc/98/45/30/1109984530.db2.gz MEZAZGHDYVAFDZ-UHFFFAOYSA-N 2 0 350.462 4.197 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2coc3ccccc23)[C@H](C)C1 ZINC000449143862 1109984987 /nfs/dbraw/zinc/98/49/87/1109984987.db2.gz XXCJBXMDBNSNOS-OPYAIIAOSA-N 2 0 358.526 4.090 20 0 FIADRP Clc1ccc(C2=CC[C@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)CC2)cc1 ZINC000449163441 1109989956 /nfs/dbraw/zinc/98/99/56/1109989956.db2.gz WDUIIGDRHFQHPE-UTKZUKDTSA-N 2 0 374.956 4.366 20 0 FIADRP Cc1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000449188088 1109990901 /nfs/dbraw/zinc/99/09/01/1109990901.db2.gz RPDRDPWJPVKVCP-UHFFFAOYSA-N 2 0 358.551 4.217 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CCC3(CCOCC3)CC2)CC1 ZINC000449188103 1109991120 /nfs/dbraw/zinc/99/11/20/1109991120.db2.gz RSIZCDYAKSXTDC-FQEVSTJZSA-N 2 0 370.581 4.411 20 0 FIADRP CCOCCC1(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCC1 ZINC000449184531 1109994031 /nfs/dbraw/zinc/99/40/31/1109994031.db2.gz GJVDBBHYXWZOGH-HXUWFJFHSA-N 2 0 358.570 4.269 20 0 FIADRP COc1cccc2c(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cccc12 ZINC000449252354 1110005839 /nfs/dbraw/zinc/00/58/39/1110005839.db2.gz QLBMWTNCCWHTBY-UHFFFAOYSA-N 2 0 361.489 4.250 20 0 FIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cnc(-c4ccccc4F)s3)C2)CC1 ZINC000449326553 1110026367 /nfs/dbraw/zinc/02/63/67/1110026367.db2.gz XDMJLGJMMUOZMR-INIZCTEOSA-N 2 0 359.514 4.113 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000449322978 1110026861 /nfs/dbraw/zinc/02/68/61/1110026861.db2.gz QVLMTEIKRPAPMZ-FQEVSTJZSA-N 2 0 363.549 4.189 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC(C)(C)c2ccccn2)CC1 ZINC000449394129 1110050203 /nfs/dbraw/zinc/05/02/03/1110050203.db2.gz PKDVLKTUCHQWPY-LJQANCHMSA-N 2 0 351.538 4.044 20 0 FIADRP CC1(C)C[N@H+](Cc2cncs2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413882 1110055541 /nfs/dbraw/zinc/05/55/41/1110055541.db2.gz KNFRCVCXQJYZOR-FQEVSTJZSA-N 2 0 355.551 4.266 20 0 FIADRP Cc1nocc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411217 1110062659 /nfs/dbraw/zinc/06/26/59/1110062659.db2.gz AOCABBKUSRATTC-NRFANRHFSA-N 2 0 353.510 4.106 20 0 FIADRP CC[C@@H](CCc1ccc(Br)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449562043 1110111075 /nfs/dbraw/zinc/11/10/75/1110111075.db2.gz ZNTIHVYOVDNNJE-QBUWPKIASA-N 2 0 365.359 4.375 20 0 FIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000538396377 1111122754 /nfs/dbraw/zinc/12/27/54/1111122754.db2.gz RCUJQYSXDUVERK-VQIMIIECSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000538396373 1111122902 /nfs/dbraw/zinc/12/29/02/1111122902.db2.gz RCUJQYSXDUVERK-APWZRJJASA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(F)cc1 ZINC000538409329 1111129096 /nfs/dbraw/zinc/12/90/96/1111129096.db2.gz MDZCAVYPKGUXFS-HBMCJLEFSA-N 2 0 362.533 4.270 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000538410877 1111130544 /nfs/dbraw/zinc/13/05/44/1111130544.db2.gz LHXIRIGBCSCLII-PZJWPPBQSA-N 2 0 374.532 4.420 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H](Nc2cccc(C[NH+]3CCCCC3)c2)[C@@H](C)C1 ZINC000538498326 1111160318 /nfs/dbraw/zinc/16/03/18/1111160318.db2.gz WKUNCNNHBHQQJH-REWPJTCUSA-N 2 0 373.585 4.221 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)C[C@H](C)O1 ZINC000461385688 1111192857 /nfs/dbraw/zinc/19/28/57/1111192857.db2.gz ICFMQBMQMVQKHP-IRXDYDNUSA-N 2 0 366.496 4.336 20 0 FIADRP COc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2ccccc12 ZINC000538799118 1111295371 /nfs/dbraw/zinc/29/53/71/1111295371.db2.gz OKCUGSZJBCRHTK-AVRDEDQJSA-N 2 0 350.506 4.297 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(N3CCCC3)nc2)CC1)CC1CC1 ZINC000538857517 1111321862 /nfs/dbraw/zinc/32/18/62/1111321862.db2.gz CTUCPENWRVIDDR-UHFFFAOYSA-N 2 0 370.585 4.016 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)C1 ZINC000461794422 1111359059 /nfs/dbraw/zinc/35/90/59/1111359059.db2.gz ASMVNZHYWUBHBM-QGZVFWFLSA-N 2 0 358.476 4.050 20 0 FIADRP CCC1(C[NH2+]Cc2ncc(COC)s2)CC[NH+](Cc2ccccc2)CC1 ZINC000538969401 1111363529 /nfs/dbraw/zinc/36/35/29/1111363529.db2.gz OTXUSHKQZQSLPP-UHFFFAOYSA-N 2 0 373.566 4.072 20 0 FIADRP Cc1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1F ZINC000539369143 1111532443 /nfs/dbraw/zinc/53/24/43/1111532443.db2.gz CHFZISYVUZZLBY-FQEVSTJZSA-N 2 0 354.469 4.212 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCNc1ccccc1)c1ccccc1O2 ZINC000539400942 1111550956 /nfs/dbraw/zinc/55/09/56/1111550956.db2.gz VJNPULLZSKAXTF-NRFANRHFSA-N 2 0 365.521 4.066 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(Br)s3)CCC2)[C@@H](C)C1 ZINC000552089862 1111570878 /nfs/dbraw/zinc/57/08/78/1111570878.db2.gz XPEAXGPLEBLKSU-KBPBESRZSA-N 2 0 371.388 4.252 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4ccccc4)s3)C2)CC1 ZINC000552092410 1111572897 /nfs/dbraw/zinc/57/28/97/1111572897.db2.gz SRPJMXGPMDKRRR-HXUWFJFHSA-N 2 0 369.578 4.015 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)[C@@H](C)C1 ZINC000477855764 1111579460 /nfs/dbraw/zinc/57/94/60/1111579460.db2.gz IUSUUQNLMCZSAM-BLLLJJGKSA-N 2 0 354.325 4.337 20 0 FIADRP Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000477855902 1111579476 /nfs/dbraw/zinc/57/94/76/1111579476.db2.gz IYFKCRQBFJHJKH-UHFFFAOYSA-N 2 0 372.601 4.200 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477857907 1111580124 /nfs/dbraw/zinc/58/01/24/1111580124.db2.gz RRLPBZKXROPFHE-WIYYLYMNSA-N 2 0 360.542 4.160 20 0 FIADRP COc1cc(OC)c([C@@H](C)NCC(C)(C)C[NH+]2CCCC2)cc1Cl ZINC000477936154 1111607076 /nfs/dbraw/zinc/60/70/76/1111607076.db2.gz KVNXZCJHOVYBNJ-CQSZACIVSA-N 2 0 354.922 4.130 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000552281684 1111658851 /nfs/dbraw/zinc/65/88/51/1111658851.db2.gz GLMOTNNRPVZVEJ-OQIJWPOYSA-N 2 0 354.460 4.465 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc(Br)cc2)CC1 ZINC000479295511 1111987678 /nfs/dbraw/zinc/98/76/78/1111987678.db2.gz LGJLDXZCBAADEO-OAHLLOKOSA-N 2 0 353.348 4.092 20 0 FIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479332418 1111994298 /nfs/dbraw/zinc/99/42/98/1111994298.db2.gz SZJXLXUQIMQNIN-UGKGYDQZSA-N 2 0 366.553 4.351 20 0 FIADRP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc(Br)ccc21 ZINC000479335859 1111999275 /nfs/dbraw/zinc/99/92/75/1111999275.db2.gz MWSWXZBFGCJHSM-MPGHIAIKSA-N 2 0 363.343 4.388 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3c(cc(C)cc3C)[nH]2)[C@@H](C)C1 ZINC000479396182 1112012088 /nfs/dbraw/zinc/01/20/88/1112012088.db2.gz PBFROJQNLJEMFB-RXVVDRJESA-N 2 0 357.542 4.011 20 0 FIADRP Brc1ccc2c(c1)CCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000479436744 1112022085 /nfs/dbraw/zinc/02/20/85/1112022085.db2.gz JEBDTZKLCPQWBQ-LJQANCHMSA-N 2 0 363.343 4.291 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000479466316 1112041802 /nfs/dbraw/zinc/04/18/02/1112041802.db2.gz RLQLWBDPXIQRPN-YLJYHZDGSA-N 2 0 356.510 4.474 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000479491491 1112044582 /nfs/dbraw/zinc/04/45/82/1112044582.db2.gz SMFYNUATDXAAAA-KSFYIVLOSA-N 2 0 356.485 4.494 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)[C@H](C)C1 ZINC000479525680 1112052424 /nfs/dbraw/zinc/05/24/24/1112052424.db2.gz IFIZLZVYNVTENJ-XPGWFJOJSA-N 2 0 350.934 4.054 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1F ZINC000479550385 1112066197 /nfs/dbraw/zinc/06/61/97/1112066197.db2.gz CGSUOECHLFZJNV-XSNSTOHYSA-N 2 0 360.517 4.467 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000553875976 1112118125 /nfs/dbraw/zinc/11/81/25/1112118125.db2.gz HPGXWOFIGSWRBY-PKOBYXMFSA-N 2 0 358.555 4.195 20 0 FIADRP O=C(NCCCCC[NH+]1CCCCC1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000553908401 1112127189 /nfs/dbraw/zinc/12/71/89/1112127189.db2.gz YKBDWBVPGYJQFQ-UHFFFAOYSA-N 2 0 371.569 4.059 20 0 FIADRP CCN(CC[NH+]1CCCCCC1)C(=O)c1ccc(C[N@H+](CC)C2CC2)cc1 ZINC000554148709 1112214707 /nfs/dbraw/zinc/21/47/07/1112214707.db2.gz SASDFNFWWNKVNF-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000480022872 1112235322 /nfs/dbraw/zinc/23/53/22/1112235322.db2.gz VZMOFSKHZKPDOL-AQNXPRMDSA-N 2 0 352.522 4.455 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cc(F)ccc2C)CC1 ZINC000480025838 1112243958 /nfs/dbraw/zinc/24/39/58/1112243958.db2.gz YNNWEWPOUWXTBD-QGZVFWFLSA-N 2 0 373.491 4.266 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480162782 1112310319 /nfs/dbraw/zinc/31/03/19/1112310319.db2.gz LMDPIMNAQIMNDZ-SFHVURJKSA-N 2 0 371.550 4.272 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CCCC2)[C@H](C)C1 ZINC000480190268 1112327640 /nfs/dbraw/zinc/32/76/40/1112327640.db2.gz AIROJJASDNFEBX-IFMALSPDSA-N 2 0 358.570 4.225 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000480212269 1112333484 /nfs/dbraw/zinc/33/34/84/1112333484.db2.gz FZZPHGWCKHZKED-AUSIDOKSSA-N 2 0 374.532 4.028 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)CCCC(F)(F)F)CC1 ZINC000480235433 1112344115 /nfs/dbraw/zinc/34/41/15/1112344115.db2.gz XMPSEAXBNLQHDJ-KRWDZBQOSA-N 2 0 371.491 4.035 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(Cl)cn3)CC2)cc1 ZINC000480257198 1112347825 /nfs/dbraw/zinc/34/78/25/1112347825.db2.gz ZFTNKTAEWNRYON-MRXNPFEDSA-N 2 0 373.928 4.306 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)c(F)c1 ZINC000658355122 1112454073 /nfs/dbraw/zinc/45/40/73/1112454073.db2.gz HJUUZQKPPQHVOQ-QFIPXVFZSA-N 2 0 371.475 4.161 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)c1cccc(-c2ccccc2)c1)N1CC[NH+](C)CC1 ZINC000480534671 1112464596 /nfs/dbraw/zinc/46/45/96/1112464596.db2.gz DSEGDZOGYACDCQ-YKSBVNFPSA-N 2 0 365.565 4.276 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2ccncc2OCC[NH+](C)C)cc1 ZINC000554740717 1112466943 /nfs/dbraw/zinc/46/69/43/1112466943.db2.gz HIOPAIAPDLXLPB-SFHVURJKSA-N 2 0 355.526 4.071 20 0 FIADRP CC(C)C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000480539686 1112467385 /nfs/dbraw/zinc/46/73/85/1112467385.db2.gz VWOTVKOKIJBNBZ-HXUWFJFHSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480623131 1112514970 /nfs/dbraw/zinc/51/49/70/1112514970.db2.gz HTYCBQARDDGFRR-IAGOWNOFSA-N 2 0 357.542 4.222 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cnn1-c1ccc(F)cc1 ZINC000480643852 1112518512 /nfs/dbraw/zinc/51/85/12/1112518512.db2.gz SYHKYGRDOOUQCB-MSOLQXFVSA-N 2 0 372.532 4.483 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(N(C)C(C)C)nc2)cc1 ZINC000480639177 1112526200 /nfs/dbraw/zinc/52/62/00/1112526200.db2.gz LREXFHDSXXSVIT-UHFFFAOYSA-N 2 0 354.542 4.058 20 0 FIADRP COc1cccc(CCC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccc(C)s3)C2)c1 ZINC000554852106 1112530080 /nfs/dbraw/zinc/53/00/80/1112530080.db2.gz RWEWZDVUXZRVCI-FQEVSTJZSA-N 2 0 372.578 4.452 20 0 FIADRP Cc1ccncc1CCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000554858680 1112533354 /nfs/dbraw/zinc/53/33/54/1112533354.db2.gz UDBLIZNJJBUCAE-RPWUZVMVSA-N 2 0 363.549 4.309 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNCc2nccn2-c2ccccc2)C1 ZINC000480665509 1112544177 /nfs/dbraw/zinc/54/41/77/1112544177.db2.gz XVIVOPKMOXPATM-FQEVSTJZSA-N 2 0 374.532 4.394 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480710636 1112564963 /nfs/dbraw/zinc/56/49/63/1112564963.db2.gz PHRUIMJWQCUJBI-VAPSRWTKSA-N 3 0 369.597 4.140 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480710630 1112565270 /nfs/dbraw/zinc/56/52/70/1112565270.db2.gz PHRUIMJWQCUJBI-DWQJTFDBSA-N 3 0 369.597 4.140 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000480728359 1112573947 /nfs/dbraw/zinc/57/39/47/1112573947.db2.gz KRGGOCKJZXIALT-SFHVURJKSA-N 2 0 368.521 4.288 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480763948 1112592566 /nfs/dbraw/zinc/59/25/66/1112592566.db2.gz WYYFHPOWPHGXCY-FQEVSTJZSA-N 2 0 351.966 4.044 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC000481241245 1112823136 /nfs/dbraw/zinc/82/31/36/1112823136.db2.gz JZRKZDHLFZPZDN-KXBFYZLASA-N 2 0 373.368 4.263 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc(C(C)C)nc2C)CC1 ZINC000555418479 1112825153 /nfs/dbraw/zinc/82/51/53/1112825153.db2.gz ULELOOPRXOYXDT-UHFFFAOYSA-N 2 0 361.574 4.084 20 0 FIADRP Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000481261158 1112835613 /nfs/dbraw/zinc/83/56/13/1112835613.db2.gz URCDIFXYUBQXPU-JOCHJYFZSA-N 2 0 366.553 4.019 20 0 FIADRP C[C@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cccc(Br)c21 ZINC000481308825 1112883239 /nfs/dbraw/zinc/88/32/39/1112883239.db2.gz GNNWPALDWSHHQY-UGSOOPFHSA-N 2 0 363.343 4.461 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cccc(Br)c21 ZINC000481308814 1112883588 /nfs/dbraw/zinc/88/35/88/1112883588.db2.gz GNNWPALDWSHHQY-FZKQIMNGSA-N 2 0 363.343 4.461 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000481344306 1112909143 /nfs/dbraw/zinc/90/91/43/1112909143.db2.gz WNTGEQMXZMQUGM-PZJWPPBQSA-N 2 0 360.517 4.325 20 0 FIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CC/C=C/c3ccc(Br)cc3)C2)C1 ZINC000555597416 1112941411 /nfs/dbraw/zinc/94/14/11/1112941411.db2.gz HGBFDRYFPFRVPH-XUYKHGSPSA-N 2 0 363.343 4.270 20 0 FIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CC/C=C\c3ccc(Br)cc3)C2)C1 ZINC000555597413 1112941606 /nfs/dbraw/zinc/94/16/06/1112941606.db2.gz HGBFDRYFPFRVPH-QDVBSOPMSA-N 2 0 363.343 4.270 20 0 FIADRP FC1(F)CCC(Cc2ccccn2)([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168366031 1112979085 /nfs/dbraw/zinc/97/90/85/1112979085.db2.gz IUHHUZSFBKCTJM-UHFFFAOYSA-N 2 0 363.496 4.036 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCCOc4ccccc43)CC2)c1 ZINC000481731676 1113059236 /nfs/dbraw/zinc/05/92/36/1113059236.db2.gz WASKFBJFWHRHLM-FQEVSTJZSA-N 2 0 356.535 4.464 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc2c(c1)COC2 ZINC000481719450 1113059962 /nfs/dbraw/zinc/05/99/62/1113059962.db2.gz CHTPNGIUOHYMOC-MRXNPFEDSA-N 2 0 356.535 4.341 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H](c3cccnc3)C3CCC3)CC2)c1 ZINC000481917403 1113131750 /nfs/dbraw/zinc/13/17/50/1113131750.db2.gz FYYSWJGEAGPJHP-OAQYLSRUSA-N 2 0 355.551 4.486 20 0 FIADRP CC1(C)CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc21 ZINC000481996047 1113151533 /nfs/dbraw/zinc/15/15/33/1113151533.db2.gz ZOLANJMSVSNUCR-NZQKXSOJSA-N 2 0 364.533 4.156 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000482117624 1113174364 /nfs/dbraw/zinc/17/43/64/1113174364.db2.gz AIJLJPXTNFNWGG-SIKLNZKXSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000482114009 1113177775 /nfs/dbraw/zinc/17/77/75/1113177775.db2.gz KITSBNQTEOSRLW-MRXNPFEDSA-N 2 0 369.484 4.141 20 0 FIADRP Cc1ccc2c(CC[NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)c[nH]c2c1 ZINC000482139558 1113179830 /nfs/dbraw/zinc/17/98/30/1113179830.db2.gz USVZFTDCVBTUTR-SFHVURJKSA-N 2 0 365.521 4.310 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc4c(c3)CCCO4)cc2)CC[N@@H+]1C ZINC000482121602 1113181780 /nfs/dbraw/zinc/18/17/80/1113181780.db2.gz DCSBZUIGEAFHPB-HTAPYJJXSA-N 2 0 350.506 4.251 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(OC)c1 ZINC000482434944 1113253591 /nfs/dbraw/zinc/25/35/91/1113253591.db2.gz HGGDXCWGMARFSB-NFBKMPQASA-N 2 0 352.522 4.301 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CCC2 ZINC000482442953 1113257978 /nfs/dbraw/zinc/25/79/78/1113257978.db2.gz ZYHSOWFROUIPPV-YKSBVNFPSA-N 2 0 364.533 4.227 20 0 FIADRP CC(C)CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482548243 1113291327 /nfs/dbraw/zinc/29/13/27/1113291327.db2.gz FDUFLAOHEQHQRV-FXAWDEMLSA-N 2 0 351.966 4.043 20 0 FIADRP CC(C)CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482626456 1113313656 /nfs/dbraw/zinc/31/36/56/1113313656.db2.gz CNQOSGVGVROUBA-PXNSSMCTSA-N 2 0 351.966 4.043 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cccc(-c2ccccc2)c1 ZINC000482883673 1113392003 /nfs/dbraw/zinc/39/20/03/1113392003.db2.gz AJDHXUOMHUKMDX-XXBNENTESA-N 2 0 352.522 4.241 20 0 FIADRP CCC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000483213087 1113466664 /nfs/dbraw/zinc/46/66/64/1113466664.db2.gz LKXBVYLXBUKBHA-UZLBHIALSA-N 2 0 350.934 4.272 20 0 FIADRP C[N@@H+](Cc1ccc(OCC2CC2)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000483312962 1113485165 /nfs/dbraw/zinc/48/51/65/1113485165.db2.gz UFCDMABMUDNMIJ-UHFFFAOYSA-N 2 0 365.521 4.219 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000486521726 1113590367 /nfs/dbraw/zinc/59/03/67/1113590367.db2.gz XAIMUVYCQQSQBA-PXNSSMCTSA-N 2 0 370.562 4.417 20 0 FIADRP [NH3+]CCC1CC[NH+](Cc2coc(-c3cc(Cl)cc(Cl)c3)n2)CC1 ZINC000629545902 1113607019 /nfs/dbraw/zinc/60/70/19/1113607019.db2.gz DCHXHSFKRZPOSO-UHFFFAOYSA-N 2 0 354.281 4.209 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000668713663 1113680849 /nfs/dbraw/zinc/68/08/49/1113680849.db2.gz XAIXGMZKMHSPEF-UGKGYDQZSA-N 2 0 364.533 4.215 20 0 FIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)c1 ZINC000488045258 1113846250 /nfs/dbraw/zinc/84/62/50/1113846250.db2.gz ILBQSSFGQOFPKJ-YPAWHYETSA-N 2 0 354.538 4.110 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000488071765 1113850440 /nfs/dbraw/zinc/85/04/40/1113850440.db2.gz HOZCOSPXFATLIQ-YPAWHYETSA-N 2 0 354.538 4.110 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2cncc(OCc3ccccc3)c2)CC1 ZINC000488161071 1113865467 /nfs/dbraw/zinc/86/54/67/1113865467.db2.gz KLPRLJIQAUPCBF-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)cc1 ZINC000488422972 1113925648 /nfs/dbraw/zinc/92/56/48/1113925648.db2.gz AMALYJZDOHFKID-PKOBYXMFSA-N 2 0 350.572 4.027 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)c(OC)c2)C1 ZINC000151136043 1114299853 /nfs/dbraw/zinc/29/98/53/1114299853.db2.gz MCZIQFHHLPOOFH-KBPBESRZSA-N 2 0 358.498 4.392 20 0 FIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@@H](N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000490988138 1114359463 /nfs/dbraw/zinc/35/94/63/1114359463.db2.gz OOAFNTGYNCUZIE-WOIUINJBSA-N 2 0 357.586 4.003 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)cc1 ZINC000491033681 1114364236 /nfs/dbraw/zinc/36/42/36/1114364236.db2.gz FQPKDIXYJZSQPM-JOCHJYFZSA-N 2 0 372.940 4.032 20 0 FIADRP OCC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000491056976 1114368307 /nfs/dbraw/zinc/36/83/07/1114368307.db2.gz VQSKMUKYWWGRHI-RUZDIDTESA-N 2 0 374.528 4.223 20 0 FIADRP CSCc1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000586783258 1114392772 /nfs/dbraw/zinc/39/27/72/1114392772.db2.gz REPDHMRSNZVHOY-UHFFFAOYSA-N 2 0 370.562 4.314 20 0 FIADRP C[C@H](c1cccc(Cl)c1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000588710347 1114602095 /nfs/dbraw/zinc/60/20/95/1114602095.db2.gz KFYJXOZIPMGACW-BRWVUGGUSA-N 2 0 350.934 4.222 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2OC(F)F)C[C@H]1C ZINC000572211983 1114622129 /nfs/dbraw/zinc/62/21/29/1114622129.db2.gz NXBDIZQVHVJWNY-DEYMUQAISA-N 2 0 352.469 4.496 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2OC(F)F)C[C@@H]1C ZINC000572211985 1114622330 /nfs/dbraw/zinc/62/23/30/1114622330.db2.gz NXBDIZQVHVJWNY-QUJHGWJTSA-N 2 0 352.469 4.496 20 0 FIADRP C[C@@H](c1cccc(Br)c1)[N@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168394757 1114849344 /nfs/dbraw/zinc/84/93/44/1114849344.db2.gz GEPNVTCWMNQUHU-AWEZNQCLSA-N 2 0 351.332 4.316 20 0 FIADRP c1ccc2ncc(CC3CC[NH+](C4CC[NH+](CC5CC5)CC4)CC3)cc2c1 ZINC001168397135 1114876998 /nfs/dbraw/zinc/87/69/98/1114876998.db2.gz LXLFSDKCMKSJKU-UHFFFAOYSA-N 2 0 363.549 4.364 20 0 FIADRP FC(F)(F)c1cnc2c(c1)[C@H]([NH2+]CCCCC[NH+]1CCCC1)CCC2 ZINC000572946014 1114943187 /nfs/dbraw/zinc/94/31/87/1114943187.db2.gz UTLRSUFQZFLGPV-QGZVFWFLSA-N 2 0 355.448 4.334 20 0 FIADRP CC(C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590787205 1114974070 /nfs/dbraw/zinc/97/40/70/1114974070.db2.gz UUDUHDBKHIWQKK-GOSISDBHSA-N 2 0 359.558 4.189 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC000591712225 1115126291 /nfs/dbraw/zinc/12/62/91/1115126291.db2.gz MUEMVOIKAQMQAB-GOSISDBHSA-N 2 0 356.485 4.194 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4ccsc4)cc3)C2)CC1 ZINC000573527668 1115135327 /nfs/dbraw/zinc/13/53/27/1115135327.db2.gz GVBHGBBPCHIGLO-JOCHJYFZSA-N 2 0 369.578 4.015 20 0 FIADRP COc1ccccc1-c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000573726733 1115177990 /nfs/dbraw/zinc/17/79/90/1115177990.db2.gz YDSUKKOCVQRDIV-WCRBZPEASA-N 2 0 350.506 4.419 20 0 FIADRP Cc1ccncc1CCC[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000573725761 1115178034 /nfs/dbraw/zinc/17/80/34/1115178034.db2.gz NTLFNMQDYLDYCM-IFMALSPDSA-N 2 0 351.538 4.213 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168402428 1115321780 /nfs/dbraw/zinc/32/17/80/1115321780.db2.gz ZIQKPVDPHUIVSK-HSZRJFAPSA-N 2 0 352.497 4.185 20 0 FIADRP Cn1cncc1CCC[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000574999382 1115529211 /nfs/dbraw/zinc/52/92/11/1115529211.db2.gz BYRZMAVVWXCKHT-OAQYLSRUSA-N 2 0 355.432 4.205 20 0 FIADRP Cc1noc(C2CCC([NH2+]Cc3ccccc3C[NH+]3CCCCC3)CC2)n1 ZINC000575012763 1115532988 /nfs/dbraw/zinc/53/29/88/1115532988.db2.gz ZBPGENDMQCXVTN-UHFFFAOYSA-N 2 0 368.525 4.180 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(C(=O)OC)c(Cl)c2)c1 ZINC000597046339 1115637704 /nfs/dbraw/zinc/63/77/04/1115637704.db2.gz HNOSGZKWDNOUPZ-UHFFFAOYSA-N 2 0 374.912 4.258 20 0 FIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@H](c2ccccc2)[NH+](CC)CC)CC1 ZINC000597225866 1115651045 /nfs/dbraw/zinc/65/10/45/1115651045.db2.gz MFVWZUREPPECDX-QFIPXVFZSA-N 2 0 373.585 4.040 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+]CCC(=O)Nc2cc(Cl)cc(Cl)c2)CC1 ZINC000646273620 1115664799 /nfs/dbraw/zinc/66/47/99/1115664799.db2.gz CNCCTCMEJWZMJP-UHFFFAOYSA-N 2 0 372.340 4.175 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc3c2CCOC3)CC1)CC(C)C ZINC001168414337 1115771263 /nfs/dbraw/zinc/77/12/63/1115771263.db2.gz PBTILZZAMPDIOX-UHFFFAOYSA-N 2 0 358.570 4.339 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)C1 ZINC000062426974 1115925913 /nfs/dbraw/zinc/92/59/13/1115925913.db2.gz ZEQMQWLVVRHJTM-LJQANCHMSA-N 2 0 356.485 4.225 20 0 FIADRP CC[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1F ZINC000606467404 1115946456 /nfs/dbraw/zinc/94/64/56/1115946456.db2.gz IEBNXNXFXUWATR-OAQYLSRUSA-N 2 0 362.464 4.189 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000606470826 1115948428 /nfs/dbraw/zinc/94/84/28/1115948428.db2.gz YDSZUUDRBPPFQQ-JTHBVZDNSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000608061240 1116079855 /nfs/dbraw/zinc/07/98/55/1116079855.db2.gz IEUXEKXMUUMRBI-UGKGYDQZSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)Cc1cccs1 ZINC000608062597 1116080235 /nfs/dbraw/zinc/08/02/35/1116080235.db2.gz WUNKCBLQMDLZME-SFHVURJKSA-N 2 0 358.551 4.191 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000534237182 1116174080 /nfs/dbraw/zinc/17/40/80/1116174080.db2.gz LLWWDGMOSIUZQT-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000534793792 1116237535 /nfs/dbraw/zinc/23/75/35/1116237535.db2.gz PRHPDXBFRUDQNU-BZNIZROVSA-N 2 0 357.723 4.021 20 0 FIADRP Fc1ccccc1-c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)o1 ZINC000539822463 1116385825 /nfs/dbraw/zinc/38/58/25/1116385825.db2.gz FAPXCYROPZNUJJ-UHFFFAOYSA-N 2 0 372.484 4.163 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC000539832753 1116388459 /nfs/dbraw/zinc/38/84/59/1116388459.db2.gz YFPLXVAKSOKPHW-UHFFFAOYSA-N 2 0 362.901 4.143 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000462797799 1117768713 /nfs/dbraw/zinc/76/87/13/1117768713.db2.gz GRXNTSIVVBFFKW-GOSISDBHSA-N 2 0 354.542 4.437 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CC2=Cc3ccccc3OC2)CC1)CC1CC1 ZINC000539958046 1117776121 /nfs/dbraw/zinc/77/61/21/1117776121.db2.gz CGHMZZQRBDZYJC-UHFFFAOYSA-N 2 0 354.538 4.296 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC2CC(O)C2)c2ccc(F)cc2)CC1 ZINC000462805534 1117787878 /nfs/dbraw/zinc/78/78/78/1117787878.db2.gz FHPJSDXVTPKRNM-FQUBMZHMSA-N 2 0 362.533 4.130 20 0 FIADRP Cc1nc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)cs1 ZINC000462876318 1117834478 /nfs/dbraw/zinc/83/44/78/1117834478.db2.gz DHTRXBCEYOPZMR-SFHVURJKSA-N 2 0 372.582 4.013 20 0 FIADRP COc1cccc(CCC[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000540043574 1117838228 /nfs/dbraw/zinc/83/82/28/1117838228.db2.gz DDENTKAXJGYNKF-UHFFFAOYSA-N 2 0 367.537 4.261 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC000462903494 1117849974 /nfs/dbraw/zinc/84/99/74/1117849974.db2.gz ALORXNWDSNNTTB-DEOSSOPVSA-N 2 0 364.533 4.201 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccccc2-c2cnn(C)c2)CC1 ZINC000540148664 1117899706 /nfs/dbraw/zinc/89/97/06/1117899706.db2.gz YDJFOBHQQLVSEE-MBSDFSHPSA-N 2 0 366.553 4.220 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](c3ccccc3)[C@@H]3CCOC3)CC2)C1 ZINC000540137168 1117900953 /nfs/dbraw/zinc/90/09/53/1117900953.db2.gz MJODXAQUWYHMDD-WENLIBGGSA-N 2 0 356.554 4.397 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2cc(Cl)ccc2Br)CC1 ZINC000540155285 1117909244 /nfs/dbraw/zinc/90/92/44/1117909244.db2.gz JGGPYOXFXWRWKF-UHFFFAOYSA-N 2 0 373.766 4.498 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000540170950 1117912335 /nfs/dbraw/zinc/91/23/35/1117912335.db2.gz NGLJQSCSCOHKIM-XHSDSOJGSA-N 2 0 374.447 4.125 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)C[C@@H](C)O1 ZINC000540171647 1117913301 /nfs/dbraw/zinc/91/33/01/1117913301.db2.gz UOGGBEZLSQYOSU-GPMSIDNRSA-N 2 0 366.933 4.033 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nnc(-c3ccccc3)o2)CC1)CC(C)C ZINC000540197464 1117938269 /nfs/dbraw/zinc/93/82/69/1117938269.db2.gz QOVDNTYDIWQWJJ-UHFFFAOYSA-N 2 0 370.541 4.317 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000463072314 1117956664 /nfs/dbraw/zinc/95/66/64/1117956664.db2.gz POGHFMDFERNOKB-UHFFFAOYSA-N 2 0 368.569 4.465 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C2CCN(CCc3ccccc3)CC2)cc1 ZINC000463106913 1117967457 /nfs/dbraw/zinc/96/74/57/1117967457.db2.gz BSMMNISVBZKMKQ-FQEVSTJZSA-N 2 0 366.549 4.313 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+](C)C)cc1 ZINC000463120471 1117979021 /nfs/dbraw/zinc/97/90/21/1117979021.db2.gz VYRKYIMYTZSIKZ-ZTCOLXNVSA-N 2 0 365.565 4.240 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C(C)C)cc1 ZINC000540321241 1117983161 /nfs/dbraw/zinc/98/31/61/1117983161.db2.gz RECLOJVZBOYDDB-NFBKMPQASA-N 2 0 358.570 4.427 20 0 FIADRP CC1CC[NH+](CCC[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000463140399 1117987249 /nfs/dbraw/zinc/98/72/49/1117987249.db2.gz GZMDPZUZWYDYRC-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cccc(OCc2ccccn2)c1 ZINC000540354097 1117998020 /nfs/dbraw/zinc/99/80/20/1117998020.db2.gz LETHXBGDORHPLX-GHTZIAJQSA-N 2 0 353.510 4.186 20 0 FIADRP CC[C@@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)Oc1ccccc1C(F)(F)F ZINC000540361130 1118014045 /nfs/dbraw/zinc/01/40/45/1118014045.db2.gz SVKGIGLYWAUGPA-KRWDZBQOSA-N 2 0 370.459 4.327 20 0 FIADRP COC[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)c(F)c1 ZINC000540395178 1118029523 /nfs/dbraw/zinc/02/95/23/1118029523.db2.gz PZZPUGVNEJIJEN-NGICGMGXSA-N 2 0 366.496 4.285 20 0 FIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCC4CCOCC4)CC[C@@H]32)cc1 ZINC000463293165 1118077129 /nfs/dbraw/zinc/07/71/29/1118077129.db2.gz DVKSUPSKBMTOBP-PKTZIBPZSA-N 2 0 356.554 4.180 20 0 FIADRP Cc1ccc(CC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540501755 1118103689 /nfs/dbraw/zinc/10/36/89/1118103689.db2.gz SELNPTZBEIIAEO-NRFANRHFSA-N 2 0 350.506 4.115 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)CC2(COc3cccc(COC)c3)CCC2)CC1 ZINC000540555550 1118127162 /nfs/dbraw/zinc/12/71/62/1118127162.db2.gz LDPCMRBSHZSZPK-UHFFFAOYSA-N 2 0 374.569 4.188 20 0 FIADRP CCc1ncc(C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)s1 ZINC000540627059 1118158196 /nfs/dbraw/zinc/15/81/96/1118158196.db2.gz AYUXCMFNQADTAU-UHFFFAOYSA-N 2 0 357.567 4.488 20 0 FIADRP CCC1(C[NH2+]Cc2cc(OC)cc(C)n2)CC[NH+](Cc2ccccc2)CC1 ZINC000540769468 1118235336 /nfs/dbraw/zinc/23/53/36/1118235336.db2.gz NQPVAUAQBRHKNY-UHFFFAOYSA-N 2 0 367.537 4.181 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)cc1F ZINC000540989948 1118339955 /nfs/dbraw/zinc/33/99/55/1118339955.db2.gz ALMLWZRMPZHMAE-QFBILLFUSA-N 2 0 356.913 4.003 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000540990147 1118341320 /nfs/dbraw/zinc/34/13/20/1118341320.db2.gz DOHYCVOUZAJYIY-YADARESESA-N 2 0 366.549 4.447 20 0 FIADRP CC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000540992656 1118341986 /nfs/dbraw/zinc/34/19/86/1118341986.db2.gz YKFAZUAXIMTTOE-SVMVAKDDSA-N 2 0 365.521 4.206 20 0 FIADRP CC(C)OCCN1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000507830630 1118347991 /nfs/dbraw/zinc/34/79/91/1118347991.db2.gz MOCVMXHGWCPCCX-LJQANCHMSA-N 2 0 371.352 4.460 20 0 FIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000541156168 1118404252 /nfs/dbraw/zinc/40/42/52/1118404252.db2.gz VQPDGJGNFJMHDZ-DYESRHJHSA-N 2 0 363.977 4.187 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000541379105 1118494424 /nfs/dbraw/zinc/49/44/24/1118494424.db2.gz XINZIEKZMYUYNN-IBGZPJMESA-N 2 0 368.868 4.233 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc2cccnc12 ZINC000541537941 1118546272 /nfs/dbraw/zinc/54/62/72/1118546272.db2.gz WHVBHSABSOICLU-OAQYLSRUSA-N 2 0 359.517 4.497 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541666473 1118596901 /nfs/dbraw/zinc/59/69/01/1118596901.db2.gz BKSUWRVPWGEFRB-HXUWFJFHSA-N 2 0 365.565 4.250 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000541738762 1118627434 /nfs/dbraw/zinc/62/74/34/1118627434.db2.gz OYIGZMXYUSVTNM-MBPVOVBZSA-N 2 0 369.578 4.445 20 0 FIADRP CSc1ccc(OCC[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000464846977 1118719990 /nfs/dbraw/zinc/71/99/90/1118719990.db2.gz KQOIMBOJSCMWCS-HXUWFJFHSA-N 2 0 370.562 4.241 20 0 FIADRP C[C@@H]([NH2+]CCCOc1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492371745 1119080761 /nfs/dbraw/zinc/08/07/61/1119080761.db2.gz DQPRDTFOJCZCMD-UYAOXDASSA-N 2 0 356.485 4.095 20 0 FIADRP COc1cccc(CCC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000492469442 1119099669 /nfs/dbraw/zinc/09/96/69/1119099669.db2.gz XZSDOSLPIREMJS-SIKLNZKXSA-N 2 0 352.522 4.128 20 0 FIADRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000311072871 1119356689 /nfs/dbraw/zinc/35/66/89/1119356689.db2.gz KLIAHLOXIYVSHG-LPHOPBHVSA-N 2 0 358.913 4.349 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1cccc(OCc2ccccc2)c1 ZINC000311523621 1119378316 /nfs/dbraw/zinc/37/83/16/1119378316.db2.gz PVANYEVAEPVTDF-DNVFCKCGSA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311633981 1119382756 /nfs/dbraw/zinc/38/27/56/1119382756.db2.gz JRNBNYBUULODQP-CNNODRBYSA-N 2 0 352.522 4.126 20 0 FIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)c1cccc(OC)c1 ZINC000542464526 1119384531 /nfs/dbraw/zinc/38/45/31/1119384531.db2.gz ZOBGVRKOZSROQK-KRWDZBQOSA-N 2 0 350.466 4.167 20 0 FIADRP Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000178439849 1119390896 /nfs/dbraw/zinc/39/08/96/1119390896.db2.gz ANSFIOFGRPHYPO-QGZVFWFLSA-N 2 0 354.542 4.344 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311863741 1119392489 /nfs/dbraw/zinc/39/24/89/1119392489.db2.gz VOPDMBSJSLOOHB-ILWGZMRPSA-N 2 0 356.554 4.369 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000493945732 1119513905 /nfs/dbraw/zinc/51/39/05/1119513905.db2.gz TZXPHCBTTXTHRW-CVDCTZTESA-N 2 0 352.522 4.059 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)c1 ZINC000186592769 1119738336 /nfs/dbraw/zinc/73/83/36/1119738336.db2.gz KHLHHNLTALJHOO-UHFFFAOYSA-N 2 0 358.448 4.085 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000186593067 1119738462 /nfs/dbraw/zinc/73/84/62/1119738462.db2.gz PBXOSGNHDFVXHG-ZWKOTPCHSA-N 2 0 365.521 4.263 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000186888833 1119755600 /nfs/dbraw/zinc/75/56/00/1119755600.db2.gz WEUVFZBKQFFHQC-UHFFFAOYSA-N 2 0 365.521 4.065 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc(Br)c1OC ZINC000187088440 1119765703 /nfs/dbraw/zinc/76/57/03/1119765703.db2.gz BMOQKZSXPOOPOV-CQSZACIVSA-N 2 0 357.336 4.058 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(Cl)c1 ZINC000187602268 1119791294 /nfs/dbraw/zinc/79/12/94/1119791294.db2.gz RXUYAMAOCHVSKR-QGZVFWFLSA-N 2 0 372.940 4.190 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467368337 1119946967 /nfs/dbraw/zinc/94/69/67/1119946967.db2.gz GNRZHZCZJQDGBY-ZCNNSNEGSA-N 2 0 354.542 4.281 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)cn1 ZINC000190906392 1119953486 /nfs/dbraw/zinc/95/34/86/1119953486.db2.gz UKYCECYVQXABIK-UHFFFAOYSA-N 2 0 366.553 4.204 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc(Br)o3)CC2)CC1 ZINC000191470911 1119978711 /nfs/dbraw/zinc/97/87/11/1119978711.db2.gz ZHEGNOVLMAZEEN-UHFFFAOYSA-N 2 0 355.320 4.175 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3sccc3Cl)cc2)C[C@H](C)O1 ZINC000192994873 1120093861 /nfs/dbraw/zinc/09/38/61/1120093861.db2.gz QXIRDQYTPJOIAN-GASCZTMLSA-N 2 0 364.942 4.301 20 0 FIADRP CN1CCC[C@H](C[NH2+]CCCc2ccc3c(c2)CCO3)[C@@H]1c1cccs1 ZINC000193297985 1120125766 /nfs/dbraw/zinc/12/57/66/1120125766.db2.gz MPTCGDYRKNHFTC-DENIHFKCSA-N 2 0 370.562 4.288 20 0 FIADRP COC[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000193957246 1120219491 /nfs/dbraw/zinc/21/94/91/1120219491.db2.gz XPJZTXRZJXUSPX-OAQYLSRUSA-N 2 0 358.913 4.413 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000495017134 1120424551 /nfs/dbraw/zinc/42/45/51/1120424551.db2.gz LPCIRUUPNDZUKV-IAGOWNOFSA-N 2 0 354.485 4.493 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000495005691 1120426120 /nfs/dbraw/zinc/42/61/20/1120426120.db2.gz PCTWYNUAXLZEOC-IAGOWNOFSA-N 2 0 354.485 4.493 20 0 FIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000670153972 1120709733 /nfs/dbraw/zinc/70/97/33/1120709733.db2.gz SFLCCHJPFFMXGP-LNLFQRSKSA-N 2 0 363.343 4.433 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000495415652 1120792374 /nfs/dbraw/zinc/79/23/74/1120792374.db2.gz SCQIBWVTUMQCPE-LEOXJPRUSA-N 2 0 374.544 4.488 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000495438854 1120824291 /nfs/dbraw/zinc/82/42/91/1120824291.db2.gz JDVARZFWOKBHOZ-ATZDWAIDSA-N 2 0 355.551 4.329 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cc1F ZINC000495543879 1120875943 /nfs/dbraw/zinc/87/59/43/1120875943.db2.gz BKEWPDIDDQOFEH-BBWFWOEESA-N 2 0 374.475 4.425 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cc(Br)ncc1F ZINC000762729462 1120956106 /nfs/dbraw/zinc/95/61/06/1120956106.db2.gz KGWWMSVQXMUUJO-CHWSQXEVSA-N 2 0 360.315 4.144 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000236808157 1120970005 /nfs/dbraw/zinc/97/00/05/1120970005.db2.gz OTOBEXODIIHCRA-NRFANRHFSA-N 2 0 368.521 4.096 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000236930927 1120971765 /nfs/dbraw/zinc/97/17/65/1120971765.db2.gz NPDJVTBTIAUEJG-NRFANRHFSA-N 2 0 368.521 4.096 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cccc(C)c2)CC1 ZINC000236985581 1120972316 /nfs/dbraw/zinc/97/23/16/1120972316.db2.gz UNHGPENMSDVHKK-SFHVURJKSA-N 2 0 355.501 4.127 20 0 FIADRP c1cn(-c2ccc(-c3noc([C@H]4CC[C@H](c5ccccc5)[NH2+]C4)n3)cc2)cn1 ZINC001212207290 1120979511 /nfs/dbraw/zinc/97/95/11/1120979511.db2.gz FTTIOBNPPCVPDR-AZUAARDMSA-N 2 0 371.444 4.131 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1C ZINC000237621613 1120980504 /nfs/dbraw/zinc/98/05/04/1120980504.db2.gz IPJAOJXEUIELNR-PMACEKPBSA-N 2 0 352.522 4.202 20 0 FIADRP Fc1cc(F)cc(Oc2ccc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)cc2)c1 ZINC000237811430 1120984658 /nfs/dbraw/zinc/98/46/58/1120984658.db2.gz BQQMCRYERQIQCU-INIZCTEOSA-N 2 0 358.432 4.331 20 0 FIADRP Cc1c(C[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)sc2nc(C)nc(C)c12 ZINC000915678476 1121019213 /nfs/dbraw/zinc/01/92/13/1121019213.db2.gz NRVOKYYLPLVFLE-ZIAGYGMSSA-N 2 0 360.571 4.074 20 0 FIADRP CCc1cc(C[NH+]2CCC3(CC2)CC[NH+](Cc2ccccc2)CC3)on1 ZINC001203227395 1121033420 /nfs/dbraw/zinc/03/34/20/1121033420.db2.gz YQMROAGBYHBGBU-UHFFFAOYSA-N 2 0 353.510 4.115 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2CC(F)(F)F)[C@@H](C)C1 ZINC000624307315 1121152722 /nfs/dbraw/zinc/15/27/22/1121152722.db2.gz GXOQQTMDQNXYKJ-QFBILLFUSA-N 2 0 372.475 4.018 20 0 FIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397705143 1121289617 /nfs/dbraw/zinc/28/96/17/1121289617.db2.gz WWSPKZRQRZXAJZ-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1OC(F)F ZINC000397998021 1121331615 /nfs/dbraw/zinc/33/16/15/1121331615.db2.gz UKFHSTLNTUHOGH-QFBILLFUSA-N 2 0 360.448 4.288 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(OC)c(OC)c1 ZINC000123929256 1121646200 /nfs/dbraw/zinc/64/62/00/1121646200.db2.gz JLHCKDRXYHQIGS-FQEVSTJZSA-N 2 0 356.510 4.396 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000123945372 1121648184 /nfs/dbraw/zinc/64/81/84/1121648184.db2.gz USLHCEJUDKOFSP-GOSISDBHSA-N 2 0 362.521 4.483 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000063917715 1121727834 /nfs/dbraw/zinc/72/78/34/1121727834.db2.gz KJZUCRSCQBQQHS-OAQYLSRUSA-N 2 0 368.521 4.096 20 0 FIADRP CCCC[N@H+](C)CC1CCN([C@H](C)c2nc(-c3cccs3)no2)CC1 ZINC000066960580 1121762435 /nfs/dbraw/zinc/76/24/35/1121762435.db2.gz YZCHPXJBEMXDSY-OAHLLOKOSA-N 2 0 362.543 4.303 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1F ZINC000125463514 1121781576 /nfs/dbraw/zinc/78/15/76/1121781576.db2.gz MTURSZWTBZKMJP-HNNXBMFYSA-N 2 0 362.514 4.459 20 0 FIADRP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OCc2nccn2C)cc1 ZINC000125894665 1121862650 /nfs/dbraw/zinc/86/26/50/1121862650.db2.gz JXZSWGRMBAHIIS-PXNSSMCTSA-N 2 0 372.557 4.016 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)NC(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000073012462 1121914830 /nfs/dbraw/zinc/91/48/30/1121914830.db2.gz SMQFQJILBLXJGB-QGZVFWFLSA-N 2 0 354.498 4.066 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126663512 1121973365 /nfs/dbraw/zinc/97/33/65/1121973365.db2.gz UTYHKTQBOOAEJV-QVKFZJNVSA-N 2 0 371.475 4.055 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)c(F)c2)cc1 ZINC000917008857 1121995072 /nfs/dbraw/zinc/99/50/72/1121995072.db2.gz SXGUFALSCXEEIA-OPAMFIHVSA-N 2 0 374.475 4.162 20 0 FIADRP CC(C)C[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000127409370 1122091226 /nfs/dbraw/zinc/09/12/26/1122091226.db2.gz ISXCCJJQYQGGIC-VQIMIIECSA-N 2 0 371.491 4.018 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000066960582 1122115984 /nfs/dbraw/zinc/11/59/84/1122115984.db2.gz SDNCKNQZXBLIDG-LJQANCHMSA-N 2 0 359.558 4.074 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]C3CCN(c4ccccc4)CC3)CC2)CC1 ZINC000090775401 1122131511 /nfs/dbraw/zinc/13/15/11/1122131511.db2.gz IFVXZRWTBFUPBP-UHFFFAOYSA-N 2 0 355.570 4.288 20 0 FIADRP Clc1ccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)s2)cc1 ZINC000060979559 1122151890 /nfs/dbraw/zinc/15/18/90/1122151890.db2.gz YSQJGTMRLMSQHL-UHFFFAOYSA-N 2 0 364.942 4.271 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([N@H+](C3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168623449 1122179344 /nfs/dbraw/zinc/17/93/44/1122179344.db2.gz IUXGZRCWBYXNPQ-XHRGMSINSA-N 2 0 372.553 4.430 20 0 FIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cccc(-c2ccccc2)c1 ZINC000128242656 1122208774 /nfs/dbraw/zinc/20/87/74/1122208774.db2.gz YTYWJMIRTFZWOB-FQEVSTJZSA-N 2 0 351.538 4.032 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](c1cc2ccccc2o1)C(C)(C)C)N1CC[NH+](C)CC1 ZINC000497833594 1122429833 /nfs/dbraw/zinc/42/98/33/1122429833.db2.gz WHCJECCXGDAWKR-SIKLNZKXSA-N 2 0 371.569 4.382 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497855075 1122441261 /nfs/dbraw/zinc/44/12/61/1122441261.db2.gz WLJXMVSTBGCJPI-NRFANRHFSA-N 2 0 357.542 4.136 20 0 FIADRP CC(C)Oc1ccccc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000128984033 1122484117 /nfs/dbraw/zinc/48/41/17/1122484117.db2.gz FTUOYDPZXMLKAH-GOSISDBHSA-N 2 0 356.510 4.265 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCc3sc(Br)cc32)cc1 ZINC000556052075 1122624831 /nfs/dbraw/zinc/62/48/31/1122624831.db2.gz BPXBVYYSRJTTSS-HNNXBMFYSA-N 2 0 365.340 4.349 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(F)c2ccccc21 ZINC000556119354 1122670535 /nfs/dbraw/zinc/67/05/35/1122670535.db2.gz WIQLWPSMTDZINN-ITEAAPOESA-N 2 0 356.485 4.007 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)s2)C[C@H](C)O1 ZINC000069833380 1122690373 /nfs/dbraw/zinc/69/03/73/1122690373.db2.gz KCPGUUBYAZTRNO-GJZGRUSLSA-N 2 0 364.942 4.301 20 0 FIADRP Cc1cc(F)ccc1[C@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000763430829 1122744952 /nfs/dbraw/zinc/74/49/52/1122744952.db2.gz FMMUPHAUSXCQPG-PGRDOPGGSA-N 2 0 362.533 4.144 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(Br)cc2Cl)CC[N@@H+]1C ZINC000556228696 1122745426 /nfs/dbraw/zinc/74/54/26/1122745426.db2.gz DJEOUPBNTXESJZ-GXTWGEPZSA-N 2 0 373.766 4.452 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556228613 1122745488 /nfs/dbraw/zinc/74/54/88/1122745488.db2.gz ASYFKCKQUKBQFH-FCEUIQTBSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1ccccc1C[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556429637 1122887074 /nfs/dbraw/zinc/88/70/74/1122887074.db2.gz DSHNEPXRZWFJPO-IBGZPJMESA-N 2 0 352.522 4.189 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CC(c4ccc(F)cc4)C3)cc2)CC1 ZINC000556608336 1122997379 /nfs/dbraw/zinc/99/73/79/1122997379.db2.gz LCJMRHLTYZQCOG-UHFFFAOYSA-N 2 0 368.496 4.335 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000131299263 1123030641 /nfs/dbraw/zinc/03/06/41/1123030641.db2.gz AKXAZFMJQLVPDF-SFHVURJKSA-N 2 0 365.993 4.405 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556889553 1123176360 /nfs/dbraw/zinc/17/63/60/1123176360.db2.gz JHGPPIBXELTJMA-QRFRQXIXSA-N 2 0 374.569 4.186 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)cc1 ZINC000132501547 1123273842 /nfs/dbraw/zinc/27/38/42/1123273842.db2.gz XCHKSSNQEXYBCN-NQIIRXRSSA-N 2 0 363.615 4.110 20 0 FIADRP Cc1cccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499140339 1123281157 /nfs/dbraw/zinc/28/11/57/1123281157.db2.gz VJDVBKHZMUUVTQ-KOUNCHBCSA-N 2 0 350.506 4.159 20 0 FIADRP Cc1ccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499151776 1123294636 /nfs/dbraw/zinc/29/46/36/1123294636.db2.gz ZBMILAWXCJPVER-DKUWSORSSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@@H]1CCC[C@H](C)[N@H+]1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499152532 1123294903 /nfs/dbraw/zinc/29/49/03/1123294903.db2.gz OWMDJYOIAWOYHL-QOXZHXANSA-N 2 0 355.570 4.035 20 0 FIADRP C[NH+](C)CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000499217778 1123333656 /nfs/dbraw/zinc/33/36/56/1123333656.db2.gz WONJHVRJFMLZTB-CIAFKFPVSA-N 3 0 357.586 4.138 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc(C)c1F ZINC000132828547 1123366000 /nfs/dbraw/zinc/36/60/00/1123366000.db2.gz WGFXYOAVLRGDIN-GOSISDBHSA-N 2 0 370.512 4.250 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000133077355 1123409905 /nfs/dbraw/zinc/40/99/05/1123409905.db2.gz LOYKIIHRVJELOR-QGZVFWFLSA-N 2 0 355.448 4.189 20 0 FIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000077417656 1123677291 /nfs/dbraw/zinc/67/72/91/1123677291.db2.gz JTHUNWWJLJOGTR-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP CC(C)N(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(C)C ZINC000615316370 1123989198 /nfs/dbraw/zinc/98/91/98/1123989198.db2.gz RQGABZBZJNXPRF-WOJBJXKFSA-N 2 0 373.585 4.185 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC2(CCC([NH+](C)C)CC2)CC1 ZINC000615444623 1124011602 /nfs/dbraw/zinc/01/16/02/1124011602.db2.gz AGGUONAIRYTEJP-UHFFFAOYSA-N 2 0 365.606 4.002 20 0 FIADRP C[C@H](c1nc2ccccc2o1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000245565020 1124121763 /nfs/dbraw/zinc/12/17/63/1124121763.db2.gz ZKDBSLCCIPEGMP-KZNAEPCWSA-N 2 0 371.525 4.100 20 0 FIADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245655393 1124170534 /nfs/dbraw/zinc/17/05/34/1124170534.db2.gz DIPBLBRGIQDEHT-ZQGJOIPISA-N 2 0 356.554 4.223 20 0 FIADRP COc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245696490 1124205184 /nfs/dbraw/zinc/20/51/84/1124205184.db2.gz LCEOMNXUZIISCA-KOUNCHBCSA-N 2 0 350.506 4.023 20 0 FIADRP C[NH+](C)[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245765562 1124244631 /nfs/dbraw/zinc/24/46/31/1124244631.db2.gz WHPKHKIYVVWLNO-KIHHCIJBSA-N 2 0 363.549 4.075 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1 ZINC000245925767 1124285540 /nfs/dbraw/zinc/28/55/40/1124285540.db2.gz SLAXXOGLLONPIA-JWOSDPRPSA-N 2 0 351.494 4.179 20 0 FIADRP CN1CC[C@@H]([NH2+]CCCOCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000518575426 1124369755 /nfs/dbraw/zinc/36/97/55/1124369755.db2.gz WCZLWLYQOHCVPH-PKTZIBPZSA-N 2 0 352.522 4.061 20 0 FIADRP COc1ccc([C@H](OC)[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000542840766 1124437700 /nfs/dbraw/zinc/43/77/00/1124437700.db2.gz PIWJPHKMLLIZHU-HTAPYJJXSA-N 2 0 360.542 4.158 20 0 FIADRP CSC[C@H]([NH2+]C1CCN(C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000542848862 1124449969 /nfs/dbraw/zinc/44/99/69/1124449969.db2.gz HWWRBNAFAIEQAQ-KRWDZBQOSA-N 2 0 358.473 4.326 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc2ccccc21 ZINC000246364153 1124469875 /nfs/dbraw/zinc/46/98/75/1124469875.db2.gz ITQAJCZDAJYIBS-PDIWNELESA-N 2 0 352.522 4.258 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000246927895 1124574245 /nfs/dbraw/zinc/57/42/45/1124574245.db2.gz GYHYKHRJQRIEBO-YOEHRIQHSA-N 2 0 359.514 4.258 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000246927881 1124574433 /nfs/dbraw/zinc/57/44/33/1124574433.db2.gz GYHYKHRJQRIEBO-PBHICJAKSA-N 2 0 359.514 4.258 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1)c1ccc(Cl)s1 ZINC000247103695 1124590307 /nfs/dbraw/zinc/59/03/07/1124590307.db2.gz QCJWAKZEUMPQDT-HUUCEWRRSA-N 2 0 364.942 4.473 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2COCc2ccccc2)[C@@H](C)C1 ZINC000247210205 1124599061 /nfs/dbraw/zinc/59/90/61/1124599061.db2.gz WWLOOGLMVXMHPQ-CVDCTZTESA-N 2 0 352.522 4.223 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1 ZINC000248455240 1124773067 /nfs/dbraw/zinc/77/30/67/1124773067.db2.gz RJMUXLXBZKWONB-VXKWHMMOSA-N 2 0 356.485 4.023 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]13)C2 ZINC001168683861 1124800947 /nfs/dbraw/zinc/80/09/47/1124800947.db2.gz APMNAHDMRXGOHS-LUBSMZHTSA-N 2 0 366.936 4.307 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](C2CC2)[C@@H]2CCCCO2)CC1 ZINC000655789026 1124810494 /nfs/dbraw/zinc/81/04/94/1124810494.db2.gz UAHNCFXQECIKCQ-YFXJRYMSSA-N 2 0 356.554 4.019 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000090027656 1124976249 /nfs/dbraw/zinc/97/62/49/1124976249.db2.gz CTDQBOLRKVJKIQ-SFHVURJKSA-N 2 0 368.521 4.409 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCCc3nc4ccccc4n3C)CC2)C1 ZINC000090050962 1124979166 /nfs/dbraw/zinc/97/91/66/1124979166.db2.gz XPRAXXFPNWDNRM-UYAOXDASSA-N 2 0 368.569 4.139 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000090937246 1125027613 /nfs/dbraw/zinc/02/76/13/1125027613.db2.gz ONILSZMXMYGOLS-ZDUSSCGKSA-N 2 0 368.308 4.180 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285094 1125061725 /nfs/dbraw/zinc/06/17/25/1125061725.db2.gz UMNSKCCKPYBTPY-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C(C)C)cc1 ZINC000091287594 1125063535 /nfs/dbraw/zinc/06/35/35/1125063535.db2.gz NRIDZXGDGNRFQB-JOCHJYFZSA-N 2 0 356.510 4.123 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1nc2ccccc2n1C ZINC000091313424 1125064888 /nfs/dbraw/zinc/06/48/88/1125064888.db2.gz SRGYLDCKJZMGQK-MRXNPFEDSA-N 2 0 368.550 4.198 20 0 FIADRP COCCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000092739417 1125240410 /nfs/dbraw/zinc/24/04/10/1125240410.db2.gz YCHFQNXGYDPEEW-BBWFWOEESA-N 2 0 367.603 4.049 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(OC)cc2)ccc1OC ZINC000182185453 1125275519 /nfs/dbraw/zinc/27/55/19/1125275519.db2.gz JXXGZYZBIPINIH-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP C[C@H](C[NH2+][C@H](c1cccc(Cl)c1)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000543012755 1125325779 /nfs/dbraw/zinc/32/57/79/1125325779.db2.gz VSYVRFANODRYEX-UTKZUKDTSA-N 2 0 363.977 4.187 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)cc1C[NH+]1CCCCC1 ZINC000182353387 1125424359 /nfs/dbraw/zinc/42/43/59/1125424359.db2.gz WXJWWCSEDCXJFL-GOSISDBHSA-N 2 0 363.505 4.404 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000093597712 1125452660 /nfs/dbraw/zinc/45/26/60/1125452660.db2.gz GMSRMPVBPVOLGV-HXUWFJFHSA-N 2 0 350.506 4.280 20 0 FIADRP C[NH+](C)CCC[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000097137166 222163826 /nfs/dbraw/zinc/16/38/26/222163826.db2.gz JRCQZEDDFFRJDJ-UHFFFAOYSA-N 2 0 353.329 4.219 20 0 FIADRP c1ccc(C[NH+]2CCC([C@H]3CCCCC[N@@H+]3Cc3cnccn3)CC2)cc1 ZINC000563117493 568220502 /nfs/dbraw/zinc/22/05/02/568220502.db2.gz YQSREXDQUOIXJO-HSZRJFAPSA-N 2 0 364.537 4.133 20 0 FIADRP CN(C)[C@H](C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)c1ccsc1 ZINC000563119845 568224597 /nfs/dbraw/zinc/22/45/97/568224597.db2.gz JPUMPQLUMXKNFC-LEWJYISDSA-N 2 0 369.578 4.138 20 0 FIADRP c1cn(Cc2ccccc2)c2cc[nH+]c(N3CC[NH+](C4CCCC4)CC3)c12 ZINC001165028078 721857072 /nfs/dbraw/zinc/85/70/72/721857072.db2.gz JAHJTTWBTMCBND-UHFFFAOYSA-N 2 0 360.505 4.149 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000415020306 1089046772 /nfs/dbraw/zinc/04/67/72/1089046772.db2.gz WZMTXXXTBCDCNB-SNVBAGLBSA-N 2 0 353.226 4.075 20 0 FIADRP CC(=O)Nc1ccccc1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000093844590 1125533703 /nfs/dbraw/zinc/53/37/03/1125533703.db2.gz HTAIBSPYJDSYLC-GOSISDBHSA-N 2 0 357.542 4.122 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c(F)c1 ZINC001648786151 1079618288 /nfs/dbraw/zinc/61/82/88/1079618288.db2.gz SKFAOJJNPKNYLF-QZTJIDSGSA-N 2 0 356.485 4.033 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)NC2CC[NH+](C(C)C)CC2)ccc1OC ZINC000183165789 1125767464 /nfs/dbraw/zinc/76/74/64/1125767464.db2.gz GHZVLOPIECHRPZ-SFHVURJKSA-N 2 0 361.574 4.060 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(N2CCCC2=O)cc1 ZINC000183183883 1125772993 /nfs/dbraw/zinc/77/29/93/1125772993.db2.gz XRRHNJVJAGZDGM-CMKODMSKSA-N 2 0 369.553 4.117 20 0 FIADRP CC[N@H+](C[C@@H](C[NH+](C)Cc1ccccc1)c1ccccc1)C[C@H]1CCOC1 ZINC001167063835 1079897646 /nfs/dbraw/zinc/89/76/46/1079897646.db2.gz VBPGXGIKWPGCJQ-ISKFKSNPSA-N 2 0 366.549 4.261 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC001625795725 1079911472 /nfs/dbraw/zinc/91/14/72/1079911472.db2.gz BBEBEFSKODCHGY-WOJBJXKFSA-N 2 0 373.585 4.016 20 0 FIADRP Cc1ccc(-c2n[nH]cc2CNC2CC[NH+](CC3CCCCC3)CC2)o1 ZINC000065981986 1079974583 /nfs/dbraw/zinc/97/45/83/1079974583.db2.gz YZYHVEWNLRZKOY-UHFFFAOYSA-N 2 0 356.514 4.112 20 0 FIADRP Brc1ccccc1[C@H]([NH2+]CCCn1ccnc1)c1ccccc1 ZINC000179963887 1080389103 /nfs/dbraw/zinc/38/91/03/1080389103.db2.gz SECZXUMDRMQPIK-LJQANCHMSA-N 2 0 370.294 4.415 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)CC3 ZINC000180713699 1080539192 /nfs/dbraw/zinc/53/91/92/1080539192.db2.gz VFYDSIMIBVLJMM-GOSISDBHSA-N 2 0 351.538 4.330 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cnc2cc(C)nn2c1C ZINC000120452739 1080925954 /nfs/dbraw/zinc/92/59/54/1080925954.db2.gz OURIALDMYAUWDZ-KRWDZBQOSA-N 2 0 365.525 4.039 20 0 FIADRP COCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000547831420 1080945754 /nfs/dbraw/zinc/94/57/54/1080945754.db2.gz KDTAILFZXDEQTB-UNMCSNQZSA-N 2 0 358.570 4.474 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OCc1ccccc1 ZINC000530674097 1080978934 /nfs/dbraw/zinc/97/89/34/1080978934.db2.gz RDLMYCHASRIKSU-LEWJYISDSA-N 2 0 368.521 4.237 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000302962416 1081013527 /nfs/dbraw/zinc/01/35/27/1081013527.db2.gz QLBLYWKBYRKAKT-UHFFFAOYSA-N 2 0 362.521 4.236 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2CCCn3ccnc32)cc1 ZINC000655687754 1081115248 /nfs/dbraw/zinc/11/52/48/1081115248.db2.gz YXOQFIKLHWVZAV-QFIPXVFZSA-N 2 0 360.505 4.236 20 0 FIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+]C2CCN(C[C@H]3CCCO3)CC2)cc1 ZINC000655696356 1081122693 /nfs/dbraw/zinc/12/26/93/1081122693.db2.gz GCBSVWHTDPHOGB-WMZHIEFXSA-N 2 0 374.569 4.028 20 0 FIADRP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001648811053 1081124580 /nfs/dbraw/zinc/12/45/80/1081124580.db2.gz CXMJBWJLPGNQKY-RTBURBONSA-N 2 0 356.558 4.465 20 0 FIADRP Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000655719417 1081138378 /nfs/dbraw/zinc/13/83/78/1081138378.db2.gz SSOLZSGTNWGYOQ-QHCPKHFHSA-N 2 0 364.533 4.037 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000655745312 1081165236 /nfs/dbraw/zinc/16/52/36/1081165236.db2.gz LOVPWDGVOWJESO-AUSIDOKSSA-N 2 0 371.569 4.116 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H](C2CC2)[C@H]2CCCCO2)C3)cc1 ZINC000655788839 1081201533 /nfs/dbraw/zinc/20/15/33/1081201533.db2.gz PYZDMZDNWMKKNY-PFDCGNQRSA-N 2 0 354.538 4.119 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccccc2Br)C1 ZINC000655804942 1081211353 /nfs/dbraw/zinc/21/13/53/1081211353.db2.gz GSEQMYRXVVXQDP-VPWXQRGCSA-N 2 0 373.338 4.468 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]C[C@@H]2CCCC(C)(C)C2)CC1 ZINC001648814396 1081218853 /nfs/dbraw/zinc/21/88/53/1081218853.db2.gz KZOVUGQOCKETBS-HXUWFJFHSA-N 2 0 357.586 4.130 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)C1 ZINC000655826979 1081231701 /nfs/dbraw/zinc/23/17/01/1081231701.db2.gz KWVZFOCDESZBEM-AKAXFMLLSA-N 2 0 352.400 4.395 20 0 FIADRP COc1cccc(COc2ccc(C[NH2+]C[C@@H](C)C[NH+]3CCCC3)cc2)c1 ZINC001648832901 1081272392 /nfs/dbraw/zinc/27/23/92/1081272392.db2.gz RNCLNUQAYHLPOV-LJQANCHMSA-N 2 0 368.521 4.096 20 0 FIADRP Fc1cccc(COc2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cc2)c1 ZINC000683706122 1081414186 /nfs/dbraw/zinc/41/41/86/1081414186.db2.gz CHXNQUHVXAEQQJ-UHFFFAOYSA-N 2 0 368.496 4.369 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2CC[NH+](C)C)cc1)C(C)C ZINC000275682002 1081435209 /nfs/dbraw/zinc/43/52/09/1081435209.db2.gz QERGIUABKGNXSI-UHFFFAOYSA-N 2 0 367.537 4.273 20 0 FIADRP CCCN(CCC[NH+]1CCCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001167333767 1081456708 /nfs/dbraw/zinc/45/67/08/1081456708.db2.gz ZNIFFRJYZLRHKT-QHCPKHFHSA-N 2 0 357.586 4.239 20 0 FIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cccc5cccnc54)C[C@H]3C2)cc1 ZINC000312614215 1081459450 /nfs/dbraw/zinc/45/94/50/1081459450.db2.gz GEBXRVCSAWITEM-FYYLOGMGSA-N 2 0 357.501 4.189 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(C(F)(F)F)cc1C ZINC000466902208 1081486855 /nfs/dbraw/zinc/48/68/55/1081486855.db2.gz FNCWZBDWHXPTAW-UHFFFAOYSA-N 2 0 360.383 4.193 20 0 FIADRP Fc1ccc(C2(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)CCOCC2)cc1 ZINC000152042182 1081530749 /nfs/dbraw/zinc/53/07/49/1081530749.db2.gz XQGCPPBEOUWKPW-UHFFFAOYSA-N 2 0 374.544 4.261 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000580226548 1081764702 /nfs/dbraw/zinc/76/47/02/1081764702.db2.gz JLYXNLJFMKAMHM-AUSIDOKSSA-N 2 0 367.537 4.228 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000564432370 1082035235 /nfs/dbraw/zinc/03/52/35/1082035235.db2.gz DKGKGMCGESYLHW-QGZVFWFLSA-N 2 0 350.572 4.344 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000471611343 1082093016 /nfs/dbraw/zinc/09/30/16/1082093016.db2.gz PPQLEUZMJRRHCA-BHDDXSALSA-N 2 0 356.554 4.038 20 0 FIADRP CCC[C@@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471611261 1082093667 /nfs/dbraw/zinc/09/36/67/1082093667.db2.gz BRPNZCZRWSLEDF-DNVCBOLYSA-N 2 0 372.384 4.450 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312974728 1082109257 /nfs/dbraw/zinc/10/92/57/1082109257.db2.gz KSVRTPXZODJCHA-SPEDKVCISA-N 2 0 365.521 4.206 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000471619847 1082161469 /nfs/dbraw/zinc/16/14/69/1082161469.db2.gz ODXDOEAOIUQDOX-ZWKOTPCHSA-N 2 0 357.567 4.092 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@H]([NH3+])c2ccccc2)cc1 ZINC000580890670 1082207794 /nfs/dbraw/zinc/20/77/94/1082207794.db2.gz OWAHVXDELALJSZ-AVRDEDQJSA-N 2 0 365.521 4.480 20 0 FIADRP FC(F)(F)[C@H]1C[C@H]([NH2+]C2CCN(C3CC3)CC2)C[C@@H](C(F)(F)F)C1 ZINC000656472381 1082455208 /nfs/dbraw/zinc/45/52/08/1082455208.db2.gz DRLJOPOHKOBQHX-PJXYFTJBSA-N 2 0 358.370 4.112 20 0 FIADRP CN(c1ccccc1C[N@H+](C)CCc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000510435189 1082692411 /nfs/dbraw/zinc/69/24/11/1082692411.db2.gz JIMXUSJJLLDYGY-UHFFFAOYSA-N 2 0 369.528 4.031 20 0 FIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000656683160 1082713531 /nfs/dbraw/zinc/71/35/31/1082713531.db2.gz ILHLDSWJOBRLOJ-NRFANRHFSA-N 2 0 355.913 4.224 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1F ZINC000656684024 1082717936 /nfs/dbraw/zinc/71/79/36/1082717936.db2.gz SAQCJIVYCSSKDF-OAQYLSRUSA-N 2 0 359.464 4.313 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000684394901 1082828210 /nfs/dbraw/zinc/82/82/10/1082828210.db2.gz OAHLTNVATQNGQA-KMDXXIMOSA-N 2 0 363.549 4.213 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccccc2OC(F)F)CC1 ZINC000471764510 1082961286 /nfs/dbraw/zinc/96/12/86/1082961286.db2.gz YHJOXLNJVLOMIF-APWZRJJASA-N 2 0 366.496 4.463 20 0 FIADRP C[C@H](c1cccc(O)c1)[NH+](C)C/C=C/C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000247411169 1082993519 /nfs/dbraw/zinc/99/35/19/1082993519.db2.gz CIQQRCAGPRWCLO-PJHKVULZSA-N 2 0 354.494 4.340 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccccc1F ZINC000090971317 1083096549 /nfs/dbraw/zinc/09/65/49/1083096549.db2.gz LYTFMNRTAHMUTC-SFHVURJKSA-N 2 0 367.512 4.209 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccsc1 ZINC000090971345 1083097603 /nfs/dbraw/zinc/09/76/03/1083097603.db2.gz CZSFSUZDGCPAKR-QGZVFWFLSA-N 2 0 355.551 4.131 20 0 FIADRP CCCOc1c(Cl)cc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1OCC ZINC000430919952 1083235985 /nfs/dbraw/zinc/23/59/85/1083235985.db2.gz SIDJOKNIIGDDOW-UHFFFAOYSA-N 2 0 366.933 4.103 20 0 FIADRP C[C@H](NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cn2ccccc2n1 ZINC000658317935 1083404586 /nfs/dbraw/zinc/40/45/86/1083404586.db2.gz NZKLWAFMQJTBKB-PZJWPPBQSA-N 2 0 374.532 4.287 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000658320217 1083406498 /nfs/dbraw/zinc/40/64/98/1083406498.db2.gz RUZDZRMPUAYGLH-UGKGYDQZSA-N 2 0 366.553 4.417 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(CO)c1 ZINC000658320349 1083407962 /nfs/dbraw/zinc/40/79/62/1083407962.db2.gz SPAGBBHRCUASOG-AUSIDOKSSA-N 2 0 364.533 4.132 20 0 FIADRP COc1cc(OC)c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000658356110 1083425440 /nfs/dbraw/zinc/42/54/40/1083425440.db2.gz HGNWYCOEEVROKS-AWEZNQCLSA-N 2 0 366.933 4.130 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1sccc1Br ZINC000658354343 1083426213 /nfs/dbraw/zinc/42/62/13/1083426213.db2.gz CGYFMRUGUOLHLW-LBPRGKRZSA-N 2 0 357.361 4.283 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000510973760 1083542259 /nfs/dbraw/zinc/54/22/59/1083542259.db2.gz AUDUBFGAENQOQK-BTYIYWSLSA-N 2 0 372.484 4.113 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3Cl)C2)[C@H](C)C1 ZINC000510979879 1083555584 /nfs/dbraw/zinc/55/55/84/1083555584.db2.gz FSHYRVLFJBIYCQ-XFYJMZHFSA-N 2 0 364.961 4.313 20 0 FIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000510980635 1083556867 /nfs/dbraw/zinc/55/68/67/1083556867.db2.gz YMVBCEVJQZTXKJ-BPXKWBHBSA-N 2 0 368.496 4.322 20 0 FIADRP c1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2nc4ccccc4o2)CC3)cc1 ZINC000535680609 1083565275 /nfs/dbraw/zinc/56/52/75/1083565275.db2.gz ONJUJSWWQUJFIE-UHFFFAOYSA-N 2 0 361.489 4.316 20 0 FIADRP CCOc1cccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1OC(F)F ZINC000535811426 1083681357 /nfs/dbraw/zinc/68/13/57/1083681357.db2.gz ZZJGDDZGYFJKLP-UHFFFAOYSA-N 2 0 370.484 4.239 20 0 FIADRP Cc1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1Oc1cccnc1 ZINC000535806063 1083692197 /nfs/dbraw/zinc/69/21/97/1083692197.db2.gz CFXDUBRQECAMSL-CTNGQTDRSA-N 2 0 351.494 4.098 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2F)s1 ZINC000535809889 1083697575 /nfs/dbraw/zinc/69/75/75/1083697575.db2.gz OCLLZWBGWZWIFE-YSGRDPCXSA-N 2 0 374.525 4.238 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)ccn1 ZINC000569913181 1083766769 /nfs/dbraw/zinc/76/67/69/1083766769.db2.gz ZVGAGVIGLZOQGU-GOSISDBHSA-N 2 0 353.510 4.173 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000511003163 1084099714 /nfs/dbraw/zinc/09/97/14/1084099714.db2.gz VETZXPSGJUPPRW-YCRPNKLZSA-N 2 0 372.484 4.113 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)cc2c1C ZINC000472035050 1084127435 /nfs/dbraw/zinc/12/74/35/1084127435.db2.gz LXSGDQNFNTWZJL-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP Cc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(-c2cnn(C)c2)c1 ZINC000548980576 1084297891 /nfs/dbraw/zinc/29/78/91/1084297891.db2.gz GRJZJKLAPJAUGY-NRFANRHFSA-N 2 0 374.532 4.007 20 0 FIADRP CCc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000531142066 1084354893 /nfs/dbraw/zinc/35/48/93/1084354893.db2.gz JMBLJKFDHDJHCU-UHFFFAOYSA-N 2 0 372.578 4.471 20 0 FIADRP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000466923086 1084367979 /nfs/dbraw/zinc/36/79/79/1084367979.db2.gz IKAVAZVUWPHOMA-IBGZPJMESA-N 2 0 352.522 4.478 20 0 FIADRP CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523641 1084452765 /nfs/dbraw/zinc/45/27/65/1084452765.db2.gz OMTYIDWRVXRFNI-MSOLQXFVSA-N 2 0 359.558 4.191 20 0 FIADRP COc1ccc(C[NH+](C)C)cc1N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582029663 1084483839 /nfs/dbraw/zinc/48/38/39/1084483839.db2.gz GDWWGUANAKGSNB-WIYYLYMNSA-N 2 0 367.537 4.079 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC2(CC1)c1ccccc1NC2=O ZINC000157892892 1084576782 /nfs/dbraw/zinc/57/67/82/1084576782.db2.gz ZQQLGNKAAFSLQA-HGCBZUSOSA-N 2 0 369.553 4.063 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(F)c2OC(F)F)c1 ZINC000657348480 1084682178 /nfs/dbraw/zinc/68/21/78/1084682178.db2.gz XOZVWBMNRYFHTI-UHFFFAOYSA-N 2 0 352.400 4.169 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cccc(Br)c21 ZINC000414145981 1084698384 /nfs/dbraw/zinc/69/83/84/1084698384.db2.gz BNWMMFITUWBTSY-SJCJKPOMSA-N 2 0 356.267 4.435 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000414150499 1084706280 /nfs/dbraw/zinc/70/62/80/1084706280.db2.gz PETFNXVAJOSVFH-SFHVURJKSA-N 2 0 368.521 4.327 20 0 FIADRP Brc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414189123 1084773556 /nfs/dbraw/zinc/77/35/56/1084773556.db2.gz RAUYVRPLQPWLHB-KRWDZBQOSA-N 2 0 372.266 4.100 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2cccc(Cl)c2)CC1 ZINC000613491020 1084820334 /nfs/dbraw/zinc/82/03/34/1084820334.db2.gz ADYQGGJVENDHBM-UHFFFAOYSA-N 2 0 365.949 4.113 20 0 FIADRP O[C@@H](C[C@@H]1CCCCC[N@@H+]1CCC[NH+]1CCCCC1)c1cccs1 ZINC000161401103 1085002317 /nfs/dbraw/zinc/00/23/17/1085002317.db2.gz KUFUJPWLNSLKDW-OALUTQOASA-N 2 0 350.572 4.292 20 0 FIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC000472231011 1085135706 /nfs/dbraw/zinc/13/57/06/1085135706.db2.gz IBQDRRUBWOQRKF-HXUWFJFHSA-N 2 0 352.522 4.272 20 0 FIADRP Fc1cncc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000684955557 1085300562 /nfs/dbraw/zinc/30/05/62/1085300562.db2.gz QABUXRGNORKVOL-AVRDEDQJSA-N 2 0 353.485 4.174 20 0 FIADRP c1cncc(-c2cccc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)c2)c1 ZINC000657613262 1085691256 /nfs/dbraw/zinc/69/12/56/1085691256.db2.gz JWPFVAOUPVOJEF-UHFFFAOYSA-N 2 0 372.516 4.145 20 0 FIADRP FCC[C@H]1CCC[NH+](Cc2cncc(C[N@H+]3CCC[C@H](CCF)C3)c2)C1 ZINC000661690260 1085732437 /nfs/dbraw/zinc/73/24/37/1085732437.db2.gz OYJSBZIPJNDEGO-RTBURBONSA-N 2 0 365.512 4.225 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](c2cccnc2)C2CCCCC2)C[C@@H](C)O1 ZINC000652166533 1085733878 /nfs/dbraw/zinc/73/38/78/1085733878.db2.gz VHTBRZOWHUVUGX-KNKQGSTJSA-N 2 0 359.558 4.182 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](C2CC2)C2CCOCC2)CC1 ZINC000652247430 1085776135 /nfs/dbraw/zinc/77/61/35/1085776135.db2.gz KSDXSWCJOHLWFH-VNXZQDSDSA-N 2 0 356.554 4.224 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]C2CC[NH+](C3CCCC3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000537941081 1085850551 /nfs/dbraw/zinc/85/05/51/1085850551.db2.gz HJCRVUZFTUVCEF-RBBKRZOGSA-N 3 0 369.597 4.284 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)cc1 ZINC000120583446 1085852302 /nfs/dbraw/zinc/85/23/02/1085852302.db2.gz KLLOGDSRIUZRQV-KRWDZBQOSA-N 2 0 353.510 4.338 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H](C)C[C@@H]2CCCN2C(=O)OC(C)(C)C)CC1 ZINC000236761779 1085942144 /nfs/dbraw/zinc/94/21/44/1085942144.db2.gz QCRJWRGIEKQWPV-MJGOQNOKSA-N 2 0 367.578 4.019 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000468913363 1085943235 /nfs/dbraw/zinc/94/32/35/1085943235.db2.gz LHFDEBXTABYMNW-NRFANRHFSA-N 2 0 363.977 4.189 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2=CC[N@H+](C)CC2)C(C)C)c(Br)c1 ZINC000582993971 1086005652 /nfs/dbraw/zinc/00/56/52/1086005652.db2.gz CWFSHDPEIKTHGS-GOSISDBHSA-N 2 0 367.331 4.006 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000245970004 1086119985 /nfs/dbraw/zinc/11/99/85/1086119985.db2.gz FMBIVKPLOCUJJF-IBGZPJMESA-N 2 0 370.368 4.062 20 0 FIADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000583063419 1086131758 /nfs/dbraw/zinc/13/17/58/1086131758.db2.gz SQKIQLDLPRJDCW-DENIHFKCSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@](O)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000248880239 1086178049 /nfs/dbraw/zinc/17/80/49/1086178049.db2.gz KLYRBXOUCDBINF-GPJHCHHRSA-N 2 0 356.554 4.103 20 0 FIADRP c1cc(C[NH+]2CCC(c3nc4c(s3)CCCC4)CC2)c2c(c1)C[NH2+]CC2 ZINC000662282240 1086393200 /nfs/dbraw/zinc/39/32/00/1086393200.db2.gz DVUYBXLEOGSZAD-UHFFFAOYSA-N 2 0 367.562 4.047 20 0 FIADRP Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)cs1 ZINC000662293835 1086399074 /nfs/dbraw/zinc/39/90/74/1086399074.db2.gz OLPNKEVRBQBSRE-INIZCTEOSA-N 2 0 359.514 4.161 20 0 FIADRP COc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)cs1 ZINC000662295113 1086399143 /nfs/dbraw/zinc/39/91/43/1086399143.db2.gz SXGGNXVIHUJBDS-QGZVFWFLSA-N 2 0 371.550 4.030 20 0 FIADRP C[C@@H](c1ccccc1Cl)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327666 1086418964 /nfs/dbraw/zinc/41/89/64/1086418964.db2.gz KMVVWMMTANGSHP-HNNXBMFYSA-N 2 0 372.944 4.471 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Br)s1 ZINC000663346892 1086448015 /nfs/dbraw/zinc/44/80/15/1086448015.db2.gz WTAVIWDJWHUEBS-GXTWGEPZSA-N 2 0 357.361 4.283 20 0 FIADRP COCc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc1OC ZINC000162927466 1086479178 /nfs/dbraw/zinc/47/91/78/1086479178.db2.gz ZIWVTHRXRKPJPN-GOSISDBHSA-N 2 0 368.521 4.288 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccnn2-c2ccccc2)CC1 ZINC000583302662 1086546434 /nfs/dbraw/zinc/54/64/34/1086546434.db2.gz XNEKDJQBNHBFHR-UHFFFAOYSA-N 2 0 374.532 4.394 20 0 FIADRP C[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1OC(F)F ZINC000663468202 1086571988 /nfs/dbraw/zinc/57/19/88/1086571988.db2.gz KEXYRMCICPRMFR-UKRRQHHQSA-N 2 0 356.432 4.200 20 0 FIADRP COc1cc(OC)c([C@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663470152 1086574017 /nfs/dbraw/zinc/57/40/17/1086574017.db2.gz SLVMTBFLJAEBOB-HOCLYGCPSA-N 2 0 366.933 4.130 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc4ccc(F)cc4[nH]3)cc2)CC1 ZINC000583336949 1086574661 /nfs/dbraw/zinc/57/46/61/1086574661.db2.gz MCYVGBLJQRSXPI-UHFFFAOYSA-N 2 0 367.468 4.070 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@@H]1c1ccc(OC)cc1 ZINC001167827203 1086622483 /nfs/dbraw/zinc/62/24/83/1086622483.db2.gz UQHJDEKRGJYCBQ-YLJYHZDGSA-N 2 0 350.572 4.296 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2nnc(-c3ccccc3)o2)CC1 ZINC001167827882 1086630724 /nfs/dbraw/zinc/63/07/24/1086630724.db2.gz YWWVMNUQBZZBCF-SFHVURJKSA-N 2 0 370.541 4.427 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2nnc(-c3ccccc3)o2)CC1 ZINC001167827879 1086631157 /nfs/dbraw/zinc/63/11/57/1086631157.db2.gz YWWVMNUQBZZBCF-GOSISDBHSA-N 2 0 370.541 4.427 20 0 FIADRP CCN(C(=O)OC(C)(C)C)C1CC[NH+]([C@H](C)CCC[NH+](CC)CC)CC1 ZINC001167827901 1086632152 /nfs/dbraw/zinc/63/21/52/1086632152.db2.gz ZGJWCGHGTMXVQL-GOSISDBHSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CCO)Cc1ccc(Cl)c(Cl)c1 ZINC001167833388 1086665356 /nfs/dbraw/zinc/66/53/56/1086665356.db2.gz ARUKLLYLYLSGJA-HNNXBMFYSA-N 2 0 361.357 4.298 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(C(=O)c2ccc(F)cc2F)CC1 ZINC001167837914 1086711799 /nfs/dbraw/zinc/71/17/99/1086711799.db2.gz NTPCXVVGWKWHFB-INIZCTEOSA-N 2 0 366.496 4.370 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H](Sc2ccccc2OC)C1 ZINC001167839649 1086715034 /nfs/dbraw/zinc/71/50/34/1086715034.db2.gz AZMVNJBAIZKXLK-ZWKOTPCHSA-N 2 0 350.572 4.372 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432410844 1086733192 /nfs/dbraw/zinc/73/31/92/1086733192.db2.gz SDVUXOBFFIYCLN-DMKPSLHHSA-N 2 0 365.359 4.405 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C1(C)CCN(C(=O)OC(C)(C)C)CC1 ZINC001167841733 1086738727 /nfs/dbraw/zinc/73/87/27/1086738727.db2.gz PRRYXWVEAQVNST-SFHVURJKSA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1ccc2occc2c1 ZINC000512086764 1086750077 /nfs/dbraw/zinc/75/00/77/1086750077.db2.gz GFLYXXJSNTZQGO-UHFFFAOYSA-N 2 0 352.478 4.443 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000432428239 1086756304 /nfs/dbraw/zinc/75/63/04/1086756304.db2.gz JEVBUPPNNJDJQT-DZVQBONVSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](Cc2ccccc2)c2ccccc2)CCCO1 ZINC000432438714 1086769112 /nfs/dbraw/zinc/76/91/12/1086769112.db2.gz BWWNYPGWLVSIHF-OFNKIYASSA-N 2 0 352.522 4.061 20 0 FIADRP CN(C)Cc1cnc(CNCc2ccc(COc3ccccc3)cc2)s1 ZINC000512113379 1086782114 /nfs/dbraw/zinc/78/21/14/1086782114.db2.gz IQTZTVMGWTUEPI-UHFFFAOYSA-N 2 0 367.518 4.074 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncc(F)c1 ZINC000657773404 1086834087 /nfs/dbraw/zinc/83/40/87/1086834087.db2.gz RIDPVZYOPUJODQ-XLIONFOSSA-N 2 0 353.485 4.174 20 0 FIADRP C[C@H](CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@H]1CCC[NH2+]C1 ZINC000246176521 1086903046 /nfs/dbraw/zinc/90/30/46/1086903046.db2.gz BQXVMTLWLBTFLN-GGPKGHCWSA-N 2 0 357.542 4.025 20 0 FIADRP C[C@@H](CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)C1CC[NH2+]CC1 ZINC000246209805 1086907869 /nfs/dbraw/zinc/90/78/69/1086907869.db2.gz FTXCFVFHRNUDKR-ZWKOTPCHSA-N 2 0 357.542 4.025 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000650758392 1086973297 /nfs/dbraw/zinc/97/32/97/1086973297.db2.gz OKKNDZRVPYQEDR-SFHVURJKSA-N 2 0 350.384 4.082 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OC)c(Br)c1 ZINC000650758067 1086974471 /nfs/dbraw/zinc/97/44/71/1086974471.db2.gz HYLILSHOIMIIOW-ZDUSSCGKSA-N 2 0 363.299 4.028 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)C(C)(C)C(F)F ZINC000657826474 1087159787 /nfs/dbraw/zinc/15/97/87/1087159787.db2.gz GWCVGQSFXGLSDX-OAGGEKHMSA-N 2 0 354.485 4.065 20 0 FIADRP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC000584195624 1087213588 /nfs/dbraw/zinc/21/35/88/1087213588.db2.gz JXKTUUWJORXLRL-CQSZACIVSA-N 2 0 365.880 4.055 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000584255489 1087238185 /nfs/dbraw/zinc/23/81/85/1087238185.db2.gz LEQXDEVACRCMLO-SFHVURJKSA-N 2 0 357.517 4.046 20 0 FIADRP CSC1(C[NH2+]Cc2ccc(F)c(-c3cccs3)c2)CC[NH+](C)CC1 ZINC000584380600 1087309983 /nfs/dbraw/zinc/30/99/83/1087309983.db2.gz LBBHGFLMPOTRSV-UHFFFAOYSA-N 2 0 364.555 4.471 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(F)cn1 ZINC000092747347 1087447939 /nfs/dbraw/zinc/44/79/39/1087447939.db2.gz VLOSBOYNJGHMCO-OAHLLOKOSA-N 2 0 361.892 4.437 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2ccc(F)cc2o1 ZINC000092821599 1087448680 /nfs/dbraw/zinc/44/86/80/1087448680.db2.gz NLCDXDJZBUTPPV-UHFFFAOYSA-N 2 0 368.456 4.100 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(N3CCCC3)nc2)CC1)CC(C)C ZINC000685462643 1087575315 /nfs/dbraw/zinc/57/53/15/1087575315.db2.gz OEFXAQNZXMLSKD-UHFFFAOYSA-N 2 0 372.601 4.262 20 0 FIADRP CN1CCC([N@@H+](Cc2ccccc2)C[C@@H]2CCOc3ccccc32)CC1 ZINC000685467818 1087577691 /nfs/dbraw/zinc/57/76/91/1087577691.db2.gz BVBLFNYPEOYDEB-FQEVSTJZSA-N 2 0 350.506 4.149 20 0 FIADRP COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000163326429 1087599673 /nfs/dbraw/zinc/59/96/73/1087599673.db2.gz MPHDTKQPVIWVNN-JKSUJKDBSA-N 2 0 360.473 4.187 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)C1 ZINC000062426979 1087599740 /nfs/dbraw/zinc/59/97/40/1087599740.db2.gz VQBOQRAPDAPXEN-HXUWFJFHSA-N 2 0 356.485 4.225 20 0 FIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccncc2s1 ZINC000657909447 1087615262 /nfs/dbraw/zinc/61/52/62/1087615262.db2.gz LVYCZLRQSIDAPD-OAHLLOKOSA-N 2 0 352.507 4.259 20 0 FIADRP C[C@H]([NH2+]C[C@@]1(C)OCCc2sccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685662045 1087666725 /nfs/dbraw/zinc/66/67/25/1087666725.db2.gz YZFGSYGQLKQZHW-LRXVAGHRSA-N 2 0 370.562 4.036 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)cc2cc1OC ZINC000658034160 1087704064 /nfs/dbraw/zinc/70/40/64/1087704064.db2.gz COIBQOQUXITMLV-IAGOWNOFSA-N 2 0 356.510 4.240 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067421 1087709855 /nfs/dbraw/zinc/70/98/55/1087709855.db2.gz NRDXGIQLKQEPDI-QHCPKHFHSA-N 2 0 358.570 4.124 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658069680 1087710756 /nfs/dbraw/zinc/71/07/56/1087710756.db2.gz QEFNIOHPIPKQFJ-SFHVURJKSA-N 2 0 360.542 4.017 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000658136075 1087727848 /nfs/dbraw/zinc/72/78/48/1087727848.db2.gz BKVRGFGGOXLFMP-XZOQPEGZSA-N 2 0 352.522 4.057 20 0 FIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)C2CCC2)cc1 ZINC000658141948 1087733579 /nfs/dbraw/zinc/73/35/79/1087733579.db2.gz YCMFBMKFLKGGMI-RPWUZVMVSA-N 2 0 364.533 4.193 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](c3cccs3)C3CCCC3)cc2)C1 ZINC000658140404 1087733933 /nfs/dbraw/zinc/73/39/33/1087733933.db2.gz QOBDEHGQNQIKBY-IFMALSPDSA-N 2 0 370.562 4.336 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(F)cc1 ZINC000658142483 1087734036 /nfs/dbraw/zinc/73/40/36/1087734036.db2.gz ZNCFVNOYZLQGNA-DHIUTWEWSA-N 2 0 370.512 4.269 20 0 FIADRP CCCc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000658143151 1087735514 /nfs/dbraw/zinc/73/55/14/1087735514.db2.gz XBLBTDVJRHGEAL-FDDCHVKYSA-N 2 0 352.522 4.057 20 0 FIADRP CC(C)C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccncc1 ZINC000658162839 1087758392 /nfs/dbraw/zinc/75/83/92/1087758392.db2.gz GOZKPQFRWYMDCL-JOCHJYFZSA-N 2 0 352.526 4.066 20 0 FIADRP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164393 1087760332 /nfs/dbraw/zinc/76/03/32/1087760332.db2.gz CUPHJONXHKGQNC-QHCPKHFHSA-N 2 0 369.528 4.290 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C(C)(C)c1ccccc1 ZINC000658166143 1087763061 /nfs/dbraw/zinc/76/30/61/1087763061.db2.gz MTOPJXNTJGFWIR-LJQANCHMSA-N 2 0 351.538 4.250 20 0 FIADRP Fc1ccc2c(c1Cl)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000658167827 1087764161 /nfs/dbraw/zinc/76/41/61/1087764161.db2.gz ZBGPTNPZBWLWPO-IBGZPJMESA-N 2 0 373.903 4.363 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171812 1087766540 /nfs/dbraw/zinc/76/65/40/1087766540.db2.gz KHVKAXRTCASGDH-MRXNPFEDSA-N 2 0 372.484 4.158 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)CC1 ZINC000472590785 1087875117 /nfs/dbraw/zinc/87/51/17/1087875117.db2.gz OILRTZMNVCJHIO-GOSISDBHSA-N 2 0 363.977 4.282 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](Cc2ccncc2)c2cccs2)cc1 ZINC000424253436 1087875220 /nfs/dbraw/zinc/87/52/20/1087875220.db2.gz FQQUIXNALDAXEB-FQEVSTJZSA-N 2 0 351.519 4.278 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H](Cc2ccncc2)c2cccs2)c1 ZINC000424258280 1087878498 /nfs/dbraw/zinc/87/84/98/1087878498.db2.gz LMTPJDXYVMOVHC-FQEVSTJZSA-N 2 0 351.519 4.278 20 0 FIADRP CC(C)c1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424299762 1087904377 /nfs/dbraw/zinc/90/43/77/1087904377.db2.gz VREUQWFYPILBRO-GOSISDBHSA-N 2 0 371.569 4.336 20 0 FIADRP COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000414342933 1087909827 /nfs/dbraw/zinc/90/98/27/1087909827.db2.gz PUYMWSBCMPBUMS-ASLXYRGWSA-N 2 0 364.533 4.299 20 0 FIADRP Brc1ccc(-c2ccc(C[NH2+]C3CC[NH2+]CC3)s2)cc1 ZINC000414783063 1087950594 /nfs/dbraw/zinc/95/05/94/1087950594.db2.gz FURIILFMIXELQE-UHFFFAOYSA-N 2 0 351.313 4.019 20 0 FIADRP [NH3+]C[C@H](Cc1ccccc1)[C@H]1CCCC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000647532552 1087955733 /nfs/dbraw/zinc/95/57/33/1087955733.db2.gz BTSPCNIHRZXCJL-AZUAARDMSA-N 2 0 355.551 4.193 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000414810340 1088200101 /nfs/dbraw/zinc/20/01/01/1088200101.db2.gz HXWRXNBWFNJYCY-CABCVRRESA-N 2 0 359.901 4.175 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414813112 1088228463 /nfs/dbraw/zinc/22/84/63/1088228463.db2.gz LXMVRYZLUXVNNY-LSDHHAIUSA-N 2 0 359.901 4.175 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414813109 1088229221 /nfs/dbraw/zinc/22/92/21/1088229221.db2.gz LXMVRYZLUXVNNY-GJZGRUSLSA-N 2 0 359.901 4.175 20 0 FIADRP CC(C)c1ccc([C@H](N)C[NH2+]Cc2c[nH]nc2-c2ccccc2F)cc1 ZINC000414821971 1088288778 /nfs/dbraw/zinc/28/87/78/1088288778.db2.gz DCFOOIPEVOEVFP-HXUWFJFHSA-N 2 0 352.457 4.129 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)cc1 ZINC000163568585 1088293301 /nfs/dbraw/zinc/29/33/01/1088293301.db2.gz KINHUXCSSAWVDI-GKVSMKOHSA-N 2 0 358.551 4.117 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414830727 1088361394 /nfs/dbraw/zinc/36/13/94/1088361394.db2.gz CINUKWBQIFEONK-INIZCTEOSA-N 2 0 374.960 4.438 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1)c1ccc(Cl)cc1 ZINC000414842028 1088459549 /nfs/dbraw/zinc/45/95/49/1088459549.db2.gz ORBOTUPETQJMMY-INIZCTEOSA-N 2 0 371.912 4.072 20 0 FIADRP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@@H](N)c1ccc(C(C)C)cc1 ZINC000414843642 1088502561 /nfs/dbraw/zinc/50/25/61/1088502561.db2.gz JWXRMOFSRPIJGA-DYESRHJHSA-N 2 0 367.537 4.379 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)c1 ZINC000514101139 1088747005 /nfs/dbraw/zinc/74/70/05/1088747005.db2.gz ZBFWQYCYAFLGGX-XYJFISCASA-N 2 0 354.416 4.253 20 0 FIADRP CC(C)[C@H]1[N@H+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC12CCC2 ZINC000430107800 1088997401 /nfs/dbraw/zinc/99/74/01/1088997401.db2.gz YMWLOFAKJSLLCW-JOCHJYFZSA-N 2 0 355.570 4.228 20 0 FIADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000415042244 1089079494 /nfs/dbraw/zinc/07/94/94/1089079494.db2.gz QNLXVBRAKRQASM-STQMWFEESA-N 2 0 365.340 4.395 20 0 FIADRP Cc1cc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)sc1Br ZINC000415044151 1089082087 /nfs/dbraw/zinc/08/20/87/1089082087.db2.gz AJXKBVLMECFCRR-HNNXBMFYSA-N 2 0 353.329 4.389 20 0 FIADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000415046865 1089093797 /nfs/dbraw/zinc/09/37/97/1089093797.db2.gz VLDICKKDPIPOLS-FZMZJTMJSA-N 2 0 355.429 4.046 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Br)ccc1F)c1ccccc1 ZINC000415064228 1089104006 /nfs/dbraw/zinc/10/40/06/1089104006.db2.gz KHKDAHSOFDUSPG-QGZVFWFLSA-N 2 0 351.263 4.158 20 0 FIADRP CC1CC[NH+]([C@H](CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c2cccs2)CC1 ZINC000415089311 1089147770 /nfs/dbraw/zinc/14/77/70/1089147770.db2.gz WDFDOBBLHPIABN-IYWMVGAKSA-N 2 0 361.599 4.031 20 0 FIADRP CC1CC[NH+]([C@H](CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c2cccs2)CC1 ZINC000415089314 1089148247 /nfs/dbraw/zinc/14/82/47/1089148247.db2.gz WDFDOBBLHPIABN-VNTMZGSJSA-N 2 0 361.599 4.031 20 0 FIADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000415093803 1089152685 /nfs/dbraw/zinc/15/26/85/1089152685.db2.gz WCGCHMJKUGGZNW-HOCLYGCPSA-N 2 0 371.352 4.162 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@@H]1CCC[NH2+]C1 ZINC000414860430 1089166846 /nfs/dbraw/zinc/16/68/46/1089166846.db2.gz VJRIYGAHWLMTMU-DOTOQJQBSA-N 2 0 371.912 4.070 20 0 FIADRP C[C@H](C[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000415115157 1089173317 /nfs/dbraw/zinc/17/33/17/1089173317.db2.gz WKQLHDJENJGLPS-ZMYBRWDISA-N 2 0 370.459 4.027 20 0 FIADRP C[C@H](C[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000415115156 1089174433 /nfs/dbraw/zinc/17/44/33/1089174433.db2.gz WKQLHDJENJGLPS-NIKGAXFTSA-N 2 0 370.459 4.027 20 0 FIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000415116695 1089175853 /nfs/dbraw/zinc/17/58/53/1089175853.db2.gz IADUUJLXLKHUBZ-QHAWAJNXSA-N 2 0 352.526 4.006 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3cc(-c4ccccc4)cs3)CC2)C1 ZINC000415126468 1089177804 /nfs/dbraw/zinc/17/78/04/1089177804.db2.gz PIHLSDQPBDHFTL-TZIWHRDSSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3cccc(Oc4ccccc4)c3)CC2)C1 ZINC000415127753 1089192784 /nfs/dbraw/zinc/19/27/84/1089192784.db2.gz REGKODGULOETFB-OFNKIYASSA-N 2 0 366.505 4.197 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3)CC2)C1 ZINC000415130257 1089194838 /nfs/dbraw/zinc/19/48/38/1089194838.db2.gz WOKSBOWIKROKAL-GOTSBHOMSA-N 2 0 350.506 4.072 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc3c2OCC[C@@H]3[NH+](C)C)C1 ZINC000435041285 1089217496 /nfs/dbraw/zinc/21/74/96/1089217496.db2.gz IPQWDEMQFGRQMK-JUXOCIIHSA-N 2 0 365.521 4.319 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000472766045 1089359003 /nfs/dbraw/zinc/35/90/03/1089359003.db2.gz FISQKEPWNAXMQC-MRXNPFEDSA-N 2 0 372.384 4.402 20 0 FIADRP C[C@@H]1C[C@H](C[NH3+])CN1Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435374808 1089567422 /nfs/dbraw/zinc/56/74/22/1089567422.db2.gz YOWMZTHOFFTAGI-HUUCEWRRSA-N 2 0 360.933 4.128 20 0 FIADRP CN(Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl)C1CC[NH2+]CC1 ZINC000435379628 1089584080 /nfs/dbraw/zinc/58/40/80/1089584080.db2.gz MXVITJKUCQJHHR-UHFFFAOYSA-N 2 0 360.933 4.142 20 0 FIADRP Cn1cncc1CCC[N@@H+]1CCSC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000515178298 1089856315 /nfs/dbraw/zinc/85/63/15/1089856315.db2.gz LLYBXPKOSJCMHI-KRWDZBQOSA-N 2 0 369.456 4.162 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)ccn1 ZINC000515406287 1090013356 /nfs/dbraw/zinc/01/33/56/1090013356.db2.gz JVUPBEOBJBYSDX-GOSISDBHSA-N 2 0 353.510 4.317 20 0 FIADRP C[N@H+](C[C@@H]1CCC2(CCCCC2)O1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000467198495 1090200444 /nfs/dbraw/zinc/20/04/44/1090200444.db2.gz UCQGPFWYOIAJKV-NRFANRHFSA-N 2 0 357.542 4.112 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000378398339 1090345375 /nfs/dbraw/zinc/34/53/75/1090345375.db2.gz QOXMXORYQLRLQT-AVCGJXAMSA-N 2 0 368.521 4.055 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnc3ccccc3n2)CC1 ZINC000660007088 1090400098 /nfs/dbraw/zinc/40/00/98/1090400098.db2.gz YWBOXEQKLIDBLU-SFHVURJKSA-N 2 0 352.526 4.106 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000382072931 1090430613 /nfs/dbraw/zinc/43/06/13/1090430613.db2.gz ZXLXFFQFJJLFDY-DENIHFKCSA-N 2 0 352.522 4.474 20 0 FIADRP Cc1ncc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000628297647 1090798584 /nfs/dbraw/zinc/79/85/84/1090798584.db2.gz GWDNCXYQRYYUEL-NRFANRHFSA-N 2 0 353.510 4.106 20 0 FIADRP FC(F)(F)c1cccc([C@H]2CCC[C@@H]2[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000584830508 1090925762 /nfs/dbraw/zinc/92/57/62/1090925762.db2.gz SCNYSZSGPKYBQG-MOPGFXCFSA-N 2 0 370.459 4.044 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH+](CC)CC)c2)o1 ZINC000042724785 1090986570 /nfs/dbraw/zinc/98/65/70/1090986570.db2.gz NALNVBQLYRXXQF-UHFFFAOYSA-N 2 0 357.498 4.216 20 0 FIADRP OC1(C[NH2+][C@@H]2CCCCc3ccccc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397628042 1091023081 /nfs/dbraw/zinc/02/30/81/1091023081.db2.gz YWSIZYDDRAOZJG-HSZRJFAPSA-N 2 0 364.533 4.071 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)CC1 ZINC000500086384 1091031689 /nfs/dbraw/zinc/03/16/89/1091031689.db2.gz DIMRNMCZZCWKEW-GOSISDBHSA-N 2 0 363.977 4.282 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000311099970 1091077617 /nfs/dbraw/zinc/07/76/17/1091077617.db2.gz HYLKCCLDMQPZMT-QBUWPKIASA-N 2 0 367.578 4.017 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc2[nH]cc(CC[NH+]3CCCC3)c2c1 ZINC001167753129 1091175867 /nfs/dbraw/zinc/17/58/67/1091175867.db2.gz KYKHCOIFARVYDH-IBGZPJMESA-N 2 0 368.569 4.483 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)sc1Br ZINC000511760041 1091628578 /nfs/dbraw/zinc/62/85/78/1091628578.db2.gz VOGAWBZNCNFOFX-GFCCVEGCSA-N 2 0 357.361 4.344 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000511772555 1091656940 /nfs/dbraw/zinc/65/69/40/1091656940.db2.gz MPIMTXJENRGRTE-KNKQGSTJSA-N 2 0 352.522 4.214 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc(C[NH+](C)C)cc2)cc1 ZINC000512222642 1091928945 /nfs/dbraw/zinc/92/89/45/1091928945.db2.gz VFRCILFUDGLBFN-SFHVURJKSA-N 2 0 365.521 4.375 20 0 FIADRP CC(C)COc1ccc(-c2ccc(NC(=[NH2+])NCCCC[NH3+])cc2)cc1 ZINC001167883170 1091958429 /nfs/dbraw/zinc/95/84/29/1091958429.db2.gz BBTAZVRVUWNEFA-UHFFFAOYSA-N 2 0 354.498 4.064 20 0 FIADRP C[C@H]1CC([NH2+]CCOc2ccc(F)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168011719 1092207431 /nfs/dbraw/zinc/20/74/31/1092207431.db2.gz RNJYFLZXQLYKCK-ROUUACIJSA-N 2 0 356.485 4.236 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](CCC(C)C)c3ccoc3)cn2)CC1 ZINC000428214386 1092266504 /nfs/dbraw/zinc/26/65/04/1092266504.db2.gz CWNOBZDNFMVKSY-NRFANRHFSA-N 2 0 370.541 4.084 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccccn1 ZINC000500613564 1092282061 /nfs/dbraw/zinc/28/20/61/1092282061.db2.gz BTHUZGQUEISGSL-FQEVSTJZSA-N 2 0 351.538 4.467 20 0 FIADRP CC(C)CC[C@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccoc1 ZINC000428229871 1092283874 /nfs/dbraw/zinc/28/38/74/1092283874.db2.gz XXNUTJMKJHHJQM-QFIPXVFZSA-N 2 0 356.510 4.379 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2N(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011900 1092302766 /nfs/dbraw/zinc/30/27/66/1092302766.db2.gz UFVBHDQYMSMFSU-HATOLVCRSA-N 2 0 351.538 4.284 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2Cc3ccccc3O2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011936 1092309136 /nfs/dbraw/zinc/30/91/36/1092309136.db2.gz UJFDDQINVYCORQ-UDKICSLYSA-N 2 0 350.506 4.021 20 0 FIADRP Cc1ccccc1OCC[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012157 1092333018 /nfs/dbraw/zinc/33/30/18/1092333018.db2.gz XBGWBVAVNLVPBA-VTYHHJSWSA-N 2 0 352.522 4.405 20 0 FIADRP COc1cc([C@H](C)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c(F)cn1 ZINC000521016651 1092425318 /nfs/dbraw/zinc/42/53/18/1092425318.db2.gz QGBCDIFIFFXLHY-PKOBYXMFSA-N 2 0 371.500 4.182 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000521043699 1092442136 /nfs/dbraw/zinc/44/21/36/1092442136.db2.gz HSCYQSIVNPZOHM-UGKGYDQZSA-N 2 0 374.532 4.076 20 0 FIADRP Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000237157613 1092463301 /nfs/dbraw/zinc/46/33/01/1092463301.db2.gz ZIISUQAADVOLTM-UHFFFAOYSA-N 2 0 374.960 4.023 20 0 FIADRP C[C@H]1C[C@@H]1c1ccc(C[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)o1 ZINC000237570603 1092511350 /nfs/dbraw/zinc/51/13/50/1092511350.db2.gz PLSYEMBLULVYGF-KKSFZXQISA-N 2 0 353.510 4.228 20 0 FIADRP C[C@@H]1CC(NC[C@H](c2ccccc2)[NH+](C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014112 1092674619 /nfs/dbraw/zinc/67/46/19/1092674619.db2.gz KABPCMNFRVRFFP-YOSAUDMPSA-N 2 0 365.565 4.321 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000549726894 1092723815 /nfs/dbraw/zinc/72/38/15/1092723815.db2.gz OOVTUCSVMSVAJG-GHTZIAJQSA-N 2 0 364.574 4.133 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000442763761 1092751492 /nfs/dbraw/zinc/75/14/92/1092751492.db2.gz GVFKXSHBECOPBK-UHFFFAOYSA-N 2 0 371.903 4.005 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1 ZINC000443062314 1092924168 /nfs/dbraw/zinc/92/41/68/1092924168.db2.gz UKORVFGXLCQIMZ-SIKLNZKXSA-N 2 0 365.521 4.044 20 0 FIADRP COc1ccc(CNC2CC[NH+](C3CCC3)CC2)cc1OCCC(C)C ZINC000521831729 1092933492 /nfs/dbraw/zinc/93/34/92/1092933492.db2.gz JFFCDWAEHUDIPD-UHFFFAOYSA-N 2 0 360.542 4.227 20 0 FIADRP O[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000245687117 1092948744 /nfs/dbraw/zinc/94/87/44/1092948744.db2.gz JSNSZOWWXUAFAC-KJJMTIBFSA-N 2 0 370.924 4.159 20 0 FIADRP CSc1cc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)ccn1 ZINC000512646705 1093068321 /nfs/dbraw/zinc/06/83/21/1093068321.db2.gz CMDHHHLYKSADDA-NJDAHSKKSA-N 2 0 367.562 4.194 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512653317 1093080086 /nfs/dbraw/zinc/08/00/86/1093080086.db2.gz DOQNHDSYJJHESN-MRKXFKPJSA-N 2 0 370.581 4.208 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH2+]C[C@@H](c1ccccc1)N1CCCC1 ZINC000509616466 1093172311 /nfs/dbraw/zinc/17/23/11/1093172311.db2.gz ILDCKFOVTCVLJY-QHCPKHFHSA-N 2 0 360.505 4.014 20 0 FIADRP c1ccc(N2CCC[C@@H](C[NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000433093515 1093236436 /nfs/dbraw/zinc/23/64/36/1093236436.db2.gz QYDUQJFQOIGPHH-FQEVSTJZSA-N 2 0 355.570 4.290 20 0 FIADRP C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248586894 1093275624 /nfs/dbraw/zinc/27/56/24/1093275624.db2.gz QGFIQQJXLFCAHU-IQUTYRLHSA-N 2 0 371.352 4.269 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000469787215 1093295826 /nfs/dbraw/zinc/29/58/26/1093295826.db2.gz NXVTZHCUEIOBTF-NQIIRXRSSA-N 2 0 364.599 4.414 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1ccc2c(c1)OCO2 ZINC000411461974 1093314959 /nfs/dbraw/zinc/31/49/59/1093314959.db2.gz QIQJEKKNNYPMEI-QGZVFWFLSA-N 2 0 352.478 4.252 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(C(F)(F)F)cc2C)CC1 ZINC000443637932 1093369173 /nfs/dbraw/zinc/36/91/73/1093369173.db2.gz HHMWTYIFCAEAFM-UHFFFAOYSA-N 2 0 372.475 4.337 20 0 FIADRP Cc1cc(C(F)(F)F)ccc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000443642150 1093373920 /nfs/dbraw/zinc/37/39/20/1093373920.db2.gz NEIHMEJQPBDWSF-UHFFFAOYSA-N 2 0 370.459 4.091 20 0 FIADRP CC(C)(C)OC(=O)CCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433178071 1093390158 /nfs/dbraw/zinc/39/01/58/1093390158.db2.gz VVNJULANBFCNTC-UHFFFAOYSA-N 2 0 372.553 4.096 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000512846954 1093446430 /nfs/dbraw/zinc/44/64/30/1093446430.db2.gz RZGVQLKSZXFGIZ-GOSISDBHSA-N 2 0 358.913 4.350 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)CC(C)(C)CC[NH3+] ZINC001168028047 1093528052 /nfs/dbraw/zinc/52/80/52/1093528052.db2.gz ODKYILOMBLEUOK-KEZQHZCBSA-N 3 0 359.602 4.419 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(N2CCOC2=O)cc1 ZINC000158567175 1093531837 /nfs/dbraw/zinc/53/18/37/1093531837.db2.gz OGWZSXYFKSUPNQ-QRVBRYPASA-N 2 0 373.541 4.052 20 0 FIADRP Cc1nc(C(C)C)oc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000428290190 1093549909 /nfs/dbraw/zinc/54/99/09/1093549909.db2.gz WNXUGBAXDAHMKV-UHFFFAOYSA-N 2 0 356.514 4.240 20 0 FIADRP CC[N@H+](CCCc1ccc(C)nc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000474274987 1093635191 /nfs/dbraw/zinc/63/51/91/1093635191.db2.gz NWFUXWGOMQAYTG-QHCPKHFHSA-N 2 0 351.538 4.167 20 0 FIADRP Cc1ccc(CCC[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cn1 ZINC000474280498 1093649627 /nfs/dbraw/zinc/64/96/27/1093649627.db2.gz WGPSFVGVXKFAED-UHFFFAOYSA-N 2 0 363.549 4.311 20 0 FIADRP CCOC(=O)[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168032216 1093652584 /nfs/dbraw/zinc/65/25/84/1093652584.db2.gz GQDPZVMSRRGFPI-HVYFLLBWSA-N 2 0 372.553 4.140 20 0 FIADRP Cc1cccnc1C1(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168034000 1093728594 /nfs/dbraw/zinc/72/85/94/1093728594.db2.gz NXLNHXIGCBVSDS-VTYHHJSWSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@@H]1CC(N(CC[NH3+])c2ccc(F)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168034064 1093735255 /nfs/dbraw/zinc/73/52/55/1093735255.db2.gz OEMDPWWNWOMVQT-QZTJIDSGSA-N 2 0 355.501 4.032 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1F ZINC000513080900 1093782678 /nfs/dbraw/zinc/78/26/78/1093782678.db2.gz GNDZLEVDRDSSFH-FXAWDEMLSA-N 2 0 356.485 4.020 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2ccccc2C[NH+](CC)CC)CC1 ZINC000474481912 1093827837 /nfs/dbraw/zinc/82/78/37/1093827837.db2.gz WXFZONGSYNITQZ-UHFFFAOYSA-N 2 0 360.542 4.130 20 0 FIADRP C[C@@H]1CC(N(C(N)=[NH2+])c2ccc(Cl)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036258 1093849283 /nfs/dbraw/zinc/84/92/83/1093849283.db2.gz URCHWPMEYKWVHV-HZPDHXFCSA-N 2 0 370.928 4.481 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)CC1 ZINC000513343147 1094076085 /nfs/dbraw/zinc/07/60/85/1094076085.db2.gz NCINJMXGSAJXAA-QHCPKHFHSA-N 2 0 366.553 4.108 20 0 FIADRP Cc1cccc2ncc(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)n21 ZINC000513493439 1094160928 /nfs/dbraw/zinc/16/09/28/1094160928.db2.gz ASEIVVIXIFAXBN-TZIWHRDSSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cnc(-c3ccccc3)[nH]2)C[N@@H+]1Cc1ccccc1 ZINC000513494784 1094162932 /nfs/dbraw/zinc/16/29/32/1094162932.db2.gz JRLNZVOTHZLVBI-TZIWHRDSSA-N 2 0 374.532 4.467 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(-n3cccn3)cc2)CC1 ZINC000513671791 1094266427 /nfs/dbraw/zinc/26/64/27/1094266427.db2.gz FSHNSQIBPQPJMZ-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP C[C@H]1CC([NH2+]CC2(c3ncccc3F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168037344 1094366161 /nfs/dbraw/zinc/36/61/61/1094366161.db2.gz ZXPAJLBDOLPXRS-ROUUACIJSA-N 2 0 367.512 4.284 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000513703685 1094410942 /nfs/dbraw/zinc/41/09/42/1094410942.db2.gz YTAFXKCLPSWFPR-FKBYEOEOSA-N 2 0 350.506 4.195 20 0 FIADRP COCC[C@@H](c1ccccc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501092902 1094500798 /nfs/dbraw/zinc/50/07/98/1094500798.db2.gz XZSNAWRAIMNWDV-QFIPXVFZSA-N 2 0 353.510 4.008 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1 ZINC000501117299 1094516654 /nfs/dbraw/zinc/51/66/54/1094516654.db2.gz IKSWJYPPYRPVIK-NJDAHSKKSA-N 2 0 365.565 4.391 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467295235 1094580748 /nfs/dbraw/zinc/58/07/48/1094580748.db2.gz KXOXHLXYNPVNLX-NRFANRHFSA-N 2 0 363.977 4.189 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000501390752 1094674688 /nfs/dbraw/zinc/67/46/88/1094674688.db2.gz UFQLFUNHDBJLRW-IRLDBZIGSA-N 2 0 367.537 4.228 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000501390750 1094676265 /nfs/dbraw/zinc/67/62/65/1094676265.db2.gz UFQLFUNHDBJLRW-IFMALSPDSA-N 2 0 367.537 4.228 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000513716543 1094755020 /nfs/dbraw/zinc/75/50/20/1094755020.db2.gz DBHNNCNMSVEOOT-GOSISDBHSA-N 2 0 356.432 4.499 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCC(=O)N2 ZINC000329166948 1094763512 /nfs/dbraw/zinc/76/35/12/1094763512.db2.gz IHSGMDGHXSCEBL-IVMQYODDSA-N 2 0 371.525 4.361 20 0 FIADRP Cc1ccc(CCC[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000474881344 1094844205 /nfs/dbraw/zinc/84/42/05/1094844205.db2.gz VWQQKVARSJIZRM-OFNKIYASSA-N 2 0 351.538 4.213 20 0 FIADRP C[N@H+](CCCCCc1cc(-c2cccc(F)c2)no1)CC[C@H]1CC[NH2+]C1 ZINC000420294171 1094853640 /nfs/dbraw/zinc/85/36/40/1094853640.db2.gz AUEAXIXJYNJELA-QGZVFWFLSA-N 2 0 359.489 4.125 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000474894383 1094864559 /nfs/dbraw/zinc/86/45/59/1094864559.db2.gz IAAQEXJKVGFZIM-UHFFFAOYSA-N 2 0 362.521 4.311 20 0 FIADRP CCC[N@H+](CC[C@@H]1CCC[NH2+]C1)CC(=O)Nc1cc(Cl)ccc1Cl ZINC000420322949 1094869030 /nfs/dbraw/zinc/86/90/30/1094869030.db2.gz SWVZTAMKFJHUGK-AWEZNQCLSA-N 2 0 372.340 4.034 20 0 FIADRP Clc1ccccc1-c1csc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)n1 ZINC000420322106 1094884338 /nfs/dbraw/zinc/88/43/38/1094884338.db2.gz WCRNAGIRDRTVDK-HNNXBMFYSA-N 2 0 361.942 4.285 20 0 FIADRP Clc1ccccc1-c1csc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)n1 ZINC000420325982 1094889860 /nfs/dbraw/zinc/88/98/60/1094889860.db2.gz IVQSLXDWZDTNJP-LSDHHAIUSA-N 2 0 361.942 4.285 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420394241 1094910195 /nfs/dbraw/zinc/91/01/95/1094910195.db2.gz RNBKUGOAESANCE-CDHAZOANSA-N 2 0 357.325 4.273 20 0 FIADRP COc1ccc([C@H](C[NH3+])C[N@H+](C)[C@H](C)c2sc(C(C)C)nc2C)cc1 ZINC000420376665 1094912706 /nfs/dbraw/zinc/91/27/06/1094912706.db2.gz QYENFPPUXNTWMA-NVXWUHKLSA-N 2 0 361.555 4.319 20 0 FIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2ccc(F)cc2F)CC1 ZINC000501776523 1094920161 /nfs/dbraw/zinc/92/01/61/1094920161.db2.gz OMVUYOFXZJTXQQ-MRXNPFEDSA-N 2 0 354.485 4.096 20 0 FIADRP C[N@@H+](Cc1ccc(-c2nc3ccccc3s2)o1)CC1CC[NH+](C)CC1 ZINC000513730097 1095101831 /nfs/dbraw/zinc/10/18/31/1095101831.db2.gz VHPVPYOBBQZFNS-UHFFFAOYSA-N 2 0 355.507 4.330 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000502282633 1095304777 /nfs/dbraw/zinc/30/47/77/1095304777.db2.gz OJYBICSKGRBHDW-HKUYNNGSSA-N 2 0 362.558 4.045 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]2CCOC)CC[NH+](Cc2ccccc2)CC1 ZINC000502428569 1095446912 /nfs/dbraw/zinc/44/69/12/1095446912.db2.gz LZNPTONPSJXKQE-FGZHOGPDSA-N 2 0 358.570 4.474 20 0 FIADRP CCC1(C[NH2+][C@H](C)c2cc(C)n(C)n2)CC[NH+](Cc2ccccc2)CC1 ZINC000502427481 1095465025 /nfs/dbraw/zinc/46/50/25/1095465025.db2.gz IRGPAPHJVQNBGD-LJQANCHMSA-N 2 0 354.542 4.072 20 0 FIADRP Cc1nccn1CCCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000280978470 1095466437 /nfs/dbraw/zinc/46/64/37/1095466437.db2.gz LAQFSOFTPVYHGS-UHFFFAOYSA-N 2 0 354.542 4.005 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000502469990 1095497873 /nfs/dbraw/zinc/49/78/73/1095497873.db2.gz DMCSBZQJLXXDDZ-FHWLQOOXSA-N 2 0 374.569 4.186 20 0 FIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421369096 1095568941 /nfs/dbraw/zinc/56/89/41/1095568941.db2.gz HCPUWIDNNFATPI-UHFFFAOYSA-N 2 0 374.960 4.164 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000502969978 1095990776 /nfs/dbraw/zinc/99/07/76/1095990776.db2.gz NHIOYZKRXQZKKP-OAQYLSRUSA-N 2 0 365.606 4.003 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CCC[NH+]2CCC(C)CC2)cc1 ZINC000513761021 1095995109 /nfs/dbraw/zinc/99/51/09/1095995109.db2.gz LMTMBVLHXXWVJE-QHCPKHFHSA-N 2 0 367.537 4.086 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)[nH]1 ZINC000503123196 1096075770 /nfs/dbraw/zinc/07/57/70/1096075770.db2.gz RJJXXAANOCTCBZ-FJIJXJHWSA-N 2 0 359.517 4.211 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)[nH]1 ZINC000503123198 1096075859 /nfs/dbraw/zinc/07/58/59/1096075859.db2.gz RJJXXAANOCTCBZ-ODGPQVTHSA-N 2 0 359.517 4.211 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](COc1ccccc1F)C(C)(C)C ZINC000422710986 1096460479 /nfs/dbraw/zinc/46/04/79/1096460479.db2.gz METPSSDPVMCIBD-MGPUTAFESA-N 2 0 359.489 4.132 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)O1 ZINC000503562798 1096465716 /nfs/dbraw/zinc/46/57/16/1096465716.db2.gz NMTCOZNTFCPWRE-QZTJIDSGSA-N 2 0 358.482 4.051 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+]CCCCCOC1CCCCC1 ZINC000422716816 1096468810 /nfs/dbraw/zinc/46/88/10/1096468810.db2.gz URSJOHOQHGDKGX-JTHBVZDNSA-N 2 0 372.553 4.352 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1OC1CCCC1 ZINC000422716397 1096469223 /nfs/dbraw/zinc/46/92/23/1096469223.db2.gz UEPRABOCBSWOJD-SLFFLAALSA-N 2 0 358.526 4.027 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1OC1CCCC1 ZINC000422716401 1096469395 /nfs/dbraw/zinc/46/93/95/1096469395.db2.gz UEPRABOCBSWOJD-XUVXKRRUSA-N 2 0 358.526 4.027 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1OC ZINC000422724092 1096471412 /nfs/dbraw/zinc/47/14/12/1096471412.db2.gz UJVBIKBGJILSPH-BPQIPLTHSA-N 2 0 366.933 4.148 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](c1cccs1)N1CCC(C)CC1 ZINC000422742735 1096478550 /nfs/dbraw/zinc/47/85/50/1096478550.db2.gz HABDFOQNRSAFOW-OXJNMPFZSA-N 2 0 372.582 4.034 20 0 FIADRP c1sc2ccccc2c1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422751879 1096482580 /nfs/dbraw/zinc/48/25/80/1096482580.db2.gz DDNCJEOPQLJYFI-NQIIRXRSSA-N 2 0 350.487 4.247 20 0 FIADRP CC[C@H]1C[C@H](C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000503591391 1096487403 /nfs/dbraw/zinc/48/74/03/1096487403.db2.gz HRQVRWZBSCYLIL-NQIIRXRSSA-N 2 0 356.510 4.206 20 0 FIADRP CCC(CC)(CN[C@@H](C)c1ccc(C[NH3+])nc1C)[NH2+][C@H](C)c1ccccc1 ZINC000422772628 1096488008 /nfs/dbraw/zinc/48/80/08/1096488008.db2.gz XHRNQRNPOJVJHL-MSOLQXFVSA-N 2 0 368.569 4.409 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)Sc1ccccc1 ZINC000422778586 1096488947 /nfs/dbraw/zinc/48/89/47/1096488947.db2.gz ATOJOKGQAKETBY-OZOXKJRCSA-N 2 0 354.519 4.013 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)s2)cs1 ZINC000422793561 1096492255 /nfs/dbraw/zinc/49/22/55/1096492255.db2.gz FTFLVEHNKPVNBW-LBPRGKRZSA-N 2 0 372.563 4.235 20 0 FIADRP FC(F)(F)COCc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422805128 1096495278 /nfs/dbraw/zinc/49/52/78/1096495278.db2.gz GIGGAULDEYSCEZ-GUDVDZBRSA-N 2 0 370.459 4.166 20 0 FIADRP FC(F)(F)COc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422805592 1096496384 /nfs/dbraw/zinc/49/63/84/1096496384.db2.gz MEPDOFCCRJQSTF-RCCFBDPRSA-N 2 0 356.432 4.028 20 0 FIADRP c1nc2ccccc2n1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422828250 1096500172 /nfs/dbraw/zinc/50/01/72/1096500172.db2.gz ODRSJNJTAHLAAZ-BHIFYINESA-N 2 0 374.532 4.095 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422825983 1096500380 /nfs/dbraw/zinc/50/03/80/1096500380.db2.gz QKTSJILOYOXJMG-LBPRGKRZSA-N 2 0 352.309 4.439 20 0 FIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422840931 1096502776 /nfs/dbraw/zinc/50/27/76/1096502776.db2.gz CIOIEOLNEXVBLE-WAOWUJCRSA-N 2 0 370.493 4.208 20 0 FIADRP c1ccc(COCc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2)cc1 ZINC000422859906 1096506612 /nfs/dbraw/zinc/50/66/12/1096506612.db2.gz KNQRHXPFGGKBOA-RBZQAINGSA-N 2 0 364.533 4.414 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@H](Cc2ccccc2)[C@H](C)[NH3+])C1 ZINC000422878250 1096509878 /nfs/dbraw/zinc/50/98/78/1096509878.db2.gz JVBNQGNJZOOVCT-FBBABVLZSA-N 2 0 371.956 4.023 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OCCC(C)C ZINC000422880389 1096510958 /nfs/dbraw/zinc/51/09/58/1096510958.db2.gz LTSHVJUSQUSHTN-INIZCTEOSA-N 2 0 371.525 4.133 20 0 FIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422881146 1096510999 /nfs/dbraw/zinc/51/09/99/1096510999.db2.gz POJKZXPVDHWTJK-RDTXWAMCSA-N 2 0 371.352 4.149 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422882709 1096512201 /nfs/dbraw/zinc/51/22/01/1096512201.db2.gz STHPWMSPYHNCKJ-CQSZACIVSA-N 2 0 359.341 4.149 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000422886582 1096514068 /nfs/dbraw/zinc/51/40/68/1096514068.db2.gz XCCPQPFGSMQNBW-QZTJIDSGSA-N 3 0 366.553 4.074 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000422874193 1096517199 /nfs/dbraw/zinc/51/71/99/1096517199.db2.gz CGCVMMYVGXBXSX-IAGOWNOFSA-N 2 0 371.500 4.175 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)ccc1Oc1cccnc1 ZINC000422901950 1096519242 /nfs/dbraw/zinc/51/92/42/1096519242.db2.gz LXPJFAKVELWGAV-CEWLAPEOSA-N 2 0 369.484 4.413 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000422937847 1096530059 /nfs/dbraw/zinc/53/00/59/1096530059.db2.gz CWKXBQQUCMNSHL-ACBHZAAOSA-N 2 0 359.311 4.398 20 0 FIADRP c1sc2ccccc2c1CC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422938429 1096530144 /nfs/dbraw/zinc/53/01/44/1096530144.db2.gz POXNKGCIXNLWSC-DENIHFKCSA-N 2 0 364.514 4.289 20 0 FIADRP CC[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc(F)ccc1F ZINC000422919201 1096532783 /nfs/dbraw/zinc/53/27/83/1096532783.db2.gz JWUNEFGMTGGITN-ZJOUEHCJSA-N 2 0 358.432 4.261 20 0 FIADRP Clc1ccc(CCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422950202 1096537271 /nfs/dbraw/zinc/53/72/71/1096537271.db2.gz XIKNQUFNEVPPAD-FPOVZHCZSA-N 2 0 356.897 4.118 20 0 FIADRP c1ccc(-c2cccc(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)c2)nc1 ZINC000422993808 1096542370 /nfs/dbraw/zinc/54/23/70/1096542370.db2.gz GHQICHTXIPEQNP-UPVQGACJSA-N 2 0 371.484 4.094 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NC[C@H]1CCC[C@@H]([NH3+])C1)C1CCCCC1 ZINC000414710537 1096545848 /nfs/dbraw/zinc/54/58/48/1096545848.db2.gz LIYDLFVWBOQGGC-PKOBYXMFSA-N 2 0 372.557 4.090 20 0 FIADRP CCOc1cc(Cl)ccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423005257 1096547991 /nfs/dbraw/zinc/54/79/91/1096547991.db2.gz QYFLGWOXYSHOJF-RXVVDRJESA-N 2 0 372.896 4.084 20 0 FIADRP CCC([NH3+])(CC)CNC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414711149 1096548396 /nfs/dbraw/zinc/54/83/96/1096548396.db2.gz MCMKPEVDSRDUGR-UHFFFAOYSA-N 2 0 360.546 4.090 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423058679 1096560838 /nfs/dbraw/zinc/56/08/38/1096560838.db2.gz KCIOTGAQECNSAQ-STQMWFEESA-N 2 0 351.416 4.322 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423058677 1096561241 /nfs/dbraw/zinc/56/12/41/1096561241.db2.gz KCIOTGAQECNSAQ-OLZOCXBDSA-N 2 0 351.416 4.322 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH+]1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000423052815 1096565281 /nfs/dbraw/zinc/56/52/81/1096565281.db2.gz RHQUYRDAGGQMIG-HNNXBMFYSA-N 2 0 359.464 4.143 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)ccn1 ZINC000423082033 1096567350 /nfs/dbraw/zinc/56/73/50/1096567350.db2.gz DSKPGLBXGZETAD-QXAKKESOSA-N 2 0 355.457 4.023 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089885 1096571349 /nfs/dbraw/zinc/57/13/49/1096571349.db2.gz WETDCLKTZGYCIL-URVUXULASA-N 2 0 352.453 4.049 20 0 FIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423093514 1096572343 /nfs/dbraw/zinc/57/23/43/1096572343.db2.gz HVBFISRCWSRWPA-RXABAKJHSA-N 2 0 352.444 4.462 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]C1CCC(c2ccc(C(C)(C)C)cc2)CC1 ZINC000423115671 1096578073 /nfs/dbraw/zinc/57/80/73/1096578073.db2.gz YGUUZKOJTFJWEU-XNDYWVSOSA-N 2 0 358.570 4.352 20 0 FIADRP Clc1ccccc1[C@H]1C[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423150894 1096589063 /nfs/dbraw/zinc/58/90/63/1096589063.db2.gz ZMIXPDXRUKYFGB-VPZAWKCMSA-N 2 0 368.908 4.432 20 0 FIADRP Clc1cccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)C2)c1 ZINC000423157411 1096590895 /nfs/dbraw/zinc/59/08/95/1096590895.db2.gz AZDADBFQHCRAGK-SDZDHKAXSA-N 2 0 362.945 4.113 20 0 FIADRP Clc1cccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)C2)c1 ZINC000423157408 1096590933 /nfs/dbraw/zinc/59/09/33/1096590933.db2.gz AZDADBFQHCRAGK-KPACCLEDSA-N 2 0 362.945 4.113 20 0 FIADRP Fc1cccc2c1CCC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423144513 1096595994 /nfs/dbraw/zinc/59/59/94/1096595994.db2.gz HHKHVYQQFBOOJY-ONTIZHBOSA-N 2 0 352.453 4.049 20 0 FIADRP Cc1ncsc1C[N@H+](CCc1ccc(C(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC000414721413 1096597666 /nfs/dbraw/zinc/59/76/66/1096597666.db2.gz CAYNUSSRZDMLQE-LJQANCHMSA-N 2 0 357.567 4.229 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(Br)cc1C(F)(F)F ZINC000423213738 1096616115 /nfs/dbraw/zinc/61/61/15/1096616115.db2.gz NXMBVXZJIDNWNO-WDEREUQCSA-N 2 0 365.237 4.118 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000423344880 1096646446 /nfs/dbraw/zinc/64/64/46/1096646446.db2.gz XDVDZCDARIVEIS-IRXDYDNUSA-N 2 0 351.494 4.333 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1OC(F)F ZINC000423373631 1096651937 /nfs/dbraw/zinc/65/19/37/1096651937.db2.gz HWAYIZJHVQZCLU-LLVKDONJSA-N 2 0 352.812 4.395 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423407448 1096673889 /nfs/dbraw/zinc/67/38/89/1096673889.db2.gz VVMKIARZVPCOHZ-PKFCDNJMSA-N 2 0 354.338 4.373 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423430553 1096683250 /nfs/dbraw/zinc/68/32/50/1096683250.db2.gz LBISZQGBKRHXTR-KSSFIOAISA-N 2 0 369.347 4.024 20 0 FIADRP COCCC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423459923 1096689502 /nfs/dbraw/zinc/68/95/02/1096689502.db2.gz AJROLRBQIQFMEL-JLSDUUJJSA-N 2 0 369.347 4.024 20 0 FIADRP COCCC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423467629 1096691811 /nfs/dbraw/zinc/69/18/11/1096691811.db2.gz BMFUEOBRDBRVKV-ZWKOTPCHSA-N 2 0 369.347 4.039 20 0 FIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc2cc(Br)ccc2o1 ZINC000423475508 1096695346 /nfs/dbraw/zinc/69/53/46/1096695346.db2.gz ICXIIGPCGDIMQX-IUODEOHRSA-N 2 0 351.288 4.378 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2ccc(F)cc2)CC1 ZINC000423503287 1096701032 /nfs/dbraw/zinc/70/10/32/1096701032.db2.gz KJANFJMGLXOBAL-BWAGFHJFSA-N 3 0 361.549 4.096 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2ccccc2Br)C1 ZINC000423508801 1096701736 /nfs/dbraw/zinc/70/17/36/1096701736.db2.gz OFBODZWTIFUPHH-ALKREAHSSA-N 2 0 359.311 4.256 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000423482052 1096703426 /nfs/dbraw/zinc/70/34/26/1096703426.db2.gz XONFIEMTHBGHFO-TVLQYADYSA-N 2 0 370.512 4.309 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)ccc1OC(F)F ZINC000423494503 1096706444 /nfs/dbraw/zinc/70/64/44/1096706444.db2.gz AQPSULWBBGORBA-RHSMWYFYSA-N 2 0 364.436 4.427 20 0 FIADRP COc1cc(OC)c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1Cl ZINC000423496699 1096707971 /nfs/dbraw/zinc/70/79/71/1096707971.db2.gz FKDMDSNMELJTKH-KBXCAEBGSA-N 2 0 362.901 4.488 20 0 FIADRP [NH3+]C1(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C2CC3CC(C2)CC1C3 ZINC000423530377 1096709252 /nfs/dbraw/zinc/70/92/52/1096709252.db2.gz RHIRQZLREOUVQO-RNVGKXKPSA-N 2 0 372.528 4.037 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000423515708 1096711254 /nfs/dbraw/zinc/71/12/54/1096711254.db2.gz SVLXDMBHFUWVIF-UHYGZKCKSA-N 2 0 350.840 4.425 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCNCC3)CC2)cc1 ZINC000423519488 1096712087 /nfs/dbraw/zinc/71/20/87/1096712087.db2.gz PUXRYJYHWWBYTA-QHGAOEGBSA-N 2 0 361.599 4.054 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000423518627 1096712117 /nfs/dbraw/zinc/71/21/17/1096712117.db2.gz PFLOXMMJLDLOSJ-UEQSERJNSA-N 3 0 363.549 4.252 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423538783 1096715472 /nfs/dbraw/zinc/71/54/72/1096715472.db2.gz HDOYKSJLFXIEGK-XZYOPWHXSA-N 2 0 368.496 4.096 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C2CC2)c1 ZINC000423544597 1096717494 /nfs/dbraw/zinc/71/74/94/1096717494.db2.gz OMWJSYJSADJAHU-KYHPRHEASA-N 2 0 354.416 4.014 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc2ccccc2c1OC(F)F ZINC000423547926 1096718226 /nfs/dbraw/zinc/71/82/26/1096718226.db2.gz QNNPPVQQLGFGHR-QSPRXWTASA-N 2 0 360.448 4.480 20 0 FIADRP Brc1ccc([C@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccco2)cc1 ZINC000423546137 1096718609 /nfs/dbraw/zinc/71/86/09/1096718609.db2.gz YTUPWCWSYFXVJK-SFHVURJKSA-N 2 0 361.283 4.031 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423551176 1096720421 /nfs/dbraw/zinc/72/04/21/1096720421.db2.gz TZWRJORJNMJKCS-UDTPNQRGSA-N 2 0 355.551 4.466 20 0 FIADRP CC(C)N(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(C)C ZINC000515518345 1098656848 /nfs/dbraw/zinc/65/68/48/1098656848.db2.gz GBVMETATKKGWLA-UXHICEINSA-N 2 0 373.585 4.042 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]Cc2cn(-c3ccccc3)nc2C(C)(C)C)CC1 ZINC000533070118 1098737355 /nfs/dbraw/zinc/73/73/55/1098737355.db2.gz NAUJHYHVENPIES-UHFFFAOYSA-N 2 0 368.569 4.380 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000436237989 1098844693 /nfs/dbraw/zinc/84/46/93/1098844693.db2.gz IDSJVFBCWPMXAE-DHIUTWEWSA-N 2 0 364.533 4.069 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000436233726 1098858198 /nfs/dbraw/zinc/85/81/98/1098858198.db2.gz TVTLEZASLNVVED-YADHBBJMSA-N 2 0 352.522 4.095 20 0 FIADRP CSc1ccc(CC[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000436289741 1098903452 /nfs/dbraw/zinc/90/34/52/1098903452.db2.gz HDUBOXHUSYKIIA-QGZVFWFLSA-N 2 0 358.551 4.242 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2)c1 ZINC000515761950 1098919548 /nfs/dbraw/zinc/91/95/48/1098919548.db2.gz IMKGOACLQXCDFR-INIZCTEOSA-N 2 0 373.928 4.299 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1C ZINC000533309929 1098945842 /nfs/dbraw/zinc/94/58/42/1098945842.db2.gz GTOKMHSWBWKSFH-UKRRQHHQSA-N 2 0 372.340 4.127 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000515846349 1098978972 /nfs/dbraw/zinc/97/89/72/1098978972.db2.gz VUSQXTJGJACWER-JXFKEZNVSA-N 2 0 372.484 4.083 20 0 FIADRP C[C@H](Cc1ccccc1Br)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000436470768 1099046029 /nfs/dbraw/zinc/04/60/29/1099046029.db2.gz ORPBGZLEIODBDI-OAHLLOKOSA-N 2 0 374.326 4.034 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccc(-n2ccnc2)cc1 ZINC000516436051 1099465935 /nfs/dbraw/zinc/46/59/35/1099465935.db2.gz NXWWEXVYNKTZBC-CYBMUJFWSA-N 2 0 361.367 4.464 20 0 FIADRP CSCc1cccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000614992642 1099494940 /nfs/dbraw/zinc/49/49/40/1099494940.db2.gz MJVHRKMKTUYXIJ-UHFFFAOYSA-N 2 0 370.562 4.314 20 0 FIADRP CC(C)(C)OC(=O)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167961705 1099596296 /nfs/dbraw/zinc/59/62/96/1099596296.db2.gz NJEVBVIDJBWSID-SEJPIABJSA-N 2 0 370.537 4.137 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000516689869 1099727635 /nfs/dbraw/zinc/72/76/35/1099727635.db2.gz LLWBASXNKNNBFG-PUYZDKHRSA-N 2 0 350.453 4.296 20 0 FIADRP C[NH2+]CCc1ccccc1C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000516773625 1099790186 /nfs/dbraw/zinc/79/01/86/1099790186.db2.gz XQEPPPXWPBXTJL-GOSISDBHSA-N 2 0 365.521 4.075 20 0 FIADRP C[C@H](CN(C)Cc1ccccc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693257 1099825886 /nfs/dbraw/zinc/82/58/86/1099825886.db2.gz CQOQVFOKGYJMOR-ZFGGDYGUSA-N 2 0 365.565 4.007 20 0 FIADRP CCOCc1ccccc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508694347 1099826012 /nfs/dbraw/zinc/82/60/12/1099826012.db2.gz CPYNMDKYTMWMRC-SIKLNZKXSA-N 2 0 352.522 4.223 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccccc1F ZINC000508692886 1099826121 /nfs/dbraw/zinc/82/61/21/1099826121.db2.gz BPZUNCCJIVRRJS-QWFCFKBJSA-N 2 0 356.485 4.093 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000162535624 1099830519 /nfs/dbraw/zinc/83/05/19/1099830519.db2.gz WJCHEKPYEYQEOI-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162554873 1099841988 /nfs/dbraw/zinc/84/19/88/1099841988.db2.gz ASJCPOMYGNAREV-HNNXBMFYSA-N 2 0 362.514 4.339 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000508702556 1099855477 /nfs/dbraw/zinc/85/54/77/1099855477.db2.gz ZKXCZHZWMQHWIP-MKWLTTDUSA-N 2 0 358.570 4.470 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)c(Cl)c1 ZINC000162569391 1099863853 /nfs/dbraw/zinc/86/38/53/1099863853.db2.gz QKKMTWJPAHHBLL-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CN[C@H]2CC[NH+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000516866863 1099896333 /nfs/dbraw/zinc/89/63/33/1099896333.db2.gz UZUMPINZNKEABM-PKTZIBPZSA-N 2 0 369.597 4.141 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@H](C)C(C)(C)c3ccccc3)CC2)oc1C ZINC000162724045 1099976139 /nfs/dbraw/zinc/97/61/39/1099976139.db2.gz FPGXIRUXQMBNAP-LJQANCHMSA-N 2 0 369.553 4.459 20 0 FIADRP Cc1nc(CN2CCC(C[NH2+][C@@H]3CCc4c3cccc4C)CC2)oc1C ZINC000162730936 1099976150 /nfs/dbraw/zinc/97/61/50/1099976150.db2.gz ORBPYYMPDARBGS-OAQYLSRUSA-N 2 0 353.510 4.089 20 0 FIADRP C[C@H](Nc1ccc(N2CCCC2)cn1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516998734 1099977966 /nfs/dbraw/zinc/97/79/66/1099977966.db2.gz XLSLOKSOUMTZRS-ICSRJNTNSA-N 2 0 350.510 4.004 20 0 FIADRP C[C@@H](Nc1ccc(N2CCCC2)cn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516998736 1099978564 /nfs/dbraw/zinc/97/85/64/1099978564.db2.gz XLSLOKSOUMTZRS-UYAOXDASSA-N 2 0 350.510 4.004 20 0 FIADRP COc1ccc(Cl)cc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162772797 1099996536 /nfs/dbraw/zinc/99/65/36/1099996536.db2.gz ZKHUPKVOZCMVNR-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP CC[N@H+](Cc1scnc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000536671930 1100155922 /nfs/dbraw/zinc/15/59/22/1100155922.db2.gz URPQXPRZSOMAEC-UHFFFAOYSA-N 2 0 373.570 4.164 20 0 FIADRP CO[C@H](c1ccc(Cl)cc1)[C@@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459447352 1100183576 /nfs/dbraw/zinc/18/35/76/1100183576.db2.gz QJKGZTUBIWMIKR-QRWLVFNGSA-N 2 0 359.901 4.070 20 0 FIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000536695423 1100196319 /nfs/dbraw/zinc/19/63/19/1100196319.db2.gz BDJOJENUHJIZMC-NRFANRHFSA-N 2 0 374.532 4.189 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000379628415 1100245384 /nfs/dbraw/zinc/24/53/84/1100245384.db2.gz IXHGKJJKKQZJSB-WOIUINJBSA-N 2 0 352.522 4.356 20 0 FIADRP CCn1cc([C@H](C)[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000536827315 1100325720 /nfs/dbraw/zinc/32/57/20/1100325720.db2.gz OHJWUCHZUMIOTR-IBGZPJMESA-N 2 0 354.542 4.246 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)CC1 ZINC000459589241 1100330677 /nfs/dbraw/zinc/33/06/77/1100330677.db2.gz XYGFOMUQMWDAAY-JOCHJYFZSA-N 2 0 355.570 4.020 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccccc1C(C)(C)C ZINC000536833635 1100345367 /nfs/dbraw/zinc/34/53/67/1100345367.db2.gz NXXMHVPAVJEIEU-KRWDZBQOSA-N 2 0 355.526 4.170 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536849932 1100363435 /nfs/dbraw/zinc/36/34/35/1100363435.db2.gz CBZLDBKSNAQGEO-GBESFXJTSA-N 2 0 371.352 4.412 20 0 FIADRP C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000536853081 1100366596 /nfs/dbraw/zinc/36/65/96/1100366596.db2.gz PTQGAGZMGXCRAE-LIRRHRJNSA-N 2 0 360.885 4.065 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536857630 1100371060 /nfs/dbraw/zinc/37/10/60/1100371060.db2.gz LSVBYFLMPRIDOD-BZUAXINKSA-N 2 0 358.448 4.245 20 0 FIADRP Brc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000536861376 1100377638 /nfs/dbraw/zinc/37/76/38/1100377638.db2.gz CVKAMSAAHNCKCM-IBGZPJMESA-N 2 0 363.343 4.433 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CCCc2cccnc2)CC1 ZINC000459652834 1100395935 /nfs/dbraw/zinc/39/59/35/1100395935.db2.gz QVRQBYIKQFPSJM-LEWJYISDSA-N 2 0 365.565 4.478 20 0 FIADRP COCC[NH+]1CCC(N[C@H](c2ccsc2)c2ccc(Cl)cc2)CC1 ZINC000536876954 1100400400 /nfs/dbraw/zinc/40/04/00/1100400400.db2.gz MGFQHWRRTDZKKP-IBGZPJMESA-N 2 0 364.942 4.191 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)C[C@H]1CCCC[C@@H]1[NH3+])C1CCCCC1 ZINC000517571616 1100507227 /nfs/dbraw/zinc/50/72/27/1100507227.db2.gz ZDMOUPQDAGUYSO-XLIONFOSSA-N 2 0 357.542 4.297 20 0 FIADRP CC(C)[C@H](C(=O)Nc1cccc(C[NH+]2CCCCC2)c1)[NH+]1CCCCC1 ZINC000517827098 1100698036 /nfs/dbraw/zinc/69/80/36/1100698036.db2.gz PPLUTCOYZBAMTI-OAQYLSRUSA-N 2 0 357.542 4.122 20 0 FIADRP CC(C)[C@@H](C(=O)Nc1cccc(C[NH+]2CCCCC2)c1)[NH+]1CCCCC1 ZINC000517827097 1100698192 /nfs/dbraw/zinc/69/81/92/1100698192.db2.gz PPLUTCOYZBAMTI-NRFANRHFSA-N 2 0 357.542 4.122 20 0 FIADRP CC1([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC[NH2+]CC1 ZINC000414941266 1100852389 /nfs/dbraw/zinc/85/23/89/1100852389.db2.gz LIQWAEQLGGNUFU-UHFFFAOYSA-N 2 0 365.340 4.409 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@@H]1OCCc2sccc21 ZINC000426308180 1101241119 /nfs/dbraw/zinc/24/11/19/1101241119.db2.gz VDNJEOLFCQDSDX-MRUHUIDDSA-N 2 0 374.550 4.042 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000536962215 1101358480 /nfs/dbraw/zinc/35/84/80/1101358480.db2.gz GEEHBCSEELEDGV-BEFAXECRSA-N 2 0 372.384 4.306 20 0 FIADRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCc2cccnc2)cc1 ZINC000537024562 1101402601 /nfs/dbraw/zinc/40/26/01/1101402601.db2.gz PVUUPHVVHNLJAW-GHTZIAJQSA-N 2 0 353.510 4.186 20 0 FIADRP Cn1cnc2cc(CN3CC[C@@H]4[C@@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc21 ZINC000537202877 1101555980 /nfs/dbraw/zinc/55/59/80/1101555980.db2.gz CBPXYUQCRYLGNF-JTHBVZDNSA-N 2 0 374.532 4.060 20 0 FIADRP Clc1ccc(CNC2CC[NH+](C3CCC3)CC2)cc1Br ZINC000537284383 1101604546 /nfs/dbraw/zinc/60/45/46/1101604546.db2.gz HTIQQLZMKWZTIT-UHFFFAOYSA-N 2 0 357.723 4.209 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000537293672 1101614579 /nfs/dbraw/zinc/61/45/79/1101614579.db2.gz ABRWAARVWNPBON-RXVVDRJESA-N 2 0 363.565 4.166 20 0 FIADRP C[NH+]1CCC(N2CC[C@H]([NH2+][C@@H]3CC=C(c4ccc(Cl)cc4)CC3)C2)CC1 ZINC000648450468 1101719194 /nfs/dbraw/zinc/71/91/94/1101719194.db2.gz NJXYQCCGHPEASS-RTWAWAEBSA-N 2 0 373.972 4.034 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1OCC ZINC000415009022 1102043383 /nfs/dbraw/zinc/04/33/83/1102043383.db2.gz SZONBTMRHIUBKC-GDBMZVCRSA-N 2 0 354.922 4.135 20 0 FIADRP OCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cccc2ccccc21 ZINC001167967154 1102274982 /nfs/dbraw/zinc/27/49/82/1102274982.db2.gz DPYHLBNTSAUFCE-UKKFODGLSA-N 2 0 364.533 4.258 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(=O)OC)cc1 ZINC000550782927 1102281428 /nfs/dbraw/zinc/28/14/28/1102281428.db2.gz BSDWOKIBEAJXAY-LRQRDZAKSA-N 2 0 358.526 4.167 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)ccc1SC ZINC000120949429 1102287757 /nfs/dbraw/zinc/28/77/57/1102287757.db2.gz WSNJRIDMDPAKLS-CQSZACIVSA-N 2 0 362.514 4.469 20 0 FIADRP CCOc1cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc(C(F)(F)F)c1 ZINC001204742765 1102342893 /nfs/dbraw/zinc/34/28/93/1102342893.db2.gz UAZLBRSBLQNXOL-UHFFFAOYSA-N 2 0 356.432 4.070 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000532457486 1102358198 /nfs/dbraw/zinc/35/81/98/1102358198.db2.gz QXGJZQIPBGQCES-QFIPXVFZSA-N 2 0 350.506 4.458 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c(Cl)c1 ZINC000532461120 1102361292 /nfs/dbraw/zinc/36/12/92/1102361292.db2.gz ZRFKZPOPFRYBKG-CQSZACIVSA-N 2 0 365.949 4.264 20 0 FIADRP Cc1cc(Br)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167969258 1102366494 /nfs/dbraw/zinc/36/64/94/1102366494.db2.gz AVPDWGLZIFBRCO-YQQQUEKLSA-N 2 0 363.343 4.253 20 0 FIADRP Cc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)ccc1Br ZINC001167969843 1102403779 /nfs/dbraw/zinc/40/37/79/1102403779.db2.gz FXAYLLJHONURQC-AYHJJNSGSA-N 2 0 363.343 4.253 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4Cl)cc2)CC1 ZINC000532485184 1102426012 /nfs/dbraw/zinc/42/60/12/1102426012.db2.gz KYOTXFVYVYDJFV-QFIPXVFZSA-N 2 0 370.924 4.074 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000121791669 1102437754 /nfs/dbraw/zinc/43/77/54/1102437754.db2.gz XVXOWEHJHRUBSR-JOCHJYFZSA-N 2 0 350.506 4.240 20 0 FIADRP Fc1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CCOCC2)c1 ZINC001167971240 1102439889 /nfs/dbraw/zinc/43/98/89/1102439889.db2.gz UQKAFVBGCSZKRS-GLCCWIKHSA-N 2 0 372.528 4.288 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H](CC2CC2)c2ccccc2)(N2CCCCC2)CC1 ZINC000532524878 1102442793 /nfs/dbraw/zinc/44/27/93/1102442793.db2.gz QNRGNPUXZSGSFL-QFIPXVFZSA-N 2 0 355.570 4.068 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H](CC2CC2)c2ccccc2)CC1 ZINC000532550288 1102463623 /nfs/dbraw/zinc/46/36/23/1102463623.db2.gz DVVOIBDKDDTJIB-XMMPIXPASA-N 2 0 364.533 4.274 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCOc2ccc(F)cc2F)cc1 ZINC000532550255 1102464168 /nfs/dbraw/zinc/46/41/68/1102464168.db2.gz ZXPHYJJNNGIQFQ-AWEZNQCLSA-N 2 0 357.404 4.189 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000122361924 1102578891 /nfs/dbraw/zinc/57/88/91/1102578891.db2.gz UDHQXKMXDWMEBV-FQEVSTJZSA-N 2 0 366.505 4.163 20 0 FIADRP COc1ccc(Br)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000537646895 1102639722 /nfs/dbraw/zinc/63/97/22/1102639722.db2.gz CGUNRGOFZWFEDA-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550886439 1102658309 /nfs/dbraw/zinc/65/83/09/1102658309.db2.gz PDTVVMMAYCVIDK-RJGXRXQPSA-N 2 0 370.581 4.330 20 0 FIADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550886442 1102658665 /nfs/dbraw/zinc/65/86/65/1102658665.db2.gz PDTVVMMAYCVIDK-VJBWXMMDSA-N 2 0 370.581 4.330 20 0 FIADRP CC[C@H]1CN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC[C@H]1[NH3+] ZINC000666657043 1102675681 /nfs/dbraw/zinc/67/56/81/1102675681.db2.gz KSJBPMYHIWELGI-FXAWDEMLSA-N 2 0 372.557 4.042 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCCO2 ZINC000123001409 1102732223 /nfs/dbraw/zinc/73/22/23/1102732223.db2.gz FABZBCHBTANVFW-JOCHJYFZSA-N 2 0 366.505 4.295 20 0 FIADRP COc1ccc2oc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cc2c1 ZINC000122999779 1102732931 /nfs/dbraw/zinc/73/29/31/1102732931.db2.gz CWMQBDAIZDRJJP-UHFFFAOYSA-N 2 0 350.462 4.327 20 0 FIADRP c1ccc(Oc2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)nc1 ZINC001167978566 1102745613 /nfs/dbraw/zinc/74/56/13/1102745613.db2.gz PDGLSOJZQAAWTD-SEJPIABJSA-N 2 0 363.505 4.369 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@@H]2CCC[NH+]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000551051575 1102864138 /nfs/dbraw/zinc/86/41/38/1102864138.db2.gz RFQSEFCPURWJIC-HJOGWXRNSA-N 2 0 363.549 4.076 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123202355 1102881794 /nfs/dbraw/zinc/88/17/94/1102881794.db2.gz XVFPJOWSGBXKHD-GOSISDBHSA-N 2 0 373.585 4.192 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550263042 1102884277 /nfs/dbraw/zinc/88/42/77/1102884277.db2.gz TXJDBJUKPQNNND-FCEUIQTBSA-N 2 0 356.554 4.084 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2nc3cc(C(F)(F)F)ccc3o2)CC1 ZINC000123231593 1102891700 /nfs/dbraw/zinc/89/17/00/1102891700.db2.gz CDRMRCSOQSBXKB-UHFFFAOYSA-N 2 0 369.431 4.400 20 0 FIADRP CCC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CC1 ZINC000550270764 1102902119 /nfs/dbraw/zinc/90/21/19/1102902119.db2.gz BRHBUOCCZNANJB-GTMAMOSYSA-N 2 0 370.581 4.474 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000133011198 1102928263 /nfs/dbraw/zinc/92/82/63/1102928263.db2.gz SHGOWHAWPXISPN-MSOLQXFVSA-N 2 0 362.583 4.339 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1OCC(C)C ZINC000506907623 1102942042 /nfs/dbraw/zinc/94/20/42/1102942042.db2.gz HQPAEQWVJZDPEG-UHFFFAOYSA-N 2 0 360.542 4.038 20 0 FIADRP Clc1cccc(CC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1Cl ZINC000459370480 1102943628 /nfs/dbraw/zinc/94/36/28/1102943628.db2.gz IQGBRZJZENNAOY-UHFFFAOYSA-N 2 0 350.293 4.190 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000551264678 1103025652 /nfs/dbraw/zinc/02/56/52/1103025652.db2.gz LDHYVSSCXFFFRH-GOSISDBHSA-N 2 0 360.546 4.133 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)ccn1 ZINC000551270090 1103030691 /nfs/dbraw/zinc/03/06/91/1103030691.db2.gz KTORZXXQLMZOPE-FHWLQOOXSA-N 2 0 367.537 4.419 20 0 FIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)CC1 ZINC000729681965 1103036543 /nfs/dbraw/zinc/03/65/43/1103036543.db2.gz CQNYEWGLFVUAGP-UHFFFAOYSA-N 2 0 356.485 4.226 20 0 FIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)[C@H](O)Cc1ccccc1 ZINC000551316881 1103073866 /nfs/dbraw/zinc/07/38/66/1103073866.db2.gz NVQNQYWHZUNPAX-OIULLBJASA-N 2 0 366.549 4.011 20 0 FIADRP Cc1nc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)sc1C ZINC000551316503 1103074954 /nfs/dbraw/zinc/07/49/54/1103074954.db2.gz HTFUZNOHKLFLSO-UHFFFAOYSA-N 2 0 357.567 4.335 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(C(F)(F)F)cn1 ZINC000551394632 1103176671 /nfs/dbraw/zinc/17/66/71/1103176671.db2.gz KHSLHNBYJBHNME-BEFAXECRSA-N 2 0 363.427 4.101 20 0 FIADRP CC(C)([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Br)cc1 ZINC001168356412 1103281862 /nfs/dbraw/zinc/28/18/62/1103281862.db2.gz RJPFKJBPDCOTQK-UHFFFAOYSA-N 2 0 351.332 4.148 20 0 FIADRP Fc1ccc(COc2cccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)c2)cc1 ZINC000666995580 1103347413 /nfs/dbraw/zinc/34/74/13/1103347413.db2.gz SLAJUJQRCOWQNR-HXUWFJFHSA-N 2 0 354.469 4.169 20 0 FIADRP Fc1cccc(COc2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)cc2)c1 ZINC000666998554 1103371136 /nfs/dbraw/zinc/37/11/36/1103371136.db2.gz ZYPYMILLTVPRAK-HXUWFJFHSA-N 2 0 354.469 4.169 20 0 FIADRP CCc1cccnc1[C@@H](C)[NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000507513183 1103454076 /nfs/dbraw/zinc/45/40/76/1103454076.db2.gz RCLUOHYTHWPIOJ-LJQANCHMSA-N 2 0 367.537 4.012 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000551779176 1103627468 /nfs/dbraw/zinc/62/74/68/1103627468.db2.gz RJQALZFIFKYGJI-PEVILPJXSA-N 2 0 364.533 4.299 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)[C@H](C)C2 ZINC000551813408 1103695426 /nfs/dbraw/zinc/69/54/26/1103695426.db2.gz LQTACXRLENFTTQ-KOSHJBKYSA-N 2 0 364.533 4.491 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CC(c4cccc(F)c4)C3)cc2)CC1 ZINC000551814429 1103697204 /nfs/dbraw/zinc/69/72/04/1103697204.db2.gz ZRQAUAMWLXHIAU-UHFFFAOYSA-N 2 0 368.496 4.335 20 0 FIADRP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000188037488 1103784599 /nfs/dbraw/zinc/78/45/99/1103784599.db2.gz CWFHNLLFRMTANF-CVDCTZTESA-N 2 0 356.554 4.317 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(OC)c(OC)c2C)cc1 ZINC000519843104 1103898094 /nfs/dbraw/zinc/89/80/94/1103898094.db2.gz PYDNVNLVHJSVSW-UHFFFAOYSA-N 2 0 356.510 4.144 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCCSc1ccccc1Cl ZINC000441201923 1104195650 /nfs/dbraw/zinc/19/56/50/1104195650.db2.gz FRZMIDHCFUCRDJ-NJAFHUGGSA-N 2 0 368.974 4.006 20 0 FIADRP Clc1ccc(SCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441397534 1104330778 /nfs/dbraw/zinc/33/07/78/1104330778.db2.gz WSNYSMXVGLJFSA-KXBFYZLASA-N 2 0 350.959 4.381 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cc1 ZINC000112524921 1104374408 /nfs/dbraw/zinc/37/44/08/1104374408.db2.gz XAEMHGDTPWASBH-KSZLIROESA-N 2 0 356.485 4.286 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)o2)cc1 ZINC000647976681 1104484007 /nfs/dbraw/zinc/48/40/07/1104484007.db2.gz RZXJLUBFSBBHOK-IAGOWNOFSA-N 2 0 359.901 4.207 20 0 FIADRP c1ccc(C[NH+](C2CCOCC2)C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995384 1104498266 /nfs/dbraw/zinc/49/82/66/1104498266.db2.gz DAEYUEBAPHQSRO-AIZNXBIQSA-N 2 0 354.538 4.073 20 0 FIADRP CSCc1cccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000188725056 1104752021 /nfs/dbraw/zinc/75/20/21/1104752021.db2.gz PYJGVHFBBFDIBJ-QGZVFWFLSA-N 2 0 358.551 4.341 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2Cn2ccnc2)CC1 ZINC000520459682 1104760319 /nfs/dbraw/zinc/76/03/19/1104760319.db2.gz CGVCGCATMWWJIF-WMZHIEFXSA-N 2 0 366.553 4.064 20 0 FIADRP CC[C@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000391584447 1105013509 /nfs/dbraw/zinc/01/35/09/1105013509.db2.gz PYWCCRBRQZZXPX-RBUKOAKNSA-N 2 0 372.384 4.306 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000391584444 1105013707 /nfs/dbraw/zinc/01/37/07/1105013707.db2.gz PYWCCRBRQZZXPX-OALUTQOASA-N 2 0 372.384 4.306 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000388829656 1105044476 /nfs/dbraw/zinc/04/44/76/1105044476.db2.gz WZJIUXFKGGPFMS-QKLQHJQFSA-N 2 0 356.485 4.396 20 0 FIADRP C[N@H+](CCOc1cccc(Cl)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000441629606 1105048488 /nfs/dbraw/zinc/04/84/88/1105048488.db2.gz XFWRRQOHGGAHNO-LJQANCHMSA-N 2 0 358.913 4.173 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152371045 1105056862 /nfs/dbraw/zinc/05/68/62/1105056862.db2.gz OQORAKVVXMZLFL-ZFWWWQNUSA-N 2 0 359.514 4.393 20 0 FIADRP CC(C)[NH+]1CCC(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168008172 1105171600 /nfs/dbraw/zinc/17/16/00/1105171600.db2.gz CYAGCHROUWFXSQ-PMACEKPBSA-N 3 0 357.586 4.138 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000152426454 1105173737 /nfs/dbraw/zinc/17/37/37/1105173737.db2.gz CRSFCTZBWZCCCZ-KBXCAEBGSA-N 2 0 371.525 4.401 20 0 FIADRP CC[C@@H]1C[C@H](C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCO1 ZINC000507809872 1105176017 /nfs/dbraw/zinc/17/60/17/1105176017.db2.gz FQEQHJPFZFDARW-KAOXLYBCSA-N 2 0 356.554 4.178 20 0 FIADRP CCC[N@@H+]1CC[C@@H](NC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000665193197 1105197068 /nfs/dbraw/zinc/19/70/68/1105197068.db2.gz QDELRDZDTJPSNZ-LJQANCHMSA-N 2 0 372.557 4.057 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3-c3ccnn3C)C2)CC1 ZINC000507834268 1105240947 /nfs/dbraw/zinc/24/09/47/1105240947.db2.gz SIBUYRQZOQMPDJ-FQEVSTJZSA-N 2 0 366.553 4.031 20 0 FIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1F ZINC000665240451 1105257629 /nfs/dbraw/zinc/25/76/29/1105257629.db2.gz LKCVGTJEFLSVPN-BAGYTPMASA-N 2 0 354.469 4.368 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCC[C@@H](C)C2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000508204653 1105358271 /nfs/dbraw/zinc/35/82/71/1105358271.db2.gz IHDBRZNQAMWRHO-YRXWBPOGSA-N 2 0 357.542 4.118 20 0 FIADRP [NH3+][C@H]1C[C@@H]([NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c2ccccc21 ZINC000530209559 1106913603 /nfs/dbraw/zinc/91/36/03/1106913603.db2.gz IQJYJOGXNSFYNN-VQTJNVASSA-N 2 0 366.509 4.127 20 0 FIADRP CC1(C)C[C@H]([NH2+]CCCCn2ccnc2)c2cc(Br)ccc21 ZINC000530321684 1106965232 /nfs/dbraw/zinc/96/52/32/1106965232.db2.gz IERARYQHJJJEBW-KRWDZBQOSA-N 2 0 362.315 4.438 20 0 FIADRP Cc1cc(N2CCC([NH+]3CCCC3)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301567669 1107072091 /nfs/dbraw/zinc/07/20/91/1107072091.db2.gz ZOOUNXGUZYTQAZ-UHFFFAOYSA-N 2 0 361.436 4.209 20 0 FIADRP C[C@@H]([NH2+]CCc1ccccc1OC(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530513408 1107105741 /nfs/dbraw/zinc/10/57/41/1107105741.db2.gz WAZSFDIVKLHGFQ-YLJYHZDGSA-N 2 0 374.475 4.331 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530544688 1107127276 /nfs/dbraw/zinc/12/72/76/1107127276.db2.gz UQUPTBAOKNHDNC-RCZSKKKRSA-N 2 0 350.506 4.319 20 0 FIADRP Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530544686 1107127344 /nfs/dbraw/zinc/12/73/44/1107127344.db2.gz UQUPTBAOKNHDNC-CZTZKLFOSA-N 2 0 350.506 4.319 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)ccc1OCc1ccccc1 ZINC000530674113 1107247161 /nfs/dbraw/zinc/24/71/61/1107247161.db2.gz RDLMYCHASRIKSU-NHCUHLMSSA-N 2 0 368.521 4.237 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152434191 1107452478 /nfs/dbraw/zinc/45/24/78/1107452478.db2.gz KZVGBAQAQQCUGX-MBSDFSHPSA-N 2 0 368.496 4.192 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152468530 1107775591 /nfs/dbraw/zinc/77/55/91/1107775591.db2.gz YSDKGPANRGLMSL-KDOFPFPSSA-N 2 0 371.525 4.401 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)nc1 ZINC000179100494 1107791990 /nfs/dbraw/zinc/79/19/90/1107791990.db2.gz NULCRIUVBQRAEB-BBWFWOEESA-N 2 0 373.928 4.195 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1OCc1ccccc1 ZINC000531389918 1107842691 /nfs/dbraw/zinc/84/26/91/1107842691.db2.gz XTHAOBUTPZRSHP-LEWJYISDSA-N 2 0 368.521 4.237 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)nc1 ZINC000179106715 1107874079 /nfs/dbraw/zinc/87/40/79/1107874079.db2.gz BELHCHBYUWGYDM-INIZCTEOSA-N 2 0 361.917 4.306 20 0 FIADRP C[C@H]([NH2+]CCc1cccc2cccnc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000531687625 1108051542 /nfs/dbraw/zinc/05/15/42/1108051542.db2.gz SWYBUFCBUMDVJK-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000531705509 1108084366 /nfs/dbraw/zinc/08/43/66/1108084366.db2.gz CZEWRWWHWABVMI-KSFYIVLOSA-N 2 0 356.485 4.179 20 0 FIADRP Cc1cc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc(C)c1F ZINC000531709794 1108088473 /nfs/dbraw/zinc/08/84/73/1108088473.db2.gz YMNCDMOFXRGEPQ-UGKGYDQZSA-N 2 0 369.528 4.082 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)CC(=O)Nc1ccccc1C ZINC000531726010 1108097287 /nfs/dbraw/zinc/09/72/87/1108097287.db2.gz ZBSJOVDVZKFZLQ-SVFBPWRDSA-N 2 0 359.558 4.202 20 0 FIADRP COC1([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCOCC1 ZINC000453077263 1108149380 /nfs/dbraw/zinc/14/93/80/1108149380.db2.gz XXGBDIOSICNDLT-LJQANCHMSA-N 2 0 374.569 4.125 20 0 FIADRP CCn1ccnc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000453105152 1108173159 /nfs/dbraw/zinc/17/31/59/1108173159.db2.gz FFOJYIHYVIGBDY-INIZCTEOSA-N 2 0 360.933 4.119 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(-c3ccccc3)nn2C)c1 ZINC000453112016 1108179373 /nfs/dbraw/zinc/17/93/73/1108179373.db2.gz SJNBCNKBWMXDFE-SFHVURJKSA-N 2 0 362.521 4.390 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1 ZINC000453211781 1108283153 /nfs/dbraw/zinc/28/31/53/1108283153.db2.gz OCNRMGNRMQWWOB-KSZLIROESA-N 2 0 352.444 4.362 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H](NC3CC([NH+]4CCCCC4)C3)[C@@H]3CCC[C@@H]32)cc1 ZINC000453220878 1108291866 /nfs/dbraw/zinc/29/18/66/1108291866.db2.gz PKMMWUFFTDZDES-ISEXJNJKSA-N 2 0 367.581 4.036 20 0 FIADRP FC(F)(F)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)C1 ZINC000453229984 1108304648 /nfs/dbraw/zinc/30/46/48/1108304648.db2.gz PLUJAIGXIQFFIN-CPLYBDICSA-N 2 0 352.444 4.360 20 0 FIADRP CC[C@H](COCC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453265154 1108338722 /nfs/dbraw/zinc/33/87/22/1108338722.db2.gz XHKSGOWZOVSTHT-MKXGPGLRSA-N 2 0 370.459 4.129 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2=CCOCC2)c2ccc(F)cc2)CC1 ZINC000453283034 1108358913 /nfs/dbraw/zinc/35/89/13/1108358913.db2.gz HUSAILAGOYUBHE-JOCHJYFZSA-N 2 0 360.517 4.315 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC(C)(C)CO)c2ccc(F)cc2)CC1 ZINC000453285329 1108360370 /nfs/dbraw/zinc/36/03/70/1108360370.db2.gz XIZSIALZDSYKIX-NRFANRHFSA-N 2 0 364.549 4.377 20 0 FIADRP CC(C)c1ccc(CC[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cc1 ZINC000531932862 1108402459 /nfs/dbraw/zinc/40/24/59/1108402459.db2.gz MSEUYPSOUGGJJK-AUSIDOKSSA-N 2 0 351.538 4.248 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000531936105 1108410326 /nfs/dbraw/zinc/41/03/26/1108410326.db2.gz CMRLWPBPUARYKA-RTBURBONSA-N 2 0 354.542 4.486 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CCOC4(CCC4)C2)C3)cc1 ZINC000453326615 1108418796 /nfs/dbraw/zinc/41/87/96/1108418796.db2.gz VGOZFWJZPVQTLT-YUMYIRISSA-N 2 0 354.538 4.121 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCc4ccccc43)CC2)cc1 ZINC000531949507 1108431583 /nfs/dbraw/zinc/43/15/83/1108431583.db2.gz KMTVVHSGSHERHR-QHCPKHFHSA-N 2 0 350.506 4.184 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC[C@@]4(CCSC4)C2)C3)cc1 ZINC000453353460 1108452903 /nfs/dbraw/zinc/45/29/03/1108452903.db2.gz JEPVYILWXPZJAY-CIAFKFPVSA-N 2 0 356.579 4.401 20 0 FIADRP COc1ccc([C@@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)cc1C[NH+]1CCCCC1 ZINC000453365430 1108480146 /nfs/dbraw/zinc/48/01/46/1108480146.db2.gz LYRGSEZIVOUPIU-XXBNENTESA-N 2 0 372.553 4.245 20 0 FIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000531971170 1108483035 /nfs/dbraw/zinc/48/30/35/1108483035.db2.gz BOLJYRRHCXNJMN-SBUREZEXSA-N 2 0 368.496 4.323 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)Oc1cccc(C(F)(F)F)c1 ZINC000531979222 1108496919 /nfs/dbraw/zinc/49/69/19/1108496919.db2.gz ZBQHZYLMKRBCMN-GZOSKZMVSA-N 2 0 358.448 4.181 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000453445858 1108539899 /nfs/dbraw/zinc/53/98/99/1108539899.db2.gz ZVPOXAYAMHNDOD-GFOJFJKKSA-N 2 0 370.562 4.468 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc(Cl)c1OC ZINC000523863738 1108612613 /nfs/dbraw/zinc/61/26/13/1108612613.db2.gz YMSYNXLVCIHTJJ-KRWDZBQOSA-N 2 0 356.938 4.203 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC000532105358 1108661460 /nfs/dbraw/zinc/66/14/60/1108661460.db2.gz UYPSJOZFYWXFOA-SFHVURJKSA-N 2 0 369.528 4.249 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)C1 ZINC000524639944 1109101409 /nfs/dbraw/zinc/10/14/09/1109101409.db2.gz AJXZYEJCOHSRLF-JOCHJYFZSA-N 2 0 352.522 4.130 20 0 FIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000524968813 1109223921 /nfs/dbraw/zinc/22/39/21/1109223921.db2.gz RRMUVKBCWRUCCI-ROUUACIJSA-N 2 0 374.500 4.373 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[C@H]([NH+]3CCCC3)C2)c1C ZINC000525193332 1109304066 /nfs/dbraw/zinc/30/40/66/1109304066.db2.gz GJPOGUAHFSUUEW-INIZCTEOSA-N 2 0 374.326 4.289 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446752992 1109329696 /nfs/dbraw/zinc/32/96/96/1109329696.db2.gz QTLHBFPSRNNMMB-QHCPKHFHSA-N 2 0 357.586 4.234 20 0 FIADRP Clc1cc(Cl)c2c(c1)C=C(C[NH2+]CC1CC[NH+](C3CC3)CC1)CO2 ZINC000446886883 1109383223 /nfs/dbraw/zinc/38/32/23/1109383223.db2.gz LFGLXASSXMEIIV-UHFFFAOYSA-N 2 0 367.320 4.233 20 0 FIADRP C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887717 1109383973 /nfs/dbraw/zinc/38/39/73/1109383973.db2.gz XQAYALQIHVRLRT-OAHLLOKOSA-N 2 0 352.469 4.073 20 0 FIADRP C[N@H+](CC/C=C/c1ccc(Br)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000525518129 1109410590 /nfs/dbraw/zinc/41/05/90/1109410590.db2.gz YSCXEGCPAHMOLH-ZNNBYXKUSA-N 2 0 351.332 4.126 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(C)o1 ZINC000447560710 1109581510 /nfs/dbraw/zinc/58/15/10/1109581510.db2.gz FGFQAXQRMCVTMO-LJQANCHMSA-N 2 0 355.526 4.149 20 0 FIADRP COC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447563479 1109582965 /nfs/dbraw/zinc/58/29/65/1109582965.db2.gz QAAAYCKXEVCNRD-JLLPCOHGSA-N 2 0 364.533 4.029 20 0 FIADRP Fc1ccccc1NCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447603298 1109599504 /nfs/dbraw/zinc/59/95/04/1109599504.db2.gz XJQMAFYDVFKXAU-MZADTFQBSA-N 2 0 367.512 4.413 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(F)cc1OC ZINC000527641599 1109792198 /nfs/dbraw/zinc/79/21/98/1109792198.db2.gz WJJSRHRGOOKDRG-UHFFFAOYSA-N 2 0 374.500 4.363 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc4cc[nH]c4c3)CC2)cc1 ZINC000527647323 1109794896 /nfs/dbraw/zinc/79/48/96/1109794896.db2.gz CDVWZXBHMGGAQS-UHFFFAOYSA-N 2 0 363.505 4.178 20 0 FIADRP CC(C)c1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000527883622 1109848834 /nfs/dbraw/zinc/84/88/34/1109848834.db2.gz DLUFUVQCYJGIPZ-JPYJTQIMSA-N 2 0 352.522 4.227 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cn1 ZINC000528044864 1109897486 /nfs/dbraw/zinc/89/74/86/1109897486.db2.gz VZSDJAAORDKGNB-FRGLQRNOSA-N 2 0 365.521 4.042 20 0 FIADRP COCc1ccccc1C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449068205 1109971831 /nfs/dbraw/zinc/97/18/31/1109971831.db2.gz AMPZBEKHTSHEKM-IBGZPJMESA-N 2 0 352.522 4.018 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc3ccoc32)C[C@H](C)O1 ZINC000449108970 1109977456 /nfs/dbraw/zinc/97/74/56/1109977456.db2.gz UNUJXVJHTJLUHA-ROUUACIJSA-N 2 0 364.489 4.332 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc3ccoc32)C[C@@H](C)O1 ZINC000449108969 1109977491 /nfs/dbraw/zinc/97/74/91/1109977491.db2.gz UNUJXVJHTJLUHA-QZTJIDSGSA-N 2 0 364.489 4.332 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449127210 1109981191 /nfs/dbraw/zinc/98/11/91/1109981191.db2.gz OKDRYGSAMVMFSB-UXHICEINSA-N 2 0 366.549 4.399 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC(NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000449219041 1110000007 /nfs/dbraw/zinc/00/00/07/1110000007.db2.gz MCTFMFSQFBUYTE-WIYYLYMNSA-N 2 0 371.594 4.036 20 0 FIADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000449343041 1110035026 /nfs/dbraw/zinc/03/50/26/1110035026.db2.gz HFXDGLUAUMKDHU-PZJWPPBQSA-N 2 0 358.570 4.330 20 0 FIADRP Cc1cc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cs1 ZINC000449346447 1110036440 /nfs/dbraw/zinc/03/64/40/1110036440.db2.gz ZLAKZPSVIBEGQR-OAQYLSRUSA-N 2 0 370.562 4.075 20 0 FIADRP CC[C@H](COCC(F)(F)F)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449377439 1110051062 /nfs/dbraw/zinc/05/10/62/1110051062.db2.gz AEDRFJZXTJOIKY-SJLPKXTDSA-N 2 0 372.475 4.029 20 0 FIADRP CC(C)[C@@H]1C[C@@H](C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449490111 1110091680 /nfs/dbraw/zinc/09/16/80/1110091680.db2.gz BNPAOOJFBOTPNI-RRPUWOKSSA-N 2 0 358.570 4.123 20 0 FIADRP CC(C)c1nnc(CN2CCC(C[N@H+](C)Cc3ccccc3)CC2)s1 ZINC000450344803 1110285697 /nfs/dbraw/zinc/28/56/97/1110285697.db2.gz IYWBUWPIHCIIBR-UHFFFAOYSA-N 2 0 358.555 4.006 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCc1cccs1)c1ccccc1O2 ZINC000538307070 1111087676 /nfs/dbraw/zinc/08/76/76/1111087676.db2.gz SIOMOZJEKGWXFN-LJQANCHMSA-N 2 0 356.535 4.259 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H](Nc2cccc(C[NH+]3CCCCC3)c2)[C@H](C)C1 ZINC000538498325 1111160434 /nfs/dbraw/zinc/16/04/34/1111160434.db2.gz WKUNCNNHBHQQJH-OFNKIYASSA-N 2 0 373.585 4.221 20 0 FIADRP CC[N@@H+](Cc1c[nH]nc1-c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538764143 1111291362 /nfs/dbraw/zinc/29/13/62/1111291362.db2.gz PIDXZDIEHNFCBU-NRFANRHFSA-N 2 0 374.532 4.421 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc(-c2ccccc2)cs1 ZINC000538795879 1111294149 /nfs/dbraw/zinc/29/41/49/1111294149.db2.gz BOOIXUMFJGNSGM-HLAWJBBLSA-N 2 0 356.535 4.099 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccccc2Br)[C@@H](C)C1 ZINC000539053397 1111401393 /nfs/dbraw/zinc/40/13/93/1111401393.db2.gz FYAWWTPEQSRAGQ-WMLDXEAASA-N 2 0 353.348 4.047 20 0 FIADRP C[C@@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082591 1111424805 /nfs/dbraw/zinc/42/48/05/1111424805.db2.gz INXYWRMXWPGZFR-QGZVFWFLSA-N 2 0 352.478 4.267 20 0 FIADRP Clc1cccc(OCC[NH2+]C2CCN(c3ccccn3)CC2)c1Cl ZINC000539090604 1111427468 /nfs/dbraw/zinc/42/74/68/1111427468.db2.gz HBBPWUBXLWOWMO-UHFFFAOYSA-N 2 0 366.292 4.026 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000539218631 1111480501 /nfs/dbraw/zinc/48/05/01/1111480501.db2.gz XMPNSUFRAYNJDA-DNVJHFABSA-N 2 0 374.544 4.415 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)CC1 ZINC000552048408 1111557555 /nfs/dbraw/zinc/55/75/55/1111557555.db2.gz RITVLYBRTKEXFN-MNMPARFZSA-N 2 0 356.554 4.223 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)c(Cl)c1 ZINC000477918991 1111609347 /nfs/dbraw/zinc/60/93/47/1111609347.db2.gz QRXUZLRZFFRGDD-INIZCTEOSA-N 2 0 365.949 4.077 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2COc3ccccc3C2)CC1 ZINC000552252794 1111644793 /nfs/dbraw/zinc/64/47/93/1111644793.db2.gz XVJGUGLIJBGFAF-ATKRNPRHSA-N 2 0 350.506 4.023 20 0 FIADRP Cc1nc2ccccn2c1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552273803 1111654589 /nfs/dbraw/zinc/65/45/89/1111654589.db2.gz SKHUEVFQUXXYJG-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP CC(C)C1CCC([NH+]2CCN([C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)CC1 ZINC000552281377 1111658575 /nfs/dbraw/zinc/65/85/75/1111658575.db2.gz TYLINTIFHVNPSG-KXTRFFEISA-N 2 0 369.597 4.093 20 0 FIADRP CCC[N@H+](C)[C@H](CNC1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000552325374 1111670188 /nfs/dbraw/zinc/67/01/88/1111670188.db2.gz UDAWHMOMADYRRQ-HXUWFJFHSA-N 2 0 351.966 4.185 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)ccc1F ZINC000478205722 1111713781 /nfs/dbraw/zinc/71/37/81/1111713781.db2.gz LIHOGQSESPAGLR-UHFFFAOYSA-N 2 0 372.484 4.132 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)cc1F ZINC000478252959 1111725521 /nfs/dbraw/zinc/72/55/21/1111725521.db2.gz HYPGLDHELSMJCE-UHFFFAOYSA-N 2 0 372.484 4.132 20 0 FIADRP Cc1cc(C)cc(CC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000553149964 1111918550 /nfs/dbraw/zinc/91/85/50/1111918550.db2.gz RWKYXBCJFSUFMF-QFIPXVFZSA-N 2 0 364.533 4.424 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479285167 1111981786 /nfs/dbraw/zinc/98/17/86/1111981786.db2.gz PMBPDKJFQFURFE-HXUWFJFHSA-N 2 0 373.338 4.470 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)CC1 ZINC000479338738 1111999115 /nfs/dbraw/zinc/99/91/15/1111999115.db2.gz UIRIBRYFFYCRFD-JOCHJYFZSA-N 2 0 366.553 4.351 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000479529914 1112053743 /nfs/dbraw/zinc/05/37/43/1112053743.db2.gz RSAHSJMNBPWPQB-FAHLNCGFSA-N 2 0 367.512 4.357 20 0 FIADRP COc1cc([C@H](C)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c(F)cn1 ZINC000554049919 1112175653 /nfs/dbraw/zinc/17/56/53/1112175653.db2.gz YDJVFMZEKIRKSW-SJORKVTESA-N 2 0 371.500 4.312 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCO[C@H](C(F)(F)F)C2)CC1 ZINC000554049186 1112176265 /nfs/dbraw/zinc/17/62/65/1112176265.db2.gz LXHUQNRWZUUEPR-OALUTQOASA-N 2 0 370.459 4.118 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccccc1 ZINC000554349837 1112311384 /nfs/dbraw/zinc/31/13/84/1112311384.db2.gz QKUMFHNCOSVRLB-QHCPKHFHSA-N 2 0 352.522 4.396 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)c3ccsc3)CC2)c1 ZINC000480229458 1112339723 /nfs/dbraw/zinc/33/97/23/1112339723.db2.gz OYIOUTFFDRFCDF-LJQANCHMSA-N 2 0 357.567 4.310 20 0 FIADRP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000480243860 1112341649 /nfs/dbraw/zinc/34/16/49/1112341649.db2.gz WMEGSOFSCBASAI-IECBHUPTSA-N 2 0 364.533 4.381 20 0 FIADRP C[C@H](CCCC(F)(F)F)[NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000480252436 1112350541 /nfs/dbraw/zinc/35/05/41/1112350541.db2.gz UWUIBEWPSDQYEC-MJGOQNOKSA-N 2 0 371.491 4.076 20 0 FIADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000480252515 1112350787 /nfs/dbraw/zinc/35/07/87/1112350787.db2.gz USQBPFAIKWSZNE-LUCIHVKJSA-N 2 0 364.533 4.319 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc2c(c1)OCO2 ZINC000480262514 1112365157 /nfs/dbraw/zinc/36/51/57/1112365157.db2.gz KONVUMRRPYCBCB-GOSISDBHSA-N 2 0 366.505 4.498 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(Cl)cn1 ZINC000480339177 1112388553 /nfs/dbraw/zinc/38/85/53/1112388553.db2.gz WCMYNHHRCYILLO-ZACQAIPSSA-N 2 0 373.928 4.195 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(Br)c(Cl)s2)CC1 ZINC000480343076 1112394455 /nfs/dbraw/zinc/39/44/55/1112394455.db2.gz KTCNWPSIEVORKY-UHFFFAOYSA-N 2 0 365.768 4.376 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1)N1CC[NH+](C)CC1 ZINC000480534670 1112464792 /nfs/dbraw/zinc/46/47/92/1112464792.db2.gz DSEGDZOGYACDCQ-RDPSFJRHSA-N 2 0 365.565 4.276 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1)N1CC[NH+](C)CC1 ZINC000480538645 1112467003 /nfs/dbraw/zinc/46/70/03/1112467003.db2.gz SBFPIQXYYQNOET-RDPSFJRHSA-N 2 0 365.565 4.276 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)N1CC[NH+](C)CC1 ZINC000480548515 1112470392 /nfs/dbraw/zinc/47/03/92/1112470392.db2.gz JONLSYPHQSIMBI-GHTZIAJQSA-N 2 0 371.594 4.338 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480608498 1112499153 /nfs/dbraw/zinc/49/91/53/1112499153.db2.gz LFWQYAJSWPRNDU-CEXWTWQISA-N 2 0 374.573 4.235 20 0 FIADRP CC(C)C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521338 1112500427 /nfs/dbraw/zinc/50/04/27/1112500427.db2.gz MVZRHMRMLSROLR-INIZCTEOSA-N 2 0 359.341 4.048 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)nnn1-c1ccc(C)cc1 ZINC000480612899 1112501052 /nfs/dbraw/zinc/50/10/52/1112501052.db2.gz ODDCVVXQHBKVJU-RBUKOAKNSA-N 2 0 369.557 4.189 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000480604880 1112504974 /nfs/dbraw/zinc/50/49/74/1112504974.db2.gz GCOFDOOYFDFTKW-HZPDHXFCSA-N 2 0 352.494 4.148 20 0 FIADRP C[C@H](C[NH+]1CCCCCC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000480701931 1112562053 /nfs/dbraw/zinc/56/20/53/1112562053.db2.gz VCHTZRKNOSJPNO-SNWXZZBVSA-N 2 0 355.570 4.036 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC000480711601 1112565531 /nfs/dbraw/zinc/56/55/31/1112565531.db2.gz HGKHVCJGSOGOLP-QFIPXVFZSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480755255 1112588148 /nfs/dbraw/zinc/58/81/48/1112588148.db2.gz GNGLXXYPOSAXAS-MJBXVCDLSA-N 2 0 357.325 4.223 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCCCC1 ZINC000480757681 1112589818 /nfs/dbraw/zinc/58/98/18/1112589818.db2.gz LTMRCFMMPGWCGT-RBBKRZOGSA-N 2 0 358.570 4.474 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C[C@@H](C)O1 ZINC000480832540 1112632023 /nfs/dbraw/zinc/63/20/23/1112632023.db2.gz KDTYQFKZPXUHBQ-DNVFCKCGSA-N 2 0 370.512 4.394 20 0 FIADRP Cc1ccc(C(=O)CC[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000480854921 1112637936 /nfs/dbraw/zinc/63/79/36/1112637936.db2.gz UZMNTKHRRVQZKV-UHFFFAOYSA-N 2 0 365.521 4.201 20 0 FIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000480914693 1112668177 /nfs/dbraw/zinc/66/81/77/1112668177.db2.gz VFOMUZMYYHTFRX-YADARESESA-N 2 0 363.549 4.162 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000480914692 1112668423 /nfs/dbraw/zinc/66/84/23/1112668423.db2.gz VFOMUZMYYHTFRX-NTKDMRAZSA-N 2 0 363.549 4.162 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2CO[C@H](C3CC3)C2)cc1 ZINC000667778283 1112670713 /nfs/dbraw/zinc/67/07/13/1112670713.db2.gz ZFWXMVVPDCICIP-GGAORHGYSA-N 2 0 350.506 4.072 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccs1 ZINC000480908246 1112672334 /nfs/dbraw/zinc/67/23/34/1112672334.db2.gz HPMVRVDPZVYMHN-NRFANRHFSA-N 2 0 371.594 4.373 20 0 FIADRP Cc1ccccc1CN1CCC([NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000481306787 1112880023 /nfs/dbraw/zinc/88/00/23/1112880023.db2.gz NAKMVCGROFNVTB-FQEVSTJZSA-N 2 0 374.532 4.496 20 0 FIADRP Cc1cc(Cl)cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000555586884 1112933247 /nfs/dbraw/zinc/93/32/47/1112933247.db2.gz JDNUMDAJYIVBJS-UHFFFAOYSA-N 2 0 358.913 4.411 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000481540685 1112973245 /nfs/dbraw/zinc/97/32/45/1112973245.db2.gz HFKHFTAVUCXZBI-HXUWFJFHSA-N 2 0 374.532 4.435 20 0 FIADRP FC(F)(F)Oc1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000899874705 1113037652 /nfs/dbraw/zinc/03/76/52/1113037652.db2.gz JFZQEDPRACKMBC-QWHCGFSZSA-N 2 0 351.372 4.172 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000899878411 1113042031 /nfs/dbraw/zinc/04/20/31/1113042031.db2.gz PMESEDMCLPTFMP-CQSZACIVSA-N 2 0 365.399 4.198 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481711076 1113050591 /nfs/dbraw/zinc/05/05/91/1113050591.db2.gz DEJVGALNOCWKTC-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000481943030 1113136256 /nfs/dbraw/zinc/13/62/56/1113136256.db2.gz DYASQBIGVUHUCK-BAGYTPMASA-N 2 0 369.553 4.163 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851407 1113144332 /nfs/dbraw/zinc/14/43/32/1113144332.db2.gz GQSJXLIVJHLZKP-QHCPKHFHSA-N 2 0 363.549 4.035 20 0 FIADRP c1csc(CN2CCC[C@@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)c1 ZINC000482131241 1113184464 /nfs/dbraw/zinc/18/44/64/1113184464.db2.gz WWAVYYGBNOUZGL-FXAWDEMLSA-N 2 0 356.535 4.464 20 0 FIADRP C[C@@H]([NH2+]CCCc1ccc2c(c1)CCO2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000482220798 1113202413 /nfs/dbraw/zinc/20/24/13/1113202413.db2.gz NPJLHWSDVKZDCZ-AUSIDOKSSA-N 2 0 364.533 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccccc2Cl)[C@@H](C)C1 ZINC000482236613 1113206286 /nfs/dbraw/zinc/20/62/86/1113206286.db2.gz ASMMRCJABMSOPW-FXAWDEMLSA-N 2 0 366.977 4.344 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1OC ZINC000482433639 1113253271 /nfs/dbraw/zinc/25/32/71/1113253271.db2.gz CWKVAGBFXQDVDK-RBBKRZOGSA-N 2 0 352.522 4.301 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CCCO2 ZINC000482438999 1113259973 /nfs/dbraw/zinc/25/99/73/1113259973.db2.gz NWLQIUWJEUXNBY-GMAHTHKFSA-N 2 0 364.533 4.363 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000482454240 1113265266 /nfs/dbraw/zinc/26/52/66/1113265266.db2.gz WZHJONFODZVXLX-TZIWHRDSSA-N 2 0 352.547 4.378 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000482519350 1113282801 /nfs/dbraw/zinc/28/28/01/1113282801.db2.gz NHNAGLWEJVAHSI-BEFAXECRSA-N 2 0 372.384 4.308 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482548654 1113290857 /nfs/dbraw/zinc/29/08/57/1113290857.db2.gz NCMLQXAHWQQHHW-VGSWGCGISA-N 2 0 367.512 4.306 20 0 FIADRP CCC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482547798 1113293923 /nfs/dbraw/zinc/29/39/23/1113293923.db2.gz AMEINVSNZWDVKF-LJQANCHMSA-N 2 0 372.384 4.452 20 0 FIADRP C[C@H]([NH2+]CCCc1c[nH]c2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000482644192 1113318954 /nfs/dbraw/zinc/31/89/54/1113318954.db2.gz SGNAAQFCEAXMFS-SFHVURJKSA-N 2 0 365.521 4.392 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2c3ccccc3sc21 ZINC000482866610 1113381220 /nfs/dbraw/zinc/38/12/20/1113381220.db2.gz MDSXKEQSFHUWHL-APWZRJJASA-N 2 0 358.551 4.105 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2c3ccccc3sc21 ZINC000482866613 1113381302 /nfs/dbraw/zinc/38/13/02/1113381302.db2.gz MDSXKEQSFHUWHL-VQIMIIECSA-N 2 0 358.551 4.105 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000482870159 1113384065 /nfs/dbraw/zinc/38/40/65/1113384065.db2.gz DPGZVXAJSHFIKH-GOSISDBHSA-N 2 0 366.505 4.042 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cc(F)cc(F)c1 ZINC000482868917 1113388748 /nfs/dbraw/zinc/38/87/48/1113388748.db2.gz MGEFKFRBSAWIHZ-INIZCTEOSA-N 2 0 360.448 4.290 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486535283 1113591297 /nfs/dbraw/zinc/59/12/97/1113591297.db2.gz JBOBSMPTCQVGHJ-XLIONFOSSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486535284 1113591338 /nfs/dbraw/zinc/59/13/38/1113591338.db2.gz JBOBSMPTCQVGHJ-YLJYHZDGSA-N 2 0 374.475 4.331 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(Cl)cc2C)CC1 ZINC000488266145 1113894105 /nfs/dbraw/zinc/89/41/05/1113894105.db2.gz IVGNRICFNPCHOJ-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP Cc1ccc([C@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)cc1 ZINC000491033683 1114364595 /nfs/dbraw/zinc/36/45/95/1114364595.db2.gz FQPKDIXYJZSQPM-QFIPXVFZSA-N 2 0 372.940 4.032 20 0 FIADRP Brc1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c2ncccc12 ZINC000491114596 1114372020 /nfs/dbraw/zinc/37/20/20/1114372020.db2.gz VYEZSSOYQVVQDJ-CQSZACIVSA-N 2 0 371.282 4.100 20 0 FIADRP Cc1ccc(C[NH2+]CCC[N@H+](C)Cc2ccccc2)c(-c2cnn(C)c2)c1 ZINC000570936298 1114416360 /nfs/dbraw/zinc/41/63/60/1114416360.db2.gz YUDQKAFIQRCLBU-UHFFFAOYSA-N 2 0 362.521 4.007 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2nn(C)c3ccccc23)cc1 ZINC000589640738 1114819456 /nfs/dbraw/zinc/81/94/56/1114819456.db2.gz OZHFLCCETZOEHE-GOSISDBHSA-N 2 0 362.521 4.238 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2csc(Br)c2)C1 ZINC000589837002 1114846940 /nfs/dbraw/zinc/84/69/40/1114846940.db2.gz UUHLPYSVDRZWTE-KBPBESRZSA-N 2 0 359.377 4.358 20 0 FIADRP c1c(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2n1Cc1ccccc1 ZINC000590611267 1114952925 /nfs/dbraw/zinc/95/29/25/1114952925.db2.gz DTLBNZVGTCDUOR-FQEVSTJZSA-N 2 0 359.517 4.264 20 0 FIADRP FC(F)(F)[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000573034443 1115002611 /nfs/dbraw/zinc/00/26/11/1115002611.db2.gz WJJGRLVCUCEBCE-RBUKOAKNSA-N 2 0 370.459 4.262 20 0 FIADRP CC(C)(C(=O)Nc1cccc(C[NH+]2CCCCC2)c1)[C@H]([NH3+])c1ccccc1 ZINC000573115742 1115045760 /nfs/dbraw/zinc/04/57/60/1115045760.db2.gz LIYZZYZUPYQXAE-OAQYLSRUSA-N 2 0 365.521 4.337 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CCC[C@H]([NH+]4CCCC4)C3)c2cc1OCC ZINC000591652204 1115119528 /nfs/dbraw/zinc/11/95/28/1115119528.db2.gz ULLSATLCRLIKTI-KRWDZBQOSA-N 2 0 369.509 4.097 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000479872169 1115249760 /nfs/dbraw/zinc/24/97/60/1115249760.db2.gz HIVWGHGDCGTGNS-QZTJIDSGSA-N 2 0 360.546 4.132 20 0 FIADRP CCOc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1OC(F)F ZINC000061003191 1115748394 /nfs/dbraw/zinc/74/83/94/1115748394.db2.gz HOAMRMRFGKJEOG-UHFFFAOYSA-N 2 0 356.457 4.086 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1F ZINC000669679728 1115774511 /nfs/dbraw/zinc/77/45/11/1115774511.db2.gz NTGZFPYPDHEKAU-QGZVFWFLSA-N 2 0 356.485 4.356 20 0 FIADRP [NH3+]C1(Cc2ccccc2Cl)CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416403 1115854337 /nfs/dbraw/zinc/85/43/37/1115854337.db2.gz XTNUGXBSJNNDIY-FQEVSTJZSA-N 2 0 372.915 4.372 20 0 FIADRP Cc1ccc(O[C@@H](C)C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000608065363 1116080428 /nfs/dbraw/zinc/08/04/28/1116080428.db2.gz QLEPBJGVGZUVRV-FQEVSTJZSA-N 2 0 368.521 4.027 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000535082818 1116265843 /nfs/dbraw/zinc/26/58/43/1116265843.db2.gz NZULKYQXLHWTMF-UHFFFAOYSA-N 2 0 354.542 4.041 20 0 FIADRP CCN(Cc1cc(OC)cc(C)n1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000535286134 1116290419 /nfs/dbraw/zinc/29/04/19/1116290419.db2.gz YONXTHZMBJKOJH-GHTZIAJQSA-N 2 0 353.510 4.056 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000462658702 1116383930 /nfs/dbraw/zinc/38/39/30/1116383930.db2.gz PXWUVAVJHGGMBB-UHFFFAOYSA-N 2 0 373.491 4.446 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000539852018 1116392941 /nfs/dbraw/zinc/39/29/41/1116392941.db2.gz JTFZZIZZZKFTTI-UHFFFAOYSA-N 2 0 360.590 4.343 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000539898431 1117740504 /nfs/dbraw/zinc/74/05/04/1117740504.db2.gz QTBJBCQNBOVJRK-JTHBVZDNSA-N 2 0 369.597 4.093 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000462789432 1117773508 /nfs/dbraw/zinc/77/35/08/1117773508.db2.gz JWHMMENFGAZQSJ-KRWDZBQOSA-N 2 0 356.485 4.499 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H]2CCN(c3ccccc3F)C2)CC1 ZINC000462801559 1117784517 /nfs/dbraw/zinc/78/45/17/1117784517.db2.gz CKQSURSHAWEUPS-XQBPLPMBSA-N 2 0 373.560 4.285 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462804156 1117786497 /nfs/dbraw/zinc/78/64/97/1117786497.db2.gz CVGQDNJELSZTOW-RUEOWNRQSA-N 2 0 351.332 4.013 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000462803689 1117786841 /nfs/dbraw/zinc/78/68/41/1117786841.db2.gz CDYRIXNRZRDHLD-SIKLNZKXSA-N 2 0 362.533 4.395 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CNc1cc[nH+]c2ccccc12 ZINC000462875456 1117833500 /nfs/dbraw/zinc/83/35/00/1117833500.db2.gz MGPMMLHIRWBRAX-UHFFFAOYSA-N 2 0 357.457 4.494 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(C(C)(C)C)cc1 ZINC000540142636 1117894587 /nfs/dbraw/zinc/89/45/87/1117894587.db2.gz CNJBIYHYIAAZBH-KRWDZBQOSA-N 2 0 355.526 4.170 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000540144547 1117896216 /nfs/dbraw/zinc/89/62/16/1117896216.db2.gz ZMFBSSMJKAGGSS-IRFCIJBXSA-N 2 0 354.542 4.415 20 0 FIADRP COc1ccc([C@H](OC)[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)cc1 ZINC000540146658 1117898136 /nfs/dbraw/zinc/89/81/36/1117898136.db2.gz KDFSLKKXKXWJIL-MYEKKWIISA-N 2 0 374.569 4.404 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)C[C@@H]1C ZINC000463105733 1117966419 /nfs/dbraw/zinc/96/64/19/1117966419.db2.gz HCRAKCGXIWYQQO-ICSRJNTNSA-N 2 0 356.558 4.320 20 0 FIADRP CCc1ccc([C@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)C(C)C)cc1 ZINC000540319356 1117982435 /nfs/dbraw/zinc/98/24/35/1117982435.db2.gz ZQZPSUVAIZIKHI-JOCHJYFZSA-N 2 0 355.526 4.071 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]C2CCN(CCC(F)(F)F)CC2)cc1 ZINC000463137842 1117986130 /nfs/dbraw/zinc/98/61/30/1117986130.db2.gz UAQHTUYGQBPSJX-UHFFFAOYSA-N 2 0 371.491 4.035 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCN(CCC(F)(F)F)CC1 ZINC000463140427 1117986584 /nfs/dbraw/zinc/98/65/84/1117986584.db2.gz HFOKEGWOGHVQSQ-UHFFFAOYSA-N 2 0 371.491 4.035 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1nccs1 ZINC000540394210 1118028097 /nfs/dbraw/zinc/02/80/97/1118028097.db2.gz IZUOSPRGEGLDIJ-KSZLIROESA-N 2 0 373.566 4.003 20 0 FIADRP Cc1nc2ccccc2n1CCCCC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000463198702 1118029955 /nfs/dbraw/zinc/02/99/55/1118029955.db2.gz WQIYQTBEOWCTSM-YOFSQIOKSA-N 2 0 354.542 4.072 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3CCCc4cc(F)ccc43)c2)CCO1 ZINC000540408560 1118038235 /nfs/dbraw/zinc/03/82/35/1118038235.db2.gz MCWHGMVKJYZPLL-SBUREZEXSA-N 2 0 368.496 4.214 20 0 FIADRP C[C@H]1C[C@H]([N@H+](C)Cc2ccc3c(c2)ncn3C)CCN1Cc1ccccc1 ZINC000540482643 1118081848 /nfs/dbraw/zinc/08/18/48/1118081848.db2.gz AXFIFSDFLDTXFF-GHTZIAJQSA-N 2 0 362.521 4.058 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCOc1ccccc1)c1ccccc1O2 ZINC000540468503 1118083679 /nfs/dbraw/zinc/08/36/79/1118083679.db2.gz SYQDQOAWJYIUIJ-NRFANRHFSA-N 2 0 366.505 4.033 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)Oc1ccccc1 ZINC000540493479 1118091684 /nfs/dbraw/zinc/09/16/84/1118091684.db2.gz BAMTVGHIAHMYNP-GHTZIAJQSA-N 2 0 366.505 4.032 20 0 FIADRP Cc1ccc(CC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540501756 1118103793 /nfs/dbraw/zinc/10/37/93/1118103793.db2.gz SELNPTZBEIIAEO-OAQYLSRUSA-N 2 0 350.506 4.115 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)C[C@@H]1C ZINC000540548439 1118120275 /nfs/dbraw/zinc/12/02/75/1118120275.db2.gz UXEDXITUXVNQAH-PZJWPPBQSA-N 2 0 374.569 4.187 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)[C@@H](C)C1 ZINC000540551851 1118123488 /nfs/dbraw/zinc/12/34/88/1118123488.db2.gz VORAGIPJXIHYBE-SIKLNZKXSA-N 2 0 374.569 4.044 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000540988455 1118339336 /nfs/dbraw/zinc/33/93/36/1118339336.db2.gz LLWSMKWGBKXXDS-IRLDBZIGSA-N 2 0 370.924 4.074 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000541083926 1118376050 /nfs/dbraw/zinc/37/60/50/1118376050.db2.gz ALMXIWBJTGGMQY-HXUWFJFHSA-N 2 0 373.585 4.464 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)CC2)cc1 ZINC000464070103 1118429855 /nfs/dbraw/zinc/42/98/55/1118429855.db2.gz ITBNTGCXWDMDHU-YTFSRNRJSA-N 2 0 356.554 4.084 20 0 FIADRP COc1ccc(Oc2ccc(C[N@H+](C)C[C@H]3CCC[NH+](C)C3)cc2)cc1 ZINC000541537891 1118546197 /nfs/dbraw/zinc/54/61/97/1118546197.db2.gz UDQFBVZUDQSBKF-IBGZPJMESA-N 2 0 354.494 4.261 20 0 FIADRP Fc1ccc2c(c1)CC[C@@H]([NH+]1CCC3(C[NH+](Cc4ccccc4)C3)CC1)C2 ZINC001168438341 1118548135 /nfs/dbraw/zinc/54/81/35/1118548135.db2.gz ADVOLQWGTKIUTO-HSZRJFAPSA-N 2 0 364.508 4.281 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000541548440 1118551770 /nfs/dbraw/zinc/55/17/70/1118551770.db2.gz DLWCNRROEDHMMP-QFIPXVFZSA-N 2 0 351.469 4.395 20 0 FIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(-c2ccccc2)s1 ZINC000541745718 1118624136 /nfs/dbraw/zinc/62/41/36/1118624136.db2.gz QGJVNAYAMKHFKK-KRWDZBQOSA-N 2 0 357.567 4.092 20 0 FIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000464779036 1118691433 /nfs/dbraw/zinc/69/14/33/1118691433.db2.gz OTZJLZVPVSRWDT-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC/C=C\c2ccc(Br)cc2)C1 ZINC000464791422 1118699685 /nfs/dbraw/zinc/69/96/85/1118699685.db2.gz TWRVHSBXBYWBJU-AATOQMJSSA-N 2 0 351.332 4.126 20 0 FIADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCCOc2cccc(C(F)(F)F)c2)C1 ZINC000464791401 1118699907 /nfs/dbraw/zinc/69/99/07/1118699907.db2.gz SSEHWKSZHYYQHN-MRXNPFEDSA-N 2 0 358.448 4.138 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)C(C)(C)c1ccccc1 ZINC000541915167 1118706432 /nfs/dbraw/zinc/70/64/32/1118706432.db2.gz BAVGBTAOJLQHMC-WMZHIEFXSA-N 2 0 366.549 4.099 20 0 FIADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000541917584 1118707447 /nfs/dbraw/zinc/70/74/47/1118707447.db2.gz AIEXBDGABZVLAC-GOSISDBHSA-N 2 0 365.521 4.482 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2nc3cc(F)ccc3o2)CC1 ZINC000464866302 1118729005 /nfs/dbraw/zinc/72/90/05/1118729005.db2.gz CUHRKNLIEIYNRP-UHFFFAOYSA-N 2 0 367.468 4.311 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc([C@@H]3CCCO3)s2)CC1 ZINC000542176607 1118836639 /nfs/dbraw/zinc/83/66/39/1118836639.db2.gz DSMRWFNLCGSOAH-IBGZPJMESA-N 2 0 365.587 4.329 20 0 FIADRP CC(C)(C)OC(=O)CCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000542256788 1118870768 /nfs/dbraw/zinc/87/07/68/1118870768.db2.gz BTALYPQQDOJMEL-UHFFFAOYSA-N 2 0 372.553 4.096 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2ccc(F)cc2)CC1 ZINC000303215168 1118875080 /nfs/dbraw/zinc/87/50/80/1118875080.db2.gz SVDKJUYNWBONBT-UHFFFAOYSA-N 2 0 356.485 4.049 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000492151683 1119035586 /nfs/dbraw/zinc/03/55/86/1119035586.db2.gz NCLHCFIOUVQRJG-UHFFFAOYSA-N 2 0 365.359 4.405 20 0 FIADRP CC(C)Oc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311704810 1119385222 /nfs/dbraw/zinc/38/52/22/1119385222.db2.gz VAQGWMPFZFZQKZ-SIKLNZKXSA-N 2 0 352.522 4.474 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311994857 1119397083 /nfs/dbraw/zinc/39/70/83/1119397083.db2.gz SSARSCPBBXKVOU-VQIMIIECSA-N 2 0 360.448 4.288 20 0 FIADRP CCc1ccc([C@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000493247977 1119434101 /nfs/dbraw/zinc/43/41/01/1119434101.db2.gz MQADCPUUSOOFNC-NRFANRHFSA-N 2 0 372.940 4.038 20 0 FIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000493904414 1119504441 /nfs/dbraw/zinc/50/44/41/1119504441.db2.gz DGVFWSRMWCNVRP-DYESRHJHSA-N 2 0 358.551 4.326 20 0 FIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]CCC1CC[NH+](C)CC1)CC2 ZINC000493936269 1119511540 /nfs/dbraw/zinc/51/15/40/1119511540.db2.gz KJFYBGNHBJLGJU-KRWDZBQOSA-N 2 0 351.332 4.066 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 ZINC000493934909 1119511708 /nfs/dbraw/zinc/51/17/08/1119511708.db2.gz GZIBMBSDYPZAJW-ZHNGQKSSSA-N 2 0 354.538 4.108 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000493944211 1119513001 /nfs/dbraw/zinc/51/30/01/1119513001.db2.gz HOZCOSPXFATLIQ-BHIFYINESA-N 2 0 354.538 4.110 20 0 FIADRP C[C@@H]1CC[N@H+](Cc2cccc(C[NH+]3CCS[C@@H](C)CC3)c2)CCS1 ZINC000494151957 1119547620 /nfs/dbraw/zinc/54/76/20/1119547620.db2.gz GMHCBNWHACVXLB-HDICACEKSA-N 2 0 364.624 4.341 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cncc(C)c2)CC1 ZINC000184346395 1119604518 /nfs/dbraw/zinc/60/45/18/1119604518.db2.gz XMGCDKIBFUJQFM-ZWKOTPCHSA-N 2 0 370.516 4.083 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)C1 ZINC000542477012 1119622991 /nfs/dbraw/zinc/62/29/91/1119622991.db2.gz AVUMZDCPNXEHDQ-XMSQKQJNSA-N 2 0 355.501 4.412 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cccc(-c2ccccc2)c1 ZINC000186594490 1119738838 /nfs/dbraw/zinc/73/88/38/1119738838.db2.gz MBBCBSJLJGKBQF-WOJBJXKFSA-N 2 0 351.538 4.030 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3F)CC2)C1 ZINC000542484736 1119904556 /nfs/dbraw/zinc/90/45/56/1119904556.db2.gz RXKFHUZGCULSHU-PBHICJAKSA-N 2 0 354.460 4.279 20 0 FIADRP CC(C)N(C)c1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cn1 ZINC000190760940 1119947954 /nfs/dbraw/zinc/94/79/54/1119947954.db2.gz AHQYINNFLLFBOI-UHFFFAOYSA-N 2 0 354.542 4.056 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cnn1C(C)C ZINC000191244763 1119967018 /nfs/dbraw/zinc/96/70/18/1119967018.db2.gz ZFVQPBAIVKGPMA-INIZCTEOSA-N 2 0 360.571 4.397 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000191528549 1119982018 /nfs/dbraw/zinc/98/20/18/1119982018.db2.gz RPBTZCYQZMFSBT-FQEVSTJZSA-N 2 0 369.534 4.133 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)C[N@@H+]1Cc1ccccc1 ZINC000494612399 1119995888 /nfs/dbraw/zinc/99/58/88/1119995888.db2.gz NCIDTDILVVJBHU-ZADIZFFCSA-N 2 0 368.565 4.224 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(Cc2ccccc2)c1 ZINC000195136421 1120120234 /nfs/dbraw/zinc/12/02/34/1120120234.db2.gz SVKGHSHVDXGSST-NZQKXSOJSA-N 2 0 374.532 4.104 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(Cc2ccccc2)c1 ZINC000195136435 1120120390 /nfs/dbraw/zinc/12/03/90/1120120390.db2.gz SVKGHSHVDXGSST-NFBKMPQASA-N 2 0 374.532 4.104 20 0 FIADRP CCc1nc2c(s1)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000195139679 1120120768 /nfs/dbraw/zinc/12/07/68/1120120768.db2.gz IXRMNANMJYPRGC-MSOLQXFVSA-N 2 0 355.551 4.195 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494774771 1120183421 /nfs/dbraw/zinc/18/34/21/1120183421.db2.gz LCSBGDPSHBXSFA-FUKQBSRTSA-N 2 0 352.522 4.263 20 0 FIADRP Brc1ccc(C2CC([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000193982986 1120224181 /nfs/dbraw/zinc/22/41/81/1120224181.db2.gz XTAFVCSDDWAQDD-UHFFFAOYSA-N 2 0 363.343 4.159 20 0 FIADRP C[N@H+](CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Cc1ccccc1 ZINC000494882555 1120356377 /nfs/dbraw/zinc/35/63/77/1120356377.db2.gz ZVHNQTKTABTBJB-REWPJTCUSA-N 2 0 370.512 4.405 20 0 FIADRP CC1CC[NH+](CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494916441 1120369077 /nfs/dbraw/zinc/36/90/77/1120369077.db2.gz IGHNLULHMGKCEP-SIKLNZKXSA-N 2 0 362.533 4.395 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494926305 1120381735 /nfs/dbraw/zinc/38/17/35/1120381735.db2.gz XEMCPGJZTQZQHF-VQQMMKBISA-N 2 0 362.533 4.251 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2C)C2CCCC2)CC1 ZINC000494925026 1120382094 /nfs/dbraw/zinc/38/20/94/1120382094.db2.gz SKKNKWPEQRESKN-HSZRJFAPSA-N 2 0 357.586 4.234 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCCN(Cc3cnc(-c4ccco4)s3)C2)CC1 ZINC000494999525 1120418686 /nfs/dbraw/zinc/41/86/86/1120418686.db2.gz UVCOCGZXFFFYEY-KRWDZBQOSA-N 2 0 359.539 4.347 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000495005692 1120426311 /nfs/dbraw/zinc/42/63/11/1120426311.db2.gz PCTWYNUAXLZEOC-IRXDYDNUSA-N 2 0 354.485 4.493 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000495089051 1120468732 /nfs/dbraw/zinc/46/87/32/1120468732.db2.gz XBZOKMYZHXXRHF-WOIUINJBSA-N 2 0 362.533 4.251 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)c1 ZINC000303020277 1120725497 /nfs/dbraw/zinc/72/54/97/1120725497.db2.gz QXJXJXHHMZBPKE-QFIPXVFZSA-N 2 0 365.521 4.132 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000495415654 1120792791 /nfs/dbraw/zinc/79/27/91/1120792791.db2.gz SCQIBWVTUMQCPE-TZYHBYERSA-N 2 0 374.544 4.488 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1OC ZINC000915228550 1120883860 /nfs/dbraw/zinc/88/38/60/1120883860.db2.gz FOYXHDJAHANNLW-JOCHJYFZSA-N 2 0 368.521 4.411 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC000542666278 1121024783 /nfs/dbraw/zinc/02/47/83/1121024783.db2.gz WZBMGDCOGVFYBU-AVRDEDQJSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000397504568 1121198019 /nfs/dbraw/zinc/19/80/19/1121198019.db2.gz HTGVJSQNEWIKAF-SFHVURJKSA-N 2 0 366.505 4.021 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000397541032 1121213808 /nfs/dbraw/zinc/21/38/08/1121213808.db2.gz AWRHWFSDIAEFEW-QGZVFWFLSA-N 2 0 358.551 4.043 20 0 FIADRP CCc1cc(C[N@@H+]2CCCC3(CC[NH+](Cc4ccccc4)CC3)C2)on1 ZINC001203227750 1121298810 /nfs/dbraw/zinc/29/88/10/1121298810.db2.gz ITGSHURORSFFJD-UHFFFAOYSA-N 2 0 353.510 4.115 20 0 FIADRP C[C@@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)CC1CCCCC1 ZINC001649060602 1121433380 /nfs/dbraw/zinc/43/33/80/1121433380.db2.gz PZGVUEGRNITQCH-OFNKIYASSA-N 2 0 357.586 4.171 20 0 FIADRP Brc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000166262903 1121466264 /nfs/dbraw/zinc/46/62/64/1121466264.db2.gz KXZMXNJILWYYTB-QZTJIDSGSA-N 2 0 363.343 4.087 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2OCCc3ccccc32)CC1 ZINC000671752043 1121738269 /nfs/dbraw/zinc/73/82/69/1121738269.db2.gz YJTFPBBFNOUMQK-UBVWURDFSA-N 2 0 364.533 4.333 20 0 FIADRP COc1ccc(OC)c([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000125453073 1121780270 /nfs/dbraw/zinc/78/02/70/1121780270.db2.gz PNKXGWVGYKMBNQ-INIZCTEOSA-N 2 0 374.550 4.328 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000671759910 1121785194 /nfs/dbraw/zinc/78/51/94/1121785194.db2.gz UWRGRCYEJTXCID-FRQCXROJSA-N 2 0 365.477 4.095 20 0 FIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000125614277 1121797626 /nfs/dbraw/zinc/79/76/26/1121797626.db2.gz AQNVUVGRPVRVIY-CVEARBPZSA-N 2 0 358.555 4.286 20 0 FIADRP CCCN(C)[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764440 1121797705 /nfs/dbraw/zinc/79/77/05/1121797705.db2.gz IWQIVHGFKUOXPP-OXJNMPFZSA-N 2 0 351.966 4.043 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)ccc1OC(F)F ZINC000125793356 1121838667 /nfs/dbraw/zinc/83/86/67/1121838667.db2.gz JXXDUMYNKKYPDB-GJZGRUSLSA-N 2 0 356.457 4.068 20 0 FIADRP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OCc2nccn2C)cc1 ZINC000125894881 1121863610 /nfs/dbraw/zinc/86/36/10/1121863610.db2.gz JXZSWGRMBAHIIS-XLIONFOSSA-N 2 0 372.557 4.016 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000126185489 1121930702 /nfs/dbraw/zinc/93/07/02/1121930702.db2.gz FZZPHGWCKHZKED-CVDCTZTESA-N 2 0 374.532 4.028 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000126476594 1121957742 /nfs/dbraw/zinc/95/77/42/1121957742.db2.gz GWTIPSNZLUSQBS-GFQSRZNMSA-N 2 0 352.526 4.155 20 0 FIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccs1 ZINC000126697866 1121977439 /nfs/dbraw/zinc/97/74/39/1121977439.db2.gz NNCITXPPZHQSSR-QAPCUYQASA-N 2 0 361.530 4.441 20 0 FIADRP COc1ccc(OC(F)F)c(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000497291877 1122005127 /nfs/dbraw/zinc/00/51/27/1122005127.db2.gz FLWWNOPHNREKOP-IYBDPMFKSA-N 2 0 370.484 4.144 20 0 FIADRP CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)CCC2 ZINC000765813133 1122103068 /nfs/dbraw/zinc/10/30/68/1122103068.db2.gz BOLNXNPLWJIMPG-LAUBAEHRSA-N 2 0 370.541 4.133 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCOCC2CCC2)cc1C[NH+]1CCCCC1 ZINC000765812733 1122104029 /nfs/dbraw/zinc/10/40/29/1122104029.db2.gz XSPPETBQPITHNT-SFHVURJKSA-N 2 0 360.542 4.148 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2CC)CC1 ZINC000066960735 1122116072 /nfs/dbraw/zinc/11/60/72/1122116072.db2.gz WRLPQXMDNFETTL-GOSISDBHSA-N 2 0 359.558 4.020 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168626998 1122188029 /nfs/dbraw/zinc/18/80/29/1122188029.db2.gz ZVRJXQBEBCIYRH-XWUOBKMESA-N 2 0 360.542 4.143 20 0 FIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2cccs2)cc1 ZINC000128264714 1122216515 /nfs/dbraw/zinc/21/65/15/1122216515.db2.gz OBEHRJARWVUNJT-SFHVURJKSA-N 2 0 357.567 4.093 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630603 1122217731 /nfs/dbraw/zinc/21/77/31/1122217731.db2.gz QODCVAMIOVCXGE-JBPLPALLSA-N 2 0 360.542 4.158 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000128630828 1122362748 /nfs/dbraw/zinc/36/27/48/1122362748.db2.gz PJMISPRYXQDLRZ-HXUWFJFHSA-N 2 0 369.553 4.184 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cn1 ZINC000497820489 1122426551 /nfs/dbraw/zinc/42/65/51/1122426551.db2.gz OWJCWYKZJKPPSQ-JOCHJYFZSA-N 2 0 371.500 4.182 20 0 FIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497853953 1122441282 /nfs/dbraw/zinc/44/12/82/1122441282.db2.gz RFXLCRIMOBHQTH-NRFANRHFSA-N 2 0 357.542 4.137 20 0 FIADRP CN1CC[C@H]([NH2+]CCc2ccc(Br)cc2)C[C@@H]1c1ccccc1 ZINC000556093703 1122647476 /nfs/dbraw/zinc/64/74/76/1122647476.db2.gz KLCLANQIJBUZTQ-VQTJNVASSA-N 2 0 373.338 4.417 20 0 FIADRP CSc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000069833300 1122690388 /nfs/dbraw/zinc/69/03/88/1122690388.db2.gz UDRXLYBRMGWCJJ-QZTJIDSGSA-N 2 0 370.562 4.308 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(=O)OC)cc1 ZINC000556178779 1122717682 /nfs/dbraw/zinc/71/76/82/1122717682.db2.gz ISLFBGVYDQMBFL-SIKLNZKXSA-N 2 0 366.505 4.036 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)[C@@H](C)C1 ZINC000556216723 1122735062 /nfs/dbraw/zinc/73/50/62/1122735062.db2.gz JGGIOVATYXMTOU-QFBILLFUSA-N 2 0 354.485 4.025 20 0 FIADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230588 1122757122 /nfs/dbraw/zinc/75/71/22/1122757122.db2.gz OUFMFCHCHOHKOT-YADHBBJMSA-N 2 0 370.581 4.474 20 0 FIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230726 1122757406 /nfs/dbraw/zinc/75/74/06/1122757406.db2.gz ANFIPZXFMCDWRS-VJBWXMMDSA-N 2 0 370.581 4.474 20 0 FIADRP CSc1ccc([C@@H](CNC2CC[NH+](C3CCCC3)CC2)[NH+](C)C)cc1 ZINC000556259526 1122769953 /nfs/dbraw/zinc/76/99/53/1122769953.db2.gz CPRQQOHFECHGMB-OAQYLSRUSA-N 2 0 361.599 4.008 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)c2cccnc12 ZINC000556284673 1122790072 /nfs/dbraw/zinc/79/00/72/1122790072.db2.gz IQXYSWXBVYFMDI-UHFFFAOYSA-N 2 0 351.469 4.458 20 0 FIADRP c1[nH+]cn2cc(-c3nc(-c4cccc(C[NH+]5CCCCC5)c4)no3)ccc12 ZINC000556315890 1122805379 /nfs/dbraw/zinc/80/53/79/1122805379.db2.gz NGOSQJCLRGINKC-UHFFFAOYSA-N 2 0 359.433 4.037 20 0 FIADRP Cc1nc(COc2ccc(C[NH+]3CCC(CC[NH+](C)C)CC3)cc2)cs1 ZINC000130559030 1122871395 /nfs/dbraw/zinc/87/13/95/1122871395.db2.gz GMWNLGBLAWJIBW-UHFFFAOYSA-N 2 0 373.566 4.194 20 0 FIADRP CCCOc1cccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000556409081 1122874845 /nfs/dbraw/zinc/87/48/45/1122874845.db2.gz PVTMYAANSNIEFO-UHFFFAOYSA-N 2 0 368.521 4.238 20 0 FIADRP CC1CC[NH+](C[C@H]2CCCN(Cc3cc(-c4ccc(F)cc4)no3)C2)CC1 ZINC000498878412 1123058529 /nfs/dbraw/zinc/05/85/29/1123058529.db2.gz ACWDSYULEQHUPY-GOSISDBHSA-N 2 0 371.500 4.425 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000498945222 1123094394 /nfs/dbraw/zinc/09/43/94/1123094394.db2.gz WWHTWZHPESBRQK-NRFANRHFSA-N 2 0 357.542 4.136 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000556868736 1123149827 /nfs/dbraw/zinc/14/98/27/1123149827.db2.gz BTXXJEGSSDPJQC-KSSFIOAISA-N 2 0 356.432 4.358 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000556868735 1123149857 /nfs/dbraw/zinc/14/98/57/1123149857.db2.gz BTXXJEGSSDPJQC-KDOFPFPSSA-N 2 0 356.432 4.358 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCc4ccccn4)[C@@H]3C2)cc1 ZINC000556887497 1123163874 /nfs/dbraw/zinc/16/38/74/1123163874.db2.gz YKBVIFKIDPXNGC-QPTUXGOLSA-N 2 0 363.549 4.295 20 0 FIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000556889465 1123175074 /nfs/dbraw/zinc/17/50/74/1123175074.db2.gz HSFPGQKGNJHIOK-CYFREDJKSA-N 2 0 366.549 4.303 20 0 FIADRP CC(C)CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccoc1 ZINC000556889926 1123177471 /nfs/dbraw/zinc/17/74/71/1123177471.db2.gz KVFYDOCECGMMFE-YADHBBJMSA-N 2 0 356.510 4.113 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+]CC4(c5ccccn5)CCC4)[C@H]3C2)cc1 ZINC000556925576 1123226420 /nfs/dbraw/zinc/22/64/20/1123226420.db2.gz VGDWAZLWPUJYIH-FDFHNCONSA-N 2 0 361.533 4.004 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000132426859 1123255846 /nfs/dbraw/zinc/25/58/46/1123255846.db2.gz JQVQAJMRHDVLLO-GOSISDBHSA-N 2 0 363.427 4.329 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499138844 1123281379 /nfs/dbraw/zinc/28/13/79/1123281379.db2.gz JOWDFWCAYNVKNS-CAUSLRQDSA-N 3 0 369.597 4.426 20 0 FIADRP C[C@@H]1CCCC[C@H]1OCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499158120 1123298236 /nfs/dbraw/zinc/29/82/36/1123298236.db2.gz RSQKKRXQADZBKE-DODNOZFWSA-N 2 0 356.554 4.367 20 0 FIADRP C[C@@H](COc1cccc(F)c1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499159596 1123299466 /nfs/dbraw/zinc/29/94/66/1123299466.db2.gz VRKNKJOJRZMVDW-AGOPTVSRSA-N 2 0 368.496 4.378 20 0 FIADRP CC[N@H+](CCCC1CC[NH+](Cc2cncs2)CC1)Cc1cncs1 ZINC000660153237 1123306616 /nfs/dbraw/zinc/30/66/16/1123306616.db2.gz ARARQPFAEXQJTF-UHFFFAOYSA-N 2 0 364.584 4.114 20 0 FIADRP CC[C@H]1CCCC[N@@H+]1CCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000499214779 1123330746 /nfs/dbraw/zinc/33/07/46/1123330746.db2.gz CUZVSYPRKASBPL-GPJHCHHRSA-N 2 0 355.570 4.036 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1F ZINC000499235275 1123342995 /nfs/dbraw/zinc/34/29/95/1123342995.db2.gz PYZPTCJQGFDWIY-AYWYSENESA-N 2 0 368.496 4.378 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000132752217 1123356297 /nfs/dbraw/zinc/35/62/97/1123356297.db2.gz RYHSKKOQXRFNAY-HOYKHHGWSA-N 2 0 364.533 4.372 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000133403321 1123484670 /nfs/dbraw/zinc/48/46/70/1123484670.db2.gz DESMLMRUPYGOMJ-YDIMBITNSA-N 3 0 365.565 4.234 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000133525231 1123496088 /nfs/dbraw/zinc/49/60/88/1123496088.db2.gz PGIAEJVMFWCENG-UTKZUKDTSA-N 2 0 354.494 4.192 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(F)c1 ZINC000921069472 1123555078 /nfs/dbraw/zinc/55/50/78/1123555078.db2.gz LKLQYQRLWOIZAG-SFHVURJKSA-N 2 0 356.485 4.194 20 0 FIADRP C[C@H](CC[N@@H+]1CCSC2(CCC2)CC1)[NH+]1CCSC2(CCC2)CC1 ZINC000411868470 1124042311 /nfs/dbraw/zinc/04/23/11/1124042311.db2.gz KQSLEGISMRJBGC-GOSISDBHSA-N 2 0 368.656 4.488 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2[C@H]4CCO[C@H]4C24CCCC4)C3)cc1 ZINC000245695117 1124204615 /nfs/dbraw/zinc/20/46/15/1124204615.db2.gz KYRYLTQLEWPNSF-YPEXMJEGSA-N 2 0 366.549 4.119 20 0 FIADRP CO[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000245701842 1124209621 /nfs/dbraw/zinc/20/96/21/1124209621.db2.gz LTTQEEFKZGSJQS-GPJHCHHRSA-N 2 0 368.496 4.298 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000474598286 1124217051 /nfs/dbraw/zinc/21/70/51/1124217051.db2.gz KQQQNQVHQDQRTG-ZGOKBZQCSA-N 2 0 364.496 4.223 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245724491 1124220991 /nfs/dbraw/zinc/22/09/91/1124220991.db2.gz PGNWBGPJQALPEF-AGOPTVSRSA-N 2 0 350.506 4.108 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1C ZINC000542852112 1124465227 /nfs/dbraw/zinc/46/52/27/1124465227.db2.gz QPCMNONXZYERAX-NZQKXSOJSA-N 2 0 366.549 4.419 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)ccc1OC(F)F ZINC000246979001 1124578611 /nfs/dbraw/zinc/57/86/11/1124578611.db2.gz JXXDUMYNKKYPDB-CABCVRRESA-N 2 0 356.457 4.068 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000247931257 1124731571 /nfs/dbraw/zinc/73/15/71/1124731571.db2.gz CBIFVIANFGLJPQ-FBBABVLZSA-N 2 0 362.558 4.119 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000248157377 1124747757 /nfs/dbraw/zinc/74/77/57/1124747757.db2.gz RNVFCHYFWGXLNM-FBBABVLZSA-N 2 0 362.558 4.119 20 0 FIADRP Cc1nc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)oc1-c1ccc(Cl)cc1 ZINC000248171646 1124748517 /nfs/dbraw/zinc/74/85/17/1124748517.db2.gz UXGQUCMHUYTOIM-FUHWJXTLSA-N 2 0 359.901 4.220 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)C(c1ccccc1)c1ccccc1 ZINC000248175041 1124749079 /nfs/dbraw/zinc/74/90/79/1124749079.db2.gz VLPZKJWCFDXFGQ-REWPJTCUSA-N 2 0 366.549 4.034 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C)Nc1ccccc1 ZINC000248200243 1124750450 /nfs/dbraw/zinc/75/04/50/1124750450.db2.gz YLPMHIVAWFRROW-PMOQBDJRSA-N 2 0 366.553 4.018 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCOC5(CCCC5)C4)[C@H]3C2)cc1 ZINC000248394678 1124760570 /nfs/dbraw/zinc/76/05/70/1124760570.db2.gz FSSFORPZGSYMIX-BJESRGMDSA-N 2 0 368.565 4.369 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1F ZINC000248433921 1124768326 /nfs/dbraw/zinc/76/83/26/1124768326.db2.gz DMBYCOZJHSQBGW-UGKGYDQZSA-N 2 0 356.485 4.023 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(C(C)(C)C)cc1 ZINC000248454145 1124771764 /nfs/dbraw/zinc/77/17/64/1124771764.db2.gz QYFMMWWUCQWJLZ-WZONZLPQSA-N 2 0 366.549 4.402 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248454495 1124772357 /nfs/dbraw/zinc/77/23/57/1124772357.db2.gz ZKUIYLUBNJQXIH-DKUWSORSSA-N 2 0 359.517 4.496 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1F ZINC000248874415 1124820837 /nfs/dbraw/zinc/82/08/37/1124820837.db2.gz LIUSHFYNYKPVBB-LNLFQRSKSA-N 2 0 362.533 4.256 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1 ZINC000090936986 1125028425 /nfs/dbraw/zinc/02/84/25/1125028425.db2.gz UHWLLSSNRRGOGH-QGZVFWFLSA-N 2 0 373.566 4.373 20 0 FIADRP CCCO[C@@H]1CCC[NH+](C/C=C\C[N@H+]2CCC[C@H](OCCC)CC2)CC1 ZINC000254928549 1125065215 /nfs/dbraw/zinc/06/52/15/1125065215.db2.gz YJVXXAKTHGWQHL-HENPEBFISA-N 2 0 366.590 4.105 20 0 FIADRP COc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)C1CCCC1 ZINC000091343538 1125067243 /nfs/dbraw/zinc/06/72/43/1125067243.db2.gz HWIHFHSBTVYVNV-WZONZLPQSA-N 2 0 372.553 4.017 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091367507 1125068518 /nfs/dbraw/zinc/06/85/18/1125068518.db2.gz UQGFXLUPCBEGBE-IBGZPJMESA-N 2 0 370.368 4.060 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCO[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000672601495 1125191526 /nfs/dbraw/zinc/19/15/26/1125191526.db2.gz HKYLOFAFWQEYOC-RBUKOAKNSA-N 2 0 370.459 4.118 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCO[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000672601496 1125191690 /nfs/dbraw/zinc/19/16/90/1125191690.db2.gz HKYLOFAFWQEYOC-RTBURBONSA-N 2 0 370.459 4.118 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccnc2)cc1C[NH+]1CCCCC1 ZINC000182226620 1125301117 /nfs/dbraw/zinc/30/11/17/1125301117.db2.gz OCXQHBNVVZDCEW-ROUUACIJSA-N 2 0 353.510 4.488 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)CCC2 ZINC000359892380 534635013 /nfs/dbraw/zinc/63/50/13/534635013.db2.gz BGIUMOSVYZZDAZ-RDTXWAMCSA-N 2 0 359.539 4.120 20 0 FIADRP CN1CCC[C@@H](C[NH2+]Cc2cccnc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000522756810 568050126 /nfs/dbraw/zinc/05/01/26/568050126.db2.gz IEYLGQUFUMRHEN-PKOBYXMFSA-N 2 0 363.427 4.273 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1)C(C)C ZINC000604726812 568353434 /nfs/dbraw/zinc/35/34/34/568353434.db2.gz SCHMMOAHWSGUQK-HXUWFJFHSA-N 2 0 361.574 4.013 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCC3(CCCC[NH2+]3)CC2)nc1 ZINC001164386910 718803740 /nfs/dbraw/zinc/80/37/40/718803740.db2.gz HBRVIUNMKOSDTN-FQEVSTJZSA-N 2 0 356.558 4.131 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@H]2C2CC[NH2+]CC2)nc1 ZINC001164419816 718893284 /nfs/dbraw/zinc/89/32/84/718893284.db2.gz RDBISPNAAPOEHH-YADHBBJMSA-N 2 0 370.585 4.377 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CCN(c4cc(N)c(C)c[nH+]4)CC3)CC2)cc1 ZINC001164759874 721045106 /nfs/dbraw/zinc/04/51/06/721045106.db2.gz RJZSVLUCWWUEFW-UHFFFAOYSA-N 2 0 364.537 4.163 20 0 FIADRP CC(=O)Nc1ccccc1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000093844591 1125533125 /nfs/dbraw/zinc/53/31/25/1125533125.db2.gz HTAIBSPYJDSYLC-SFHVURJKSA-N 2 0 357.542 4.122 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(OC)c(O)c2)ccc1OC ZINC000182747385 1125612838 /nfs/dbraw/zinc/61/28/38/1125612838.db2.gz WGPOAIGIARSXDU-MRXNPFEDSA-N 2 0 372.509 4.102 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]CCc2cn3c(n2)CCCC3)cc1OC ZINC000152815684 1125659336 /nfs/dbraw/zinc/65/93/36/1125659336.db2.gz UGTGYJMJPFDEAH-QGZVFWFLSA-N 2 0 371.525 4.300 20 0 FIADRP CCc1nc(CN[C@@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)cs1 ZINC000182897704 1125677884 /nfs/dbraw/zinc/67/78/84/1125677884.db2.gz PHNVVXNXOOSSOD-HNNXBMFYSA-N 2 0 361.555 4.407 20 0 FIADRP Cc1ccccc1-c1noc([C@@H](C)[NH+]2CCC(CCC[NH+](C)C)CC2)n1 ZINC000123498996 1079587535 /nfs/dbraw/zinc/58/75/35/1079587535.db2.gz FPWWGYLJOZIXJF-QGZVFWFLSA-N 2 0 356.514 4.160 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(F)c1 ZINC001648786150 1079618505 /nfs/dbraw/zinc/61/85/05/1079618505.db2.gz SKFAOJJNPKNYLF-HDICACEKSA-N 2 0 356.485 4.033 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000643546985 1079666575 /nfs/dbraw/zinc/66/65/75/1079666575.db2.gz XWMPACQCOUXEAX-WMLDXEAASA-N 2 0 371.550 4.452 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCC2=O)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183911 1125773443 /nfs/dbraw/zinc/77/34/43/1125773443.db2.gz XRRHNJVJAGZDGM-NLWGTHIKSA-N 2 0 369.553 4.117 20 0 FIADRP C[C@@H]([NH2+]CCc1ccccc1OC(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530513407 1080008570 /nfs/dbraw/zinc/00/85/70/1080008570.db2.gz WAZSFDIVKLHGFQ-XLIONFOSSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1C(F)(F)F ZINC000067249713 1080080818 /nfs/dbraw/zinc/08/08/18/1080080818.db2.gz YGMDBLUWNQFDAS-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP C[C@@H](C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1)OCc1ccccc1 ZINC001208701996 1080090778 /nfs/dbraw/zinc/09/07/78/1080090778.db2.gz GGNHWGPNQKXSMR-XUZZJYLKSA-N 2 0 364.533 4.190 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccn1 ZINC000179465847 1080181300 /nfs/dbraw/zinc/18/13/00/1080181300.db2.gz AUNITNQZLSDJTR-XQBPLPMBSA-N 2 0 367.537 4.322 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180136105 1080455614 /nfs/dbraw/zinc/45/56/14/1080455614.db2.gz PGNWBGPJQALPEF-AMZGXZFVSA-N 2 0 350.506 4.108 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000180459586 1080502047 /nfs/dbraw/zinc/50/20/47/1080502047.db2.gz BVNIKHMUZOBNGJ-OAQYLSRUSA-N 2 0 358.913 4.369 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc2ccccc21 ZINC000180645310 1080533130 /nfs/dbraw/zinc/53/31/30/1080533130.db2.gz GWTAOGLTLTXCNI-GCJKJVERSA-N 2 0 360.501 4.257 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CC([NH+]3CCCCC3)C2)CC1 ZINC000239869286 1080560375 /nfs/dbraw/zinc/56/03/75/1080560375.db2.gz CXYPBVNIAMECGE-UHFFFAOYSA-N 3 0 355.570 4.036 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547834868 1080947695 /nfs/dbraw/zinc/94/76/95/1080947695.db2.gz MLWHRUQVPJSBCJ-XLIONFOSSA-N 2 0 374.475 4.331 20 0 FIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+]C2CCN(C[C@@H]3CCCO3)CC2)cc1 ZINC000655696354 1081122465 /nfs/dbraw/zinc/12/24/65/1081122465.db2.gz GCBSVWHTDPHOGB-CVDCTZTESA-N 2 0 374.569 4.028 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc3c(c2)OCCCCO3)C1 ZINC001648811401 1081126873 /nfs/dbraw/zinc/12/68/73/1081126873.db2.gz MEEJUZDLTZKMIQ-RTBURBONSA-N 2 0 360.542 4.086 20 0 FIADRP Clc1cccc([C@H]([NH2+]C2CCN([C@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000655734251 1081152169 /nfs/dbraw/zinc/15/21/69/1081152169.db2.gz DBANACYHTWYCBF-LEWJYISDSA-N 2 0 362.945 4.414 20 0 FIADRP Clc1cccc([C@@H]([NH2+]C2CCN([C@@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000655734253 1081152283 /nfs/dbraw/zinc/15/22/83/1081152283.db2.gz DBANACYHTWYCBF-RTWAWAEBSA-N 2 0 362.945 4.414 20 0 FIADRP CN(C)c1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC001167310541 1081278753 /nfs/dbraw/zinc/27/87/53/1081278753.db2.gz WDABZDGPZQEPKV-UHFFFAOYSA-N 2 0 351.538 4.097 20 0 FIADRP CN1CCC([NH2+][C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000123697845 1081522213 /nfs/dbraw/zinc/52/22/13/1081522213.db2.gz XLICAMGKZQSNEB-OALUTQOASA-N 2 0 367.940 4.077 20 0 FIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000580226550 1081764450 /nfs/dbraw/zinc/76/44/50/1081764450.db2.gz JLYXNLJFMKAMHM-WMZHIEFXSA-N 2 0 367.537 4.228 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000048745021 1081835645 /nfs/dbraw/zinc/83/56/45/1081835645.db2.gz ZEIAUXRKGZWPQE-KRWDZBQOSA-N 2 0 371.912 4.024 20 0 FIADRP CCOc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312782673 1081840808 /nfs/dbraw/zinc/84/08/08/1081840808.db2.gz ASJLKICJBLSYOD-WIYYLYMNSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)Sc1ccc(Br)cc1 ZINC000089582484 1081934612 /nfs/dbraw/zinc/93/46/12/1081934612.db2.gz VILQQVNWSVQOFL-VNQPRFMTSA-N 2 0 369.372 4.146 20 0 FIADRP Cc1cc(Cl)cc(C[NH2+]Cc2cccc(CN3CCO[C@H](C)C3)c2)c1 ZINC000580456178 1081954061 /nfs/dbraw/zinc/95/40/61/1081954061.db2.gz QDZYIELCYYVUGN-QGZVFWFLSA-N 2 0 358.913 4.159 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(Br)cn2)CC1 ZINC000580685434 1082082514 /nfs/dbraw/zinc/08/25/14/1082082514.db2.gz FIBWENCYNWFMSV-OAHLLOKOSA-N 2 0 368.363 4.253 20 0 FIADRP CC(C)c1[nH+]c(CNc2cccc3c2OCC[C@H]3[NH+](C)C)c2ccccn21 ZINC000580838032 1082182309 /nfs/dbraw/zinc/18/23/09/1082182309.db2.gz RBWJDNVBCYZWRB-LJQANCHMSA-N 2 0 364.493 4.455 20 0 FIADRP CC(C)c1[nH+]c(CNc2cccc3c2OCC[C@@H]3[NH+](C)C)c2ccccn21 ZINC000580838031 1082182568 /nfs/dbraw/zinc/18/25/68/1082182568.db2.gz RBWJDNVBCYZWRB-IBGZPJMESA-N 2 0 364.493 4.455 20 0 FIADRP FC(F)(F)[C@H](C[NH2+]Cc1cc(-n2ccnc2)cs1)Cc1ccccc1 ZINC000580983217 1082269133 /nfs/dbraw/zinc/26/91/33/1082269133.db2.gz WMKOEKTWEIWSPD-HNNXBMFYSA-N 2 0 365.424 4.445 20 0 FIADRP Cc1cccc2c1OC[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC000581101572 1082315447 /nfs/dbraw/zinc/31/54/47/1082315447.db2.gz MIZVAHPDPPJFQF-CWBXHPNXSA-N 2 0 362.517 4.084 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCCCc2ccc(Cl)cc21 ZINC000581155076 1082350983 /nfs/dbraw/zinc/35/09/83/1082350983.db2.gz SBALNWZRHYQHRY-HXUWFJFHSA-N 2 0 373.928 4.233 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1CNC1CC[NH+](C2CCCCC2)CC1 ZINC000154842158 1082405725 /nfs/dbraw/zinc/40/57/25/1082405725.db2.gz LYKAIXSTZZDAPI-UHFFFAOYSA-N 2 0 357.586 4.414 20 0 FIADRP CC[NH2+]CC1CC[NH+](CCC(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000430589759 1082533614 /nfs/dbraw/zinc/53/36/14/1082533614.db2.gz BHEJLJOOBVVMHI-UHFFFAOYSA-N 2 0 365.521 4.004 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000581460611 1082589007 /nfs/dbraw/zinc/58/90/07/1082589007.db2.gz XLDGQDVDNIFEMN-PEZBUJJGSA-N 2 0 352.469 4.355 20 0 FIADRP CCOCc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000581574978 1082672402 /nfs/dbraw/zinc/67/24/02/1082672402.db2.gz WQRRPOGTESFBRC-WMZHIEFXSA-N 2 0 352.522 4.223 20 0 FIADRP Clc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000656682895 1082714340 /nfs/dbraw/zinc/71/43/40/1082714340.db2.gz HWYHNIDKPQBROB-NRFANRHFSA-N 2 0 355.913 4.224 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC[NH+](C)CC1 ZINC000581637291 1082734281 /nfs/dbraw/zinc/73/42/81/1082734281.db2.gz ORIAJRXWSMYDNS-MRXNPFEDSA-N 2 0 359.366 4.398 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656787515 1082771210 /nfs/dbraw/zinc/77/12/10/1082771210.db2.gz ZWKSHGQZGQNMBC-HXUWFJFHSA-N 2 0 353.485 4.099 20 0 FIADRP CO[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000684378133 1082794018 /nfs/dbraw/zinc/79/40/18/1082794018.db2.gz ZBNCPVHJRHBYKW-RBUKOAKNSA-N 2 0 350.934 4.099 20 0 FIADRP c1ccc(CN2CC[C@@H]([NH2+]C[C@H]3OCCc4ccccc43)CC23CC3)cc1 ZINC000647183171 1082922123 /nfs/dbraw/zinc/92/21/23/1082922123.db2.gz LVOAMHMVURWFLV-FYYLOGMGSA-N 2 0 362.517 4.087 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccsc1 ZINC000090971344 1083097215 /nfs/dbraw/zinc/09/72/15/1083097215.db2.gz CZSFSUZDGCPAKR-KRWDZBQOSA-N 2 0 355.551 4.131 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1)C(C)C ZINC000510774428 1083306533 /nfs/dbraw/zinc/30/65/33/1083306533.db2.gz RUVANHVQOQABJU-FQEVSTJZSA-N 2 0 373.566 4.011 20 0 FIADRP C[C@H](c1ccccc1)[C@@H](O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000658339393 1083415947 /nfs/dbraw/zinc/41/59/47/1083415947.db2.gz JTTDAQOBKHZTMN-RFRZSCIPSA-N 2 0 366.549 4.184 20 0 FIADRP COC[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000658355703 1083428608 /nfs/dbraw/zinc/42/86/08/1083428608.db2.gz KIJZPZQHJLORSL-LJQANCHMSA-N 2 0 370.459 4.105 20 0 FIADRP C[C@@H](CCc1ccc(Br)cc1)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000132527065 1083439874 /nfs/dbraw/zinc/43/98/74/1083439874.db2.gz XXWXOEUGSKVUJS-GJZGRUSLSA-N 2 0 353.348 4.090 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000548483603 1083466667 /nfs/dbraw/zinc/46/66/67/1083466667.db2.gz VLXBSXCSTKXHLL-PXNSSMCTSA-N 2 0 356.485 4.225 20 0 FIADRP c1[nH]nc2c1cccc2C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000535808497 1083694076 /nfs/dbraw/zinc/69/40/76/1083694076.db2.gz IKYBXVNTYPRJTK-UNMCSNQZSA-N 2 0 360.505 4.049 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)cc1 ZINC000458271848 1083795308 /nfs/dbraw/zinc/79/53/08/1083795308.db2.gz VQSVRBWCHRZFEW-UHFFFAOYSA-N 2 0 353.510 4.151 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2cccs2)c1 ZINC000065976545 1083904017 /nfs/dbraw/zinc/90/40/17/1083904017.db2.gz LGEQHXOAFGEEED-UHFFFAOYSA-N 2 0 354.523 4.268 20 0 FIADRP Cn1cc2c(n1)CCC[C@H]2[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000375647842 1083913667 /nfs/dbraw/zinc/91/36/67/1083913667.db2.gz GKVWNEQYAMZWGN-HSZRJFAPSA-N 2 0 374.532 4.316 20 0 FIADRP Fc1ccc(OCc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000647231596 1084058047 /nfs/dbraw/zinc/05/80/47/1084058047.db2.gz DMAUFCXZJHOKSA-SFTDATJTSA-N 2 0 354.469 4.121 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000545272811 1084148718 /nfs/dbraw/zinc/14/87/18/1084148718.db2.gz IQTVRPQLHITSHZ-NRFANRHFSA-N 2 0 363.977 4.189 20 0 FIADRP Cc1ccc(-c2ccc(C[NH2+]C(C)(C)CCN3CC[NH+](C)CC3)s2)cc1 ZINC000472133903 1084445275 /nfs/dbraw/zinc/44/52/75/1084445275.db2.gz CZCPGBFYGBVXPZ-UHFFFAOYSA-N 2 0 371.594 4.229 20 0 FIADRP COc1ccc(C[NH+](C)C)cc1N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582029661 1084484240 /nfs/dbraw/zinc/48/42/40/1084484240.db2.gz GDWWGUANAKGSNB-NQIIRXRSSA-N 2 0 367.537 4.079 20 0 FIADRP C[C@H](NCc1ccn(-c2ccc(Cl)cc2)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000467185400 1084659077 /nfs/dbraw/zinc/65/90/77/1084659077.db2.gz FFKOTSKFTDTLDX-DLBZAZTESA-N 2 0 372.944 4.268 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](CNCc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC000657348226 1084670428 /nfs/dbraw/zinc/67/04/28/1084670428.db2.gz OMNZWSWXIWVCRA-GOSISDBHSA-N 2 0 357.473 4.223 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1 ZINC000582141544 1084697244 /nfs/dbraw/zinc/69/72/44/1084697244.db2.gz QXTUKTBSKSVRKX-MQSCRBSSSA-N 2 0 357.586 4.141 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000414151957 1084703177 /nfs/dbraw/zinc/70/31/77/1084703177.db2.gz QHHJYDRKOJBYQL-ODIFPOPNSA-N 2 0 370.459 4.460 20 0 FIADRP Brc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414183801 1084761259 /nfs/dbraw/zinc/76/12/59/1084761259.db2.gz NNQVVTQZRNRONT-QGZVFWFLSA-N 2 0 372.266 4.100 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)c1ccc(C[N@H+](CC)C(C)C)cc1 ZINC000237091266 1085034619 /nfs/dbraw/zinc/03/46/19/1085034619.db2.gz ORAHGQCHBYGDNO-UHFFFAOYSA-N 2 0 353.510 4.279 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC(C)(C)c2cccnc2)CC1 ZINC000414334171 1085076920 /nfs/dbraw/zinc/07/69/20/1085076920.db2.gz MZXKZSKLCQMQFW-IBGZPJMESA-N 2 0 351.538 4.044 20 0 FIADRP c1c2cnccc2oc1C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000651648623 1085288603 /nfs/dbraw/zinc/28/86/03/1085288603.db2.gz DHVLANKJFNGZAM-UHFFFAOYSA-N 2 0 361.489 4.316 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]CCC[N@@H+]2CCCC[C@H]2C)c2ccccc21 ZINC000549528412 1085366962 /nfs/dbraw/zinc/36/69/62/1085366962.db2.gz XZARLXYKYMHOPJ-UIFIKXQLSA-N 2 0 358.526 4.022 20 0 FIADRP COc1ncc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000582681515 1085367418 /nfs/dbraw/zinc/36/74/18/1085367418.db2.gz YIWUAVMEGBNDOG-RYRKJORJSA-N 2 0 373.928 4.305 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c2ccccc21 ZINC000549528413 1085367759 /nfs/dbraw/zinc/36/77/59/1085367759.db2.gz XZARLXYKYMHOPJ-WMQCIHAUSA-N 2 0 358.526 4.022 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(OC)c(OC)c1 ZINC000123929549 1085400080 /nfs/dbraw/zinc/40/00/80/1085400080.db2.gz JLHCKDRXYHQIGS-HXUWFJFHSA-N 2 0 356.510 4.396 20 0 FIADRP Clc1oc2ccccc2c1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000657534689 1085449275 /nfs/dbraw/zinc/44/92/75/1085449275.db2.gz COSYSCHEFREGQT-UHFFFAOYSA-N 2 0 362.901 4.067 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000657537412 1085452945 /nfs/dbraw/zinc/45/29/45/1085452945.db2.gz KBVYEOBKIXWBTJ-AJSBUHFISA-N 2 0 370.581 4.439 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@]1(Cc2ccc(Cl)cc2)CCCOC1 ZINC000661428817 1085566889 /nfs/dbraw/zinc/56/68/89/1085566889.db2.gz UJCAAXQEPKYBPN-FQEVSTJZSA-N 2 0 361.917 4.007 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4ccccc4)cc3)cc2)C1 ZINC000657595928 1085664724 /nfs/dbraw/zinc/66/47/24/1085664724.db2.gz SSFMWTRWLWSYKY-RUZDIDTESA-N 2 0 372.512 4.210 20 0 FIADRP C[C@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(Cl)c1 ZINC000657612680 1085698164 /nfs/dbraw/zinc/69/81/64/1085698164.db2.gz CIGQHTYPODBEEO-QGZVFWFLSA-N 2 0 357.929 4.340 20 0 FIADRP CCSc1cccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000657613825 1085700161 /nfs/dbraw/zinc/70/01/61/1085700161.db2.gz RWFWKKYINXUOPE-UHFFFAOYSA-N 2 0 355.551 4.195 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)cc1 ZINC000651949035 1085705964 /nfs/dbraw/zinc/70/59/64/1085705964.db2.gz AZDANBPGGNOKNI-FQEVSTJZSA-N 2 0 372.484 4.158 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]CCSc2ccc(Cl)cc2)CC1 ZINC000582805287 1085745338 /nfs/dbraw/zinc/74/53/38/1085745338.db2.gz JUDRIYYLFICOPO-UHFFFAOYSA-N 2 0 366.880 4.439 20 0 FIADRP C[C@H](NCc1ccncc1OCCC[NH+](C)C)c1ccc(F)cc1Cl ZINC000582809266 1085745735 /nfs/dbraw/zinc/74/57/35/1085745735.db2.gz MTIJHKOMTGMNBT-AWEZNQCLSA-N 2 0 365.880 4.055 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](C2CC2)C2CCOCC2)CC1 ZINC000652247431 1085775445 /nfs/dbraw/zinc/77/54/45/1085775445.db2.gz KSDXSWCJOHLWFH-XPPIMPSXSA-N 2 0 356.554 4.224 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H](C)C2CC[NH+](C)CC2)c2ccccc2OC)cc1 ZINC000090772239 1085882539 /nfs/dbraw/zinc/88/25/39/1085882539.db2.gz HERVJGPRHBBXKN-SBUREZEXSA-N 2 0 368.521 4.113 20 0 FIADRP O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000652337086 1085900785 /nfs/dbraw/zinc/90/07/85/1085900785.db2.gz ITJWJBPUBPMATI-UHFFFAOYSA-N 2 0 368.908 4.081 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000652348449 1085927268 /nfs/dbraw/zinc/92/72/68/1085927268.db2.gz FESKZTPOJRTARD-JFIYKMOQSA-N 2 0 368.974 4.041 20 0 FIADRP COc1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)cc1 ZINC001167647381 1086023339 /nfs/dbraw/zinc/02/33/39/1086023339.db2.gz MBWRTMSTDMLFLE-GMAHTHKFSA-N 2 0 350.506 4.182 20 0 FIADRP Cc1cc(N2CCC([NH2+][C@H](C)c3cnc4ccsc4c3)CC2)nc(C)n1 ZINC000162296453 1086032748 /nfs/dbraw/zinc/03/27/48/1086032748.db2.gz ZYXYUJUNAZUMNA-CQSZACIVSA-N 2 0 367.522 4.023 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC(C)C)cc2)[C@H](C)C1 ZINC000247167407 1086150940 /nfs/dbraw/zinc/15/09/40/1086150940.db2.gz UMKVFLYSISMJED-KNKQGSTJSA-N 2 0 362.558 4.261 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658358575 1086244208 /nfs/dbraw/zinc/24/42/08/1086244208.db2.gz WNNJMLGTCUDIKL-SFHVURJKSA-N 2 0 371.569 4.239 20 0 FIADRP CCCOc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063551828 1086308811 /nfs/dbraw/zinc/30/88/11/1086308811.db2.gz CIQXCXUUBRWULR-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000583184683 1086367246 /nfs/dbraw/zinc/36/72/46/1086367246.db2.gz JGWYTJYRAANPHU-OPMZPASUSA-N 2 0 352.522 4.461 20 0 FIADRP C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293728 1086399918 /nfs/dbraw/zinc/39/99/18/1086399918.db2.gz MMNVSZOITBJOGU-HOCLYGCPSA-N 2 0 362.468 4.204 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)o2)cc1 ZINC000662295985 1086401561 /nfs/dbraw/zinc/40/15/61/1086401561.db2.gz JPTDAFQCXQCXPM-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(OCc3ccccn3)cc2)[C@@H]1CCC[NH3+] ZINC000662317585 1086412823 /nfs/dbraw/zinc/41/28/23/1086412823.db2.gz SEGXNMNKIUANNK-XMSQKQJNSA-N 2 0 353.510 4.000 20 0 FIADRP Cc1nccn1CC[NH2+][C@@H]1CCCSc2ccc(Br)cc21 ZINC000663441084 1086543752 /nfs/dbraw/zinc/54/37/52/1086543752.db2.gz VBHZDLMPQFASDA-OAHLLOKOSA-N 2 0 366.328 4.171 20 0 FIADRP Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000663466730 1086568304 /nfs/dbraw/zinc/56/83/04/1086568304.db2.gz XHSBAJAZPWSXRM-IPJJNNNSSA-N 2 0 360.517 4.005 20 0 FIADRP C[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1OC(F)F ZINC000663468200 1086572168 /nfs/dbraw/zinc/57/21/68/1086572168.db2.gz KEXYRMCICPRMFR-DZGCQCFKSA-N 2 0 356.432 4.200 20 0 FIADRP c1ccc(NC2CC[NH+](Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)nc1 ZINC000663471415 1086577556 /nfs/dbraw/zinc/57/75/56/1086577556.db2.gz FEOBEQYZILYZSC-UHFFFAOYSA-N 2 0 364.537 4.144 20 0 FIADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000663498788 1086611216 /nfs/dbraw/zinc/61/12/16/1086611216.db2.gz FYMOPDOZTKBXIV-LJQANCHMSA-N 2 0 359.901 4.055 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2ccc(C(=O)OC)cc2)CC1 ZINC001167826902 1086620215 /nfs/dbraw/zinc/62/02/15/1086620215.db2.gz RTGRHSVBYODLEF-GOSISDBHSA-N 2 0 360.542 4.163 20 0 FIADRP C[C@H]([NH2+]Cc1ccc2occc2c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000512006778 1086635656 /nfs/dbraw/zinc/63/56/56/1086635656.db2.gz IDFQOZWNVRVCHJ-INIZCTEOSA-N 2 0 367.468 4.175 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167833457 1086666052 /nfs/dbraw/zinc/66/60/52/1086666052.db2.gz BHTZUCORNZFWOM-GMAHTHKFSA-N 3 0 357.586 4.095 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001167834492 1086683122 /nfs/dbraw/zinc/68/31/22/1086683122.db2.gz KPSZLRLRRFLATI-LJQANCHMSA-N 2 0 363.565 4.232 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@](C)(CNC(=O)OC(C)(C)C)C1 ZINC001167835215 1086700278 /nfs/dbraw/zinc/70/02/78/1086700278.db2.gz OWFSGGDLDGBVCV-NQIIRXRSSA-N 2 0 369.594 4.124 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](N2Cc3ccccc3NC2=O)C1 ZINC001167835209 1086700986 /nfs/dbraw/zinc/70/09/86/1086700986.db2.gz OTKUTWXGEVYGGK-QUCCMNQESA-N 2 0 372.557 4.009 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001167838250 1086711897 /nfs/dbraw/zinc/71/18/97/1086711897.db2.gz SNJPBYITHWHYDQ-FXAWDEMLSA-N 2 0 352.950 4.398 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(COc2ccccc2OC)CC1 ZINC001167840361 1086722469 /nfs/dbraw/zinc/72/24/69/1086722469.db2.gz FKGBHIUWWJZKKI-LJQANCHMSA-N 2 0 362.558 4.297 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N(C)Cc2cccc(F)c2)CC1 ZINC001167840672 1086726884 /nfs/dbraw/zinc/72/68/84/1086726884.db2.gz HLNAGCOWXKPYDF-LJQANCHMSA-N 2 0 363.565 4.232 20 0 FIADRP CSc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@H]3O)CC1)CCC2 ZINC000647294672 1086732544 /nfs/dbraw/zinc/73/25/44/1086732544.db2.gz KCIFFQWFUCKFLW-YPAWHYETSA-N 2 0 374.594 4.143 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167841740 1086739223 /nfs/dbraw/zinc/73/92/23/1086739223.db2.gz PZHOLNHBJFOKKR-MOPGFXCFSA-N 2 0 369.594 4.076 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCC[C@@H]1[C@@H](C(=O)OC)c1ccccc1 ZINC001167842546 1086754198 /nfs/dbraw/zinc/75/41/98/1086754198.db2.gz YJMKLDZTSYWLCP-NNWRFLSQSA-N 2 0 374.569 4.308 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4occc4c3)cc2)C[C@H](C)O1 ZINC000512089819 1086755575 /nfs/dbraw/zinc/75/55/75/1086755575.db2.gz SZDAUVXDTRZHAS-HDICACEKSA-N 2 0 364.489 4.332 20 0 FIADRP CC[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Cl)s1 ZINC000583523013 1086766175 /nfs/dbraw/zinc/76/61/75/1086766175.db2.gz ITYXHBWLYUZIMZ-HNNXBMFYSA-N 2 0 367.946 4.368 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccccc2)c2ccccc2)CCCO1 ZINC000432438712 1086769511 /nfs/dbraw/zinc/76/95/11/1086769511.db2.gz BWWNYPGWLVSIHF-NFBKMPQASA-N 2 0 352.522 4.061 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432438976 1086770253 /nfs/dbraw/zinc/77/02/53/1086770253.db2.gz DYVYDLPALHEXSN-XYQBIQKZSA-N 2 0 351.332 4.158 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(Cl)c(Br)c1 ZINC000650719386 1086802383 /nfs/dbraw/zinc/80/23/83/1086802383.db2.gz ODWMHEUTHDYJAC-UHFFFAOYSA-N 2 0 353.691 4.112 20 0 FIADRP COc1ccsc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657771825 1086821705 /nfs/dbraw/zinc/82/17/05/1086821705.db2.gz GVJXZXCJNLJWMT-GOSISDBHSA-N 2 0 356.535 4.149 20 0 FIADRP C[C@H](C[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1)c1ccc(C(F)(F)F)cc1 ZINC000650724478 1086836388 /nfs/dbraw/zinc/83/63/88/1086836388.db2.gz HAVLNZVUDXXYLF-FDPIWHGQSA-N 2 0 370.459 4.170 20 0 FIADRP C[C@H]1C[C@@H](C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000279216228 1086874575 /nfs/dbraw/zinc/87/45/75/1086874575.db2.gz MZVOGXCKARHBDZ-ROUUACIJSA-N 2 0 357.542 4.120 20 0 FIADRP CC(C)n1ccc(C[C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000583663671 1086907132 /nfs/dbraw/zinc/90/71/32/1086907132.db2.gz QEXOWUIFHAMUMQ-UNMCSNQZSA-N 2 0 368.569 4.287 20 0 FIADRP c1cc2cccc(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)c2s1 ZINC000650741073 1086915897 /nfs/dbraw/zinc/91/58/97/1086915897.db2.gz XFOGQYLMWBGZAI-RXVVDRJESA-N 2 0 350.487 4.247 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(Br)cc1F ZINC000650756449 1086967769 /nfs/dbraw/zinc/96/77/69/1086967769.db2.gz AZKKNTYENXYRDN-GFCCVEGCSA-N 2 0 351.263 4.158 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCc2ccc(Br)cc21 ZINC000650757180 1086970193 /nfs/dbraw/zinc/97/01/93/1086970193.db2.gz QPUJPACWZDCXJB-IBGZPJMESA-N 2 0 359.311 4.336 20 0 FIADRP Fc1cc(-c2ccncc2)ccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657813223 1087086047 /nfs/dbraw/zinc/08/60/47/1087086047.db2.gz KOIBAZKYSQFHHH-UHFFFAOYSA-N 2 0 353.485 4.099 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1 ZINC000132580936 1087091853 /nfs/dbraw/zinc/09/18/53/1087091853.db2.gz WPKOTPFNONTIPX-QHCPKHFHSA-N 2 0 352.522 4.274 20 0 FIADRP COc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000584020966 1087113074 /nfs/dbraw/zinc/11/30/74/1087113074.db2.gz AKDZNJBTJXXWQS-CQSZACIVSA-N 2 0 357.325 4.166 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000584173223 1087201290 /nfs/dbraw/zinc/20/12/90/1087201290.db2.gz ZVXKTDOBRPKQHA-JPYJTQIMSA-N 2 0 363.505 4.075 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2cc1OC ZINC000657839565 1087267083 /nfs/dbraw/zinc/26/70/83/1087267083.db2.gz CEOWKLFVPGAGOZ-RYGJVYDSSA-N 2 0 354.494 4.134 20 0 FIADRP CC[C@@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000657855999 1087361542 /nfs/dbraw/zinc/36/15/42/1087361542.db2.gz JFZHEFCMSYLSFU-KRWDZBQOSA-N 2 0 365.359 4.377 20 0 FIADRP c1ccc([C@H](C[C@H]2CCOC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089214761 1087380279 /nfs/dbraw/zinc/38/02/79/1087380279.db2.gz GLZOBDYGTKHJMD-OFNKIYASSA-N 2 0 365.521 4.056 20 0 FIADRP COc1ccccc1SC[C@@H](C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000089515659 1087395045 /nfs/dbraw/zinc/39/50/45/1087395045.db2.gz OGRXDRSSHPUZKG-KRWDZBQOSA-N 2 0 362.583 4.420 20 0 FIADRP CCOc1ccc(C[N@H+](CCCn2ccnc2)Cc2ccc(O)cc2)cc1 ZINC000685451276 1087571267 /nfs/dbraw/zinc/57/12/67/1087571267.db2.gz YUYMVBUCKXGMQA-UHFFFAOYSA-N 2 0 365.477 4.080 20 0 FIADRP C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000685470344 1087577832 /nfs/dbraw/zinc/57/78/32/1087577832.db2.gz HIVURJHGMAQTIL-CVDCTZTESA-N 2 0 361.533 4.462 20 0 FIADRP Cc1nccn1CC[NH2+][C@H](Cc1ccccc1C(F)(F)F)C(C)(C)C ZINC000685602036 1087638843 /nfs/dbraw/zinc/63/88/43/1087638843.db2.gz UYOZMMCAMSNDMV-QGZVFWFLSA-N 2 0 353.432 4.457 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000685644945 1087655723 /nfs/dbraw/zinc/65/57/23/1087655723.db2.gz LUGMTANXFGPNBK-XPNTWCBSSA-N 2 0 350.506 4.195 20 0 FIADRP Clc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CC2)cc1 ZINC000658067199 1087710245 /nfs/dbraw/zinc/71/02/45/1087710245.db2.gz LSCLBZMFDKDHSH-NRFANRHFSA-N 2 0 362.945 4.272 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(F)ccc1F ZINC000658071768 1087711518 /nfs/dbraw/zinc/71/15/18/1087711518.db2.gz YTKHYLRBVCZCAK-OAQYLSRUSA-N 2 0 366.496 4.143 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(F)c(F)c1 ZINC000658136381 1087724632 /nfs/dbraw/zinc/72/46/32/1087724632.db2.gz GYXYEVUFTKRUHK-KNQAVFIVSA-N 2 0 374.475 4.018 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)C2CCC2)cc1 ZINC000658141947 1087733843 /nfs/dbraw/zinc/73/38/43/1087733843.db2.gz YCMFBMKFLKGGMI-DNQXCXABSA-N 2 0 364.533 4.193 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658138440 1087743443 /nfs/dbraw/zinc/74/34/43/1087743443.db2.gz NKRUEKQGOBFRCF-FYYLOGMGSA-N 2 0 364.533 4.037 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(OC)cc1 ZINC000658165694 1087760069 /nfs/dbraw/zinc/76/00/69/1087760069.db2.gz KCKWIOGVGLAGQA-QFIPXVFZSA-N 2 0 353.510 4.043 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cnc2ccsc2c1 ZINC000658167926 1087761375 /nfs/dbraw/zinc/76/13/75/1087761375.db2.gz USTMVAKOIZMEDO-MRXNPFEDSA-N 2 0 366.534 4.254 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)c(F)c1 ZINC000658166290 1087761971 /nfs/dbraw/zinc/76/19/71/1087761971.db2.gz NNSRPLMGCAKZNV-OAHLLOKOSA-N 2 0 361.892 4.437 20 0 FIADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168764 1087764979 /nfs/dbraw/zinc/76/49/79/1087764979.db2.gz YNYVOXFADKXTAB-SFHVURJKSA-N 2 0 355.501 4.044 20 0 FIADRP CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3C[NH+]3CCC(C)CC3)C[C@H]2C1 ZINC000424263028 1087885039 /nfs/dbraw/zinc/88/50/39/1087885039.db2.gz GVAKWIFVQAZXQX-YSVGVQOKSA-N 2 0 356.554 4.212 20 0 FIADRP C[C@@H]1CC2(C[N@@H+]1Cc1csc(-c3ccc(Cl)cc3)n1)CC[NH2+]CC2 ZINC000424299977 1087904645 /nfs/dbraw/zinc/90/46/45/1087904645.db2.gz WIPQLYAIALFVON-CQSZACIVSA-N 2 0 361.942 4.428 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424280373 1087909881 /nfs/dbraw/zinc/90/98/81/1087909881.db2.gz HEWBRGRPJNWZME-WOJBJXKFSA-N 2 0 357.567 4.385 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C2CC[NH2+]CC2)cc1C ZINC000414790696 1088010536 /nfs/dbraw/zinc/01/05/36/1088010536.db2.gz PTBITHSXXRUIDM-UHFFFAOYSA-N 2 0 374.532 4.057 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000414802931 1088105749 /nfs/dbraw/zinc/10/57/49/1088105749.db2.gz CBFGVGCQQCYENK-MRXNPFEDSA-N 2 0 357.929 4.114 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000505146259 1088207724 /nfs/dbraw/zinc/20/77/24/1088207724.db2.gz RDUQAVGAJARRFV-UHFFFAOYSA-N 2 0 365.606 4.048 20 0 FIADRP FC(F)(F)c1ccc(-c2nc(C[NH2+]CC[C@@H]3CCC[NH2+]C3)cs2)cc1 ZINC000414831746 1088374872 /nfs/dbraw/zinc/37/48/72/1088374872.db2.gz DPDNIHWSBHISMZ-ZDUSSCGKSA-N 2 0 369.456 4.308 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)cc2)cc1 ZINC000513820290 1088415165 /nfs/dbraw/zinc/41/51/65/1088415165.db2.gz MQOOBHFYKOIPIX-UHFFFAOYSA-N 2 0 364.533 4.288 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)C[C@@H]3[NH2+]Cc4ccccc43)cc2)C1 ZINC000659284823 1088421717 /nfs/dbraw/zinc/42/17/17/1088421717.db2.gz HQIDJRNTLLIJSR-VGSWGCGISA-N 2 0 363.505 4.092 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)cs2)c1 ZINC000514103850 1088748240 /nfs/dbraw/zinc/74/82/40/1088748240.db2.gz FTFGBSIQBYOZQD-HNNXBMFYSA-N 2 0 360.523 4.227 20 0 FIADRP CC[NH+](CC)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000514129806 1088775192 /nfs/dbraw/zinc/77/51/92/1088775192.db2.gz BTEARYHEHMXBCS-GOSISDBHSA-N 2 0 353.510 4.321 20 0 FIADRP CO[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000514248769 1088944455 /nfs/dbraw/zinc/94/44/55/1088944455.db2.gz VOJSUKMCJHGUSZ-RIFZZMRRSA-N 2 0 350.934 4.270 20 0 FIADRP CCc1ccccc1[C@@H]([NH3+])CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000415044208 1089083799 /nfs/dbraw/zinc/08/37/99/1089083799.db2.gz BLIWTZSOCJKAGQ-IFBIMPTNSA-N 2 0 363.549 4.034 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cccc(OCc2ccccn2)c1)c1ccccc1 ZINC000415048148 1089084816 /nfs/dbraw/zinc/08/48/16/1089084816.db2.gz FRGMMSQMTPHLEX-QHCPKHFHSA-N 2 0 361.489 4.230 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+]C3CCN(c4ccccc4)CC3)C2)cc1 ZINC000312433111 1089085097 /nfs/dbraw/zinc/08/50/97/1089085097.db2.gz AWDPONKOOCUEFQ-QFIPXVFZSA-N 2 0 363.549 4.157 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415045261 1089088919 /nfs/dbraw/zinc/08/89/19/1089088919.db2.gz BHXGZRPZGYRQID-APWZRJJASA-N 2 0 373.928 4.435 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000415059371 1089096171 /nfs/dbraw/zinc/09/61/71/1089096171.db2.gz WTXIQLRFNYGQDB-RBBKRZOGSA-N 2 0 350.506 4.326 20 0 FIADRP CCc1ccccc1NC(=O)C[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415055312 1089099260 /nfs/dbraw/zinc/09/92/60/1089099260.db2.gz OGXAQEUJYPAFDK-UWJYYQICSA-N 2 0 353.510 4.036 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)ccc1OC1CCCC1 ZINC000415084804 1089135714 /nfs/dbraw/zinc/13/57/14/1089135714.db2.gz PXHQLQPNDGEASD-XUVXKRRUSA-N 2 0 358.526 4.027 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1)[C@H]1CCC[NH2+]C1 ZINC000414859987 1089147720 /nfs/dbraw/zinc/14/77/20/1089147720.db2.gz VBAIIFGSVFMYQT-QAPCUYQASA-N 2 0 371.912 4.070 20 0 FIADRP CCCOc1ccccc1Oc1ncccc1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000415089114 1089148920 /nfs/dbraw/zinc/14/89/20/1089148920.db2.gz MSHSSWZWFQZTTF-UHFFFAOYSA-N 2 0 369.509 4.270 20 0 FIADRP C[C@H](C[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000415115154 1089172741 /nfs/dbraw/zinc/17/27/41/1089172741.db2.gz WKQLHDJENJGLPS-CCKFTAQKSA-N 2 0 370.459 4.027 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)C1 ZINC000415126535 1089178819 /nfs/dbraw/zinc/17/88/19/1089178819.db2.gz PMOUUAQJSGVSKE-JXFKEZNVSA-N 2 0 374.525 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)C1 ZINC000415129585 1089192371 /nfs/dbraw/zinc/19/23/71/1089192371.db2.gz VFXSBRGNRYBAOK-ICSRJNTNSA-N 2 0 374.525 4.273 20 0 FIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414863732 1089204174 /nfs/dbraw/zinc/20/41/74/1089204174.db2.gz YBHPQVLMNHKONJ-CMPLNLGQSA-N 2 0 354.338 4.202 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000514602034 1089257814 /nfs/dbraw/zinc/25/78/14/1089257814.db2.gz DJSNIDXZKDSVKJ-KNQAVFIVSA-N 2 0 374.532 4.158 20 0 FIADRP C[NH+](C)C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000549223058 1089269702 /nfs/dbraw/zinc/26/97/02/1089269702.db2.gz UXCPCVHWMVWZEP-OAQYLSRUSA-N 2 0 363.977 4.329 20 0 FIADRP CO[C@H](C)[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549237098 1089317931 /nfs/dbraw/zinc/31/79/31/1089317931.db2.gz JTVCHWFGUAHTKX-UASUFHIXSA-N 2 0 350.934 4.267 20 0 FIADRP CCC[N@H+](CC)CCNC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000472777374 1089434132 /nfs/dbraw/zinc/43/41/32/1089434132.db2.gz YPFGIGISYWVLEU-UHFFFAOYSA-N 2 0 374.573 4.305 20 0 FIADRP CCC(CC)(CNC(=O)c1ccc([C@H](C)[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000514789612 1089470393 /nfs/dbraw/zinc/47/03/93/1089470393.db2.gz MFZXAZBQILXFFG-ROUUACIJSA-N 2 0 367.537 4.346 20 0 FIADRP COCc1cccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000435420495 1089635344 /nfs/dbraw/zinc/63/53/44/1089635344.db2.gz DGEZRDWOKKFGSO-FQEVSTJZSA-N 2 0 356.535 4.039 20 0 FIADRP Cc1oc2ccccc2c1CN(Cc1nccs1)[C@H]1CC12CC[NH2+]CC2 ZINC000435424665 1089639790 /nfs/dbraw/zinc/63/97/90/1089639790.db2.gz WPFIOSAAFHWPKX-IBGZPJMESA-N 2 0 367.518 4.342 20 0 FIADRP c1cc(C[N@H+](Cc2ccc3ccccc3n2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000435681018 1089839295 /nfs/dbraw/zinc/83/92/95/1089839295.db2.gz JBLDUDNDCCOFKD-OAQYLSRUSA-N 2 0 363.530 4.441 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)CC[NH+](C)CC1 ZINC000515190665 1089846350 /nfs/dbraw/zinc/84/63/50/1089846350.db2.gz MFVYTVFNLTWNIZ-AWEZNQCLSA-N 2 0 358.498 4.074 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000435782429 1089944340 /nfs/dbraw/zinc/94/43/40/1089944340.db2.gz PFIZAVCXLBYIDY-UHFFFAOYSA-N 2 0 352.526 4.061 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000435785554 1089945699 /nfs/dbraw/zinc/94/56/99/1089945699.db2.gz CRDFFBRPCIPLML-UHFFFAOYSA-N 2 0 352.526 4.061 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CCn2ccnc2)c2ccccc2)cc1 ZINC000188097797 1090169562 /nfs/dbraw/zinc/16/95/62/1090169562.db2.gz OZZQBBVBOKGMNB-SFHVURJKSA-N 2 0 356.267 4.025 20 0 FIADRP COCC[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549421570 1090317951 /nfs/dbraw/zinc/31/79/51/1090317951.db2.gz ROBDRBHKHNGFOY-XMMBUWISSA-N 2 0 350.934 4.269 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000183179800 1090395903 /nfs/dbraw/zinc/39/59/03/1090395903.db2.gz MUFORNKVWYUWEZ-INIZCTEOSA-N 2 0 371.481 4.296 20 0 FIADRP CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cn1 ZINC000584688004 1090719806 /nfs/dbraw/zinc/71/98/06/1090719806.db2.gz XZZPZBOCYQUEOY-NRFANRHFSA-N 2 0 364.537 4.013 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000500366711 1091371493 /nfs/dbraw/zinc/37/14/93/1091371493.db2.gz ADSVREIWRYMGGN-HNNXBMFYSA-N 2 0 371.903 4.007 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000500402917 1091440376 /nfs/dbraw/zinc/44/03/76/1091440376.db2.gz LBSCZGAPHUKJQB-XOBRGWDASA-N 2 0 352.869 4.254 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000320060038 1091836588 /nfs/dbraw/zinc/83/65/88/1091836588.db2.gz MHJHSWQOJZYNBF-OAHLLOKOSA-N 2 0 374.326 4.034 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000040227585 1091842620 /nfs/dbraw/zinc/84/26/20/1091842620.db2.gz QOZXMKQYMTWQMG-QGZVFWFLSA-N 2 0 351.332 4.289 20 0 FIADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000187170408 1091844890 /nfs/dbraw/zinc/84/48/90/1091844890.db2.gz WTACVQYJHPKBTM-XMMPIXPASA-N 2 0 366.549 4.000 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(F)c3cccnc23)C1 ZINC000512215149 1091915920 /nfs/dbraw/zinc/91/59/20/1091915920.db2.gz VLYURKBVOBYDQF-ZWKOTPCHSA-N 2 0 355.501 4.460 20 0 FIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000500452827 1092092017 /nfs/dbraw/zinc/09/20/17/1092092017.db2.gz RXQXRNLHNYJLSG-CTNGQTDRSA-N 2 0 350.510 4.009 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512345382 1092092168 /nfs/dbraw/zinc/09/21/68/1092092168.db2.gz GJPRSEWLEJCQHF-YCMKHMOMSA-N 2 0 356.554 4.479 20 0 FIADRP Clc1ccc(C[C@]2([NH2+]Cc3ccc(-n4ccnc4)cc3)CCOC2)cc1 ZINC000500525860 1092186891 /nfs/dbraw/zinc/18/68/91/1092186891.db2.gz IRMHCUXNMALWIU-OAQYLSRUSA-N 2 0 367.880 4.017 20 0 FIADRP Cn1ccnc1CC1CC[NH+](Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000508328252 1092232912 /nfs/dbraw/zinc/23/29/12/1092232912.db2.gz ZNTHTYLAQIQESN-UHFFFAOYSA-N 2 0 368.506 4.014 20 0 FIADRP C[C@@H]1C[C@@H](NCC[NH+](C)Cc2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012505 1092339540 /nfs/dbraw/zinc/33/95/40/1092339540.db2.gz BCRBKECNTXGBTO-RUMRUAAYSA-N 2 0 365.565 4.150 20 0 FIADRP C[C@@H]1CC(N[C@@H](C[NH+](C)C)c2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012209 1092345975 /nfs/dbraw/zinc/34/59/75/1092345975.db2.gz XXOMYWSBHUWLKP-REHUZNOOSA-N 2 0 365.565 4.321 20 0 FIADRP [NH3+][C@@H]1C[C@H](NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c2ccccc21 ZINC000665277183 1092504752 /nfs/dbraw/zinc/50/47/52/1092504752.db2.gz WEYUNZGNTFYORR-PMOQBDJRSA-N 2 0 361.533 4.023 20 0 FIADRP C[N@H+](Cc1ccc(OCc2ccc(F)cc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442757687 1092750533 /nfs/dbraw/zinc/75/05/33/1092750533.db2.gz MTRIOGQYBICEKB-WCRBZPEASA-N 2 0 354.469 4.120 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(-c2noc([C@@H]3C[C@H]4CCCC[C@@H]4[NH2+]3)n2)c1 ZINC000442756191 1092755952 /nfs/dbraw/zinc/75/59/52/1092755952.db2.gz YVHTZGDZQIDNFS-HOJAQTOUSA-N 2 0 366.509 4.316 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442782364 1092760041 /nfs/dbraw/zinc/76/00/41/1092760041.db2.gz PXBTWDHFFZQEPR-QWFCFKBJSA-N 2 0 373.544 4.381 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)CC2)c1 ZINC000442796141 1092771502 /nfs/dbraw/zinc/77/15/02/1092771502.db2.gz STCKCKLNWAKTCX-QGZVFWFLSA-N 2 0 365.546 4.198 20 0 FIADRP CC(C)[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000442878371 1092833799 /nfs/dbraw/zinc/83/37/99/1092833799.db2.gz STOBOLKHNKLYSG-GOSISDBHSA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000521817858 1092937104 /nfs/dbraw/zinc/93/71/04/1092937104.db2.gz VBODDWZGDPLHLE-RTBURBONSA-N 2 0 352.522 4.463 20 0 FIADRP C/C(=C/c1ccccc1)C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000521823149 1092940950 /nfs/dbraw/zinc/94/09/50/1092940950.db2.gz LTNHCNOKHPKGHV-XDOYNYLZSA-N 2 0 363.549 4.282 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCCC2)cc1C ZINC000246242238 1092942675 /nfs/dbraw/zinc/94/26/75/1092942675.db2.gz GICPCLIEOXADKA-CTNGQTDRSA-N 2 0 369.553 4.019 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000521844090 1092942706 /nfs/dbraw/zinc/94/27/06/1092942706.db2.gz LYRMMHJPFHZRKO-FQEVSTJZSA-N 2 0 374.532 4.279 20 0 FIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2cccc(Br)c2)o1 ZINC000521834068 1092946773 /nfs/dbraw/zinc/94/67/73/1092946773.db2.gz LGTDDLWUVXSIBF-UHFFFAOYSA-N 2 0 351.288 4.141 20 0 FIADRP Cc1ccccc1[C@H]([C@H](C)NC1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000443200635 1092988089 /nfs/dbraw/zinc/98/80/89/1092988089.db2.gz VYKMHXPHALEBKH-RDPSFJRHSA-N 2 0 365.565 4.240 20 0 FIADRP Cc1ccccc1[C@H]([C@@H](C)NC1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000443200639 1092988370 /nfs/dbraw/zinc/98/83/70/1092988370.db2.gz VYKMHXPHALEBKH-YKSBVNFPSA-N 2 0 365.565 4.240 20 0 FIADRP [NH2+]=C(Nc1ccc2c(c1)Cc1cc(Br)ccc1-2)SCC[NH3+] ZINC001167915581 1093023955 /nfs/dbraw/zinc/02/39/55/1093023955.db2.gz UVQMAESTAYQELQ-UHFFFAOYSA-N 2 0 362.296 4.059 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)sc1C ZINC000512666368 1093105940 /nfs/dbraw/zinc/10/59/40/1093105940.db2.gz KFBQXQHTJHVQMR-NJDAHSKKSA-N 2 0 369.578 4.193 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000474057472 1093162482 /nfs/dbraw/zinc/16/24/82/1093162482.db2.gz MWVZESWLOBHPDZ-BHIFYINESA-N 2 0 374.569 4.092 20 0 FIADRP Cc1cccc(OCC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168018198 1093164694 /nfs/dbraw/zinc/16/46/94/1093164694.db2.gz YWPSSAPWSGNQEX-PMACEKPBSA-N 2 0 352.522 4.405 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000474070361 1093179776 /nfs/dbraw/zinc/17/97/76/1093179776.db2.gz AELKPALRAYHLQE-JOCHJYFZSA-N 2 0 368.521 4.148 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2(CO)CC(c3ccccc3)C2)CC1 ZINC000433076216 1093203535 /nfs/dbraw/zinc/20/35/35/1093203535.db2.gz MVDTYVBIZJTCCR-VCERZCPPSA-N 2 0 370.581 4.175 20 0 FIADRP C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000433091042 1093227517 /nfs/dbraw/zinc/22/75/17/1093227517.db2.gz MTPKFBMWMZWHJD-ZDUSSCGKSA-N 2 0 368.855 4.409 20 0 FIADRP C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248586892 1093276133 /nfs/dbraw/zinc/27/61/33/1093276133.db2.gz QGFIQQJXLFCAHU-CKFHNAJUSA-N 2 0 371.352 4.269 20 0 FIADRP Cc1nn(-c2ccc(F)cc2)c(C)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500884151 1093291674 /nfs/dbraw/zinc/29/16/74/1093291674.db2.gz AMNSUSFJLMGLFF-UHFFFAOYSA-N 2 0 372.532 4.374 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000443597288 1093310407 /nfs/dbraw/zinc/31/04/07/1093310407.db2.gz ATNMUNYNYQHYBE-FQEVSTJZSA-N 2 0 371.569 4.218 20 0 FIADRP CCc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443603047 1093320021 /nfs/dbraw/zinc/32/00/21/1093320021.db2.gz QFMRRJDAWOOGRA-IBGZPJMESA-N 2 0 371.569 4.164 20 0 FIADRP CCN(CC)Cc1nc(C2([NH2+]C[C@H]3C(C)=CCC[C@H]3C)CCCC2)no1 ZINC000443639435 1093365447 /nfs/dbraw/zinc/36/54/47/1093365447.db2.gz GPOLBGNQUVWFAJ-MSOLQXFVSA-N 2 0 360.546 4.263 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168024241 1093382152 /nfs/dbraw/zinc/38/21/52/1093382152.db2.gz CTCIOWWHGDTTIW-NXWNEQKCSA-N 2 0 352.522 4.354 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4cc[nH]n4)o3)cc2)C1 ZINC000433314729 1093568190 /nfs/dbraw/zinc/56/81/90/1093568190.db2.gz BWGAIHWYDLTGLJ-KRWDZBQOSA-N 2 0 364.493 4.191 20 0 FIADRP C[C@@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)Oc1cccc(Br)c1 ZINC000512969908 1093606782 /nfs/dbraw/zinc/60/67/82/1093606782.db2.gz LPQBSCORZOIWOS-AWEZNQCLSA-N 2 0 369.347 4.069 20 0 FIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000513019861 1093665397 /nfs/dbraw/zinc/66/53/97/1093665397.db2.gz INYIQCBNHFAVCB-GQCSXXPBSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@H](NCC(C)(C)C[NH+](C)C)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433405914 1093672482 /nfs/dbraw/zinc/67/24/82/1093672482.db2.gz JZLNWXLYXWBGJH-FUHWJXTLSA-N 2 0 366.521 4.012 20 0 FIADRP C[C@@H]1CC(N[C@@H]2CC[N@@H+](C3CCCC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032982 1093681412 /nfs/dbraw/zinc/68/14/12/1093681412.db2.gz JHHOUJFWGZETEP-SFHLNBCPSA-N 2 0 355.570 4.035 20 0 FIADRP Cc1sc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)nc1-c1ccc(Cl)cc1 ZINC000647791777 1093695474 /nfs/dbraw/zinc/69/54/74/1093695474.db2.gz MTYXGNILSZQHOV-ZMSDIMECSA-N 2 0 361.942 4.250 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3cc(F)ccc23)CC1 ZINC000513063546 1093716537 /nfs/dbraw/zinc/71/65/37/1093716537.db2.gz IFECVDPZXUNKPP-ZHRRBRCNSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3cc(F)ccc23)CC1 ZINC000513063543 1093716745 /nfs/dbraw/zinc/71/67/45/1093716745.db2.gz IFECVDPZXUNKPP-OPAMFIHVSA-N 2 0 357.517 4.482 20 0 FIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2c(c1)OCO2 ZINC001648951034 1093932375 /nfs/dbraw/zinc/93/23/75/1093932375.db2.gz MBBZOESGYCPJSP-UHFFFAOYSA-N 2 0 358.526 4.080 20 0 FIADRP C[N@@H+](Cc1cn(-c2ccccc2)nc1-c1ccccc1)CC1CC[NH+](C)CC1 ZINC000729265699 1093953846 /nfs/dbraw/zinc/95/38/46/1093953846.db2.gz XATLENBGADSCOJ-UHFFFAOYSA-N 2 0 374.532 4.313 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccc(F)cc34)CC2)C1 ZINC000513233814 1094014894 /nfs/dbraw/zinc/01/48/94/1094014894.db2.gz OYDRFVJUGQTKOO-OXJNMPFZSA-N 2 0 357.517 4.482 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](Cc2ccccn2)c2cccnc2)CC1 ZINC000513343146 1094075595 /nfs/dbraw/zinc/07/55/95/1094075595.db2.gz NCINJMXGSAJXAA-HSZRJFAPSA-N 2 0 366.553 4.108 20 0 FIADRP c1ccc(C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c2cccnc2)nc1 ZINC000513487724 1094158332 /nfs/dbraw/zinc/15/83/32/1094158332.db2.gz JEYNTYBIEGBSSM-DEOSSOPVSA-N 2 0 372.516 4.146 20 0 FIADRP CCCn1nc(C)c(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1C ZINC000513495467 1094162152 /nfs/dbraw/zinc/16/21/52/1094162152.db2.gz QDVPEQAMTKNFJO-XMSQKQJNSA-N 2 0 368.569 4.300 20 0 FIADRP Cc1nc2ccccn2c1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513487304 1094166139 /nfs/dbraw/zinc/16/61/39/1094166139.db2.gz BAHDJNXHDOFFOR-RXVVDRJESA-N 2 0 362.521 4.033 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)c1 ZINC000513531605 1094202007 /nfs/dbraw/zinc/20/20/07/1094202007.db2.gz IFYUVEXECWQWHG-DEOSSOPVSA-N 2 0 374.532 4.392 20 0 FIADRP COc1ccc(OC)c(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513544617 1094205621 /nfs/dbraw/zinc/20/56/21/1094205621.db2.gz KKUNSNOPXMVSRL-ICSRJNTNSA-N 2 0 368.521 4.094 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000513544603 1094205670 /nfs/dbraw/zinc/20/56/70/1094205670.db2.gz KGZMOPXIEYPHOE-PKOBYXMFSA-N 2 0 354.542 4.098 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000513544601 1094206074 /nfs/dbraw/zinc/20/60/74/1094206074.db2.gz KGZMOPXIEYPHOE-IEBWSBKVSA-N 2 0 354.542 4.098 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(NC(=O)C3CCCCC3)c2)[C@@H]2CCC[C@@H]21 ZINC000513667014 1094264136 /nfs/dbraw/zinc/26/41/36/1094264136.db2.gz PFTMIWSXYNXPLW-FKBYEOEOSA-N 2 0 369.553 4.168 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000474607386 1094410508 /nfs/dbraw/zinc/41/05/08/1094410508.db2.gz YDZGHTWFPBOVDX-ZWKOTPCHSA-N 2 0 374.569 4.440 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](CC2CCCC2)c2ccccc2)CC1 ZINC000501006103 1094416809 /nfs/dbraw/zinc/41/68/09/1094416809.db2.gz FNSRVNHXVHHVRK-QHCPKHFHSA-N 2 0 357.586 4.314 20 0 FIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000474623497 1094454219 /nfs/dbraw/zinc/45/42/19/1094454219.db2.gz RXLKODWQZUISOP-UHFFFAOYSA-N 2 0 362.521 4.311 20 0 FIADRP C[N@@H+](Cc1nc2ccccc2s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501047520 1094454461 /nfs/dbraw/zinc/45/44/61/1094454461.db2.gz DWKAGCYRCNWTOH-UHFFFAOYSA-N 2 0 352.507 4.040 20 0 FIADRP C[N@@H+](Cc1ccccc1OC(F)F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501071569 1094476752 /nfs/dbraw/zinc/47/67/52/1094476752.db2.gz XOSYWPHFMRDWRC-UHFFFAOYSA-N 2 0 361.436 4.031 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000501089618 1094489332 /nfs/dbraw/zinc/48/93/32/1094489332.db2.gz OFJNEXUOTJWANN-QGZVFWFLSA-N 2 0 371.491 4.114 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000501081203 1094497595 /nfs/dbraw/zinc/49/75/95/1094497595.db2.gz VTDIFXOOZQGTTE-UHFFFAOYSA-N 2 0 365.565 4.105 20 0 FIADRP CCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1c(F)cccc1Cl ZINC000501140282 1094527202 /nfs/dbraw/zinc/52/72/02/1094527202.db2.gz KNYNTJOHQAQPFZ-UHFFFAOYSA-N 2 0 369.956 4.107 20 0 FIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000474730287 1094546185 /nfs/dbraw/zinc/54/61/85/1094546185.db2.gz PAKGNJLDCGQJJP-INIZCTEOSA-N 2 0 370.990 4.167 20 0 FIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cnc(CC(F)(F)F)s2)CC1 ZINC000896388198 1094546340 /nfs/dbraw/zinc/54/63/40/1094546340.db2.gz RZKRXHJYZNUKGL-UHFFFAOYSA-N 2 0 361.477 4.135 20 0 FIADRP Cc1ccc(CCC[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000474814005 1094658443 /nfs/dbraw/zinc/65/84/43/1094658443.db2.gz FNZVBZUIOSRJNS-OALUTQOASA-N 2 0 351.538 4.069 20 0 FIADRP C[C@@H]1CC(N2CC[NH+](C3CCCCC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168042047 1094669482 /nfs/dbraw/zinc/66/94/82/1094669482.db2.gz YHAHYUCOZFHHQK-NHCUHLMSSA-N 2 0 369.597 4.378 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000501390338 1094675861 /nfs/dbraw/zinc/67/58/61/1094675861.db2.gz VRJYTFNWOFCKMZ-GPXNEJASSA-N 2 0 363.549 4.262 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420398865 1094911725 /nfs/dbraw/zinc/91/17/25/1094911725.db2.gz ZGIFIHOHJCFTAD-CDHAZOANSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3sc4ccccc4c3Cl)CC2)C1 ZINC000420398937 1094912726 /nfs/dbraw/zinc/91/27/26/1094912726.db2.gz ZMAFOMFOVCKPLC-HOCLYGCPSA-N 2 0 364.942 4.273 20 0 FIADRP CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000502059013 1095075920 /nfs/dbraw/zinc/07/59/20/1095075920.db2.gz VHRQNFNWRLLPCZ-NFBKMPQASA-N 2 0 374.569 4.235 20 0 FIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000522551462 1095136333 /nfs/dbraw/zinc/13/63/33/1095136333.db2.gz JMFPAPRULWVHFO-KNQAVFIVSA-N 2 0 357.586 4.147 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccc(F)cc1F ZINC000420932492 1095173467 /nfs/dbraw/zinc/17/34/67/1095173467.db2.gz HHISOXNMBUGYBM-JOCHJYFZSA-N 2 0 374.475 4.284 20 0 FIADRP C[N@@H+](Cc1cccc(OCc2ccccc2F)c1)CC1CC[NH+](C)CC1 ZINC000513736524 1095236033 /nfs/dbraw/zinc/23/60/33/1095236033.db2.gz DEOVPHAVVPTOCA-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCC23CCOCC3)C1 ZINC000502279882 1095299709 /nfs/dbraw/zinc/29/97/09/1095299709.db2.gz FRMJMRAICJBJIV-UGKGYDQZSA-N 2 0 356.554 4.357 20 0 FIADRP FC(F)(F)c1ncc(CNCc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000443972248 1095388521 /nfs/dbraw/zinc/38/85/21/1095388521.db2.gz XHIRAJBRBWGKIP-UHFFFAOYSA-N 2 0 369.456 4.438 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCCC23CCOCC3)C[N@@H+]1Cc1ccccc1 ZINC000502411457 1095435430 /nfs/dbraw/zinc/43/54/30/1095435430.db2.gz ARZRCCFKBGUYFD-FCEUIQTBSA-N 2 0 356.554 4.226 20 0 FIADRP CCC1(C[NH2+][C@@H]2CCC[C@H]2CCOC)CC[NH+](Cc2ccccc2)CC1 ZINC000502428567 1095446171 /nfs/dbraw/zinc/44/61/71/1095446171.db2.gz LZNPTONPSJXKQE-FCHUYYIVSA-N 2 0 358.570 4.474 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(C2CCCC2)c1 ZINC000502458550 1095486969 /nfs/dbraw/zinc/48/69/69/1095486969.db2.gz CXQQBSQIXWNWTF-QUCCMNQESA-N 2 0 352.526 4.171 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000281260737 1095518001 /nfs/dbraw/zinc/51/80/01/1095518001.db2.gz GWRHDPLZSOCPEM-UHFFFAOYSA-N 2 0 366.509 4.287 20 0 FIADRP CO[C@H]1CCC[C@@H]2C[N@@H+]([C@@H]3C[C@@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)C[C@@H]21 ZINC001168050487 1095721081 /nfs/dbraw/zinc/72/10/81/1095721081.db2.gz BGGBUPCVJYQBFQ-DQEDLLLISA-N 2 0 356.554 4.175 20 0 FIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000502720316 1095743300 /nfs/dbraw/zinc/74/33/00/1095743300.db2.gz ATCGIPRWRFFNMM-RXVVDRJESA-N 2 0 364.961 4.347 20 0 FIADRP CCCCC[NH+]1CCN([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051345 1095807108 /nfs/dbraw/zinc/80/71/08/1095807108.db2.gz HPKXTKQDVCQABF-IUTQVRIDSA-N 2 0 357.586 4.236 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000421821293 1095932884 /nfs/dbraw/zinc/93/28/84/1095932884.db2.gz QOQAWMXWEAGIBR-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000421821926 1095934176 /nfs/dbraw/zinc/93/41/76/1095934176.db2.gz UWBSEUYNZDURJM-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccncc1Cl ZINC000421822765 1095935584 /nfs/dbraw/zinc/93/55/84/1095935584.db2.gz BHZVHKIHPZNHDT-IXDOHACOSA-N 2 0 373.928 4.195 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccncc1Cl ZINC000421828434 1095941481 /nfs/dbraw/zinc/94/14/81/1095941481.db2.gz CQWQDVCPBBUUBA-INIZCTEOSA-N 2 0 359.901 4.060 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccncc1Cl ZINC000421836134 1095946074 /nfs/dbraw/zinc/94/60/74/1095946074.db2.gz NYCILTMERUIALD-KRWDZBQOSA-N 2 0 373.928 4.103 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccncc1Cl ZINC000421855434 1095957362 /nfs/dbraw/zinc/95/73/62/1095957362.db2.gz NANFHZPMONBUFE-HNNXBMFYSA-N 2 0 359.901 4.059 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000421872390 1095982076 /nfs/dbraw/zinc/98/20/76/1095982076.db2.gz GTZLFFDXXUIJED-FVKWTLKZSA-N 2 0 355.295 4.038 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000422730676 1096464483 /nfs/dbraw/zinc/46/44/83/1096464483.db2.gz FDXQWCQFSBSEOQ-HOTGVXAUSA-N 2 0 355.526 4.264 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000422715847 1096468827 /nfs/dbraw/zinc/46/88/27/1096468827.db2.gz MUSVDZGCJOFMBK-OXQOHEQNSA-N 2 0 354.473 4.024 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+]CCCCCOC1CCCCC1 ZINC000422716801 1096469156 /nfs/dbraw/zinc/46/91/56/1096469156.db2.gz URSJOHOQHGDKGX-FYYLOGMGSA-N 2 0 372.553 4.352 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000422720674 1096470552 /nfs/dbraw/zinc/47/05/52/1096470552.db2.gz SWYHGLKKNRZIRF-LJQANCHMSA-N 2 0 362.521 4.206 20 0 FIADRP CC[C@@H]1C[C@H](C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000503581069 1096475219 /nfs/dbraw/zinc/47/52/19/1096475219.db2.gz IWODGEWXWAAZHL-FGZHOGPDSA-N 2 0 358.570 4.474 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(-c2ccncc2)cc1 ZINC000422754790 1096483652 /nfs/dbraw/zinc/48/36/52/1096483652.db2.gz ATTZZNFQFNTTNW-LADGPHEKSA-N 2 0 371.484 4.094 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000422766539 1096485244 /nfs/dbraw/zinc/48/52/44/1096485244.db2.gz RTRODTFAEAUVPM-HHXXYDBFSA-N 2 0 371.491 4.195 20 0 FIADRP CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)oc21 ZINC000422780952 1096489078 /nfs/dbraw/zinc/48/90/78/1096489078.db2.gz HZOXIBAMRDQXPA-UKRRQHHQSA-N 2 0 353.466 4.405 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422785839 1096490202 /nfs/dbraw/zinc/49/02/02/1096490202.db2.gz RUWHERPACBBDEO-HYVJGQCMSA-N 2 0 366.505 4.382 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2C)[NH2+][C@@H](C)CCC[NH3+])cc1OC ZINC000422795109 1096492321 /nfs/dbraw/zinc/49/23/21/1096492321.db2.gz ZLRZLYYRPZFSCI-PXNSSMCTSA-N 2 0 356.510 4.013 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c(OC)c1 ZINC000422797169 1096493485 /nfs/dbraw/zinc/49/34/85/1096493485.db2.gz LFZBGDIFDSIUMC-VLIAUNLRSA-N 2 0 362.901 4.164 20 0 FIADRP COc1cccc([C@@H]([NH2+][C@H](C)CCCC[NH3+])c2cc(F)ccc2OC)c1 ZINC000422824995 1096500654 /nfs/dbraw/zinc/50/06/54/1096500654.db2.gz OVODNMHTDWURLX-QVKFZJNVSA-N 2 0 360.473 4.039 20 0 FIADRP COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)c(C)c2c1 ZINC000422855005 1096505312 /nfs/dbraw/zinc/50/53/12/1096505312.db2.gz BRVHELWRBWOSQM-HIFRSBDPSA-N 2 0 353.466 4.324 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000422843263 1096509014 /nfs/dbraw/zinc/50/90/14/1096509014.db2.gz HOSWHBFIUWPOJE-CQSZACIVSA-N 2 0 359.464 4.290 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000422891341 1096515295 /nfs/dbraw/zinc/51/52/95/1096515295.db2.gz KGZFOHFNBYHEMK-QGZVFWFLSA-N 2 0 361.489 4.279 20 0 FIADRP COc1cccc(C2(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)CCCC2)c1 ZINC000422889962 1096515535 /nfs/dbraw/zinc/51/55/35/1096515535.db2.gz RARXMSIQRMRTFM-MRXNPFEDSA-N 2 0 353.510 4.020 20 0 FIADRP c1ccc(C2(C[NH2+][C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)CCCCCC2)cc1 ZINC000422909592 1096521432 /nfs/dbraw/zinc/52/14/32/1096521432.db2.gz OJHUMEDVXJRCOL-BHIFYINESA-N 2 0 356.554 4.025 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)CCCC[NH3+])CCC3)cc1 ZINC000422912912 1096522669 /nfs/dbraw/zinc/52/26/69/1096522669.db2.gz XIQUZKCRVIAFFP-WMLDXEAASA-N 2 0 359.539 4.303 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414703564 1096525012 /nfs/dbraw/zinc/52/50/12/1096525012.db2.gz CKYXUSSDKBLLED-UWJYYQICSA-N 2 0 372.557 4.185 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000422927344 1096527377 /nfs/dbraw/zinc/52/73/77/1096527377.db2.gz GFWUUDSXZLFIMN-NEPJUHHUSA-N 2 0 353.388 4.159 20 0 FIADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCN(c2nc3ccccc3s2)CC1 ZINC000422929958 1096527572 /nfs/dbraw/zinc/52/75/72/1096527572.db2.gz ANJCEJKLWZYNSZ-FUHWJXTLSA-N 2 0 372.582 4.166 20 0 FIADRP Clc1ccc(C2([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422937588 1096530485 /nfs/dbraw/zinc/53/04/85/1096530485.db2.gz OIRZQUGDXAUATJ-AZUAARDMSA-N 2 0 354.881 4.175 20 0 FIADRP CC[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc(F)ccc1F ZINC000422919202 1096532993 /nfs/dbraw/zinc/53/29/93/1096532993.db2.gz JWUNEFGMTGGITN-ZVDOUQERSA-N 2 0 358.432 4.261 20 0 FIADRP CC[C@H](C)C(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422945758 1096535719 /nfs/dbraw/zinc/53/57/19/1096535719.db2.gz NTZAARMZJUWGAE-LRGNLBRXSA-N 2 0 357.542 4.072 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](COc1ccccc1)c1ccccc1 ZINC000422959613 1096540298 /nfs/dbraw/zinc/54/02/98/1096540298.db2.gz SVSJRXIDUASOEX-JPYJTQIMSA-N 2 0 361.489 4.320 20 0 FIADRP Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422993769 1096542336 /nfs/dbraw/zinc/54/23/36/1096542336.db2.gz GDYXQTIXXUMNKC-ZPMCFJSWSA-N 2 0 353.510 4.198 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)NC[C@@H]1CCC[C@@H]([NH3+])C1)C1CCCCC1 ZINC000414710535 1096545792 /nfs/dbraw/zinc/54/57/92/1096545792.db2.gz LIYDLFVWBOQGGC-IEBWSBKVSA-N 2 0 372.557 4.090 20 0 FIADRP C[C@@H]([NH3+])C1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000414710601 1096546028 /nfs/dbraw/zinc/54/60/28/1096546028.db2.gz LOGNNJXCFCYDFU-QGZVFWFLSA-N 2 0 372.557 4.042 20 0 FIADRP FC(F)(F)COCc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423000698 1096546920 /nfs/dbraw/zinc/54/69/20/1096546920.db2.gz HEMJRCWGXKUGTE-GBESFXJTSA-N 2 0 370.459 4.166 20 0 FIADRP Cc1ccccc1O[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422996187 1096552572 /nfs/dbraw/zinc/55/25/72/1096552572.db2.gz LFCSECNWNIJUSM-UCNVEGJOSA-N 2 0 353.510 4.198 20 0 FIADRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1 ZINC000423023961 1096553737 /nfs/dbraw/zinc/55/37/37/1096553737.db2.gz KXQCIUBCTZUJBQ-YEWWUXTCSA-N 2 0 371.352 4.147 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC000423040783 1096557223 /nfs/dbraw/zinc/55/72/23/1096557223.db2.gz HXTLVNRMPHKMRG-STQMWFEESA-N 2 0 351.416 4.149 20 0 FIADRP c1ccc(COCCC2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000423052837 1096565511 /nfs/dbraw/zinc/56/55/11/1096565511.db2.gz QOLZEYAXYWTQNX-YPAWHYETSA-N 2 0 356.554 4.274 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089877 1096570900 /nfs/dbraw/zinc/57/09/00/1096570900.db2.gz WETDCLKTZGYCIL-RZUBCFFCSA-N 2 0 352.453 4.049 20 0 FIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423092003 1096572038 /nfs/dbraw/zinc/57/20/38/1096572038.db2.gz ACUYERBTVRUBHS-HBPKQZLHSA-N 2 0 370.443 4.056 20 0 FIADRP CCc1ccc([C@@H](C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)N(CC)CC)cc1 ZINC000423121685 1096579185 /nfs/dbraw/zinc/57/91/85/1096579185.db2.gz BAPXNGWXRBXUCD-UZUQRXQVSA-N 2 0 368.569 4.145 20 0 FIADRP Fc1cc(C2CC2)ccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423123498 1096579273 /nfs/dbraw/zinc/57/92/73/1096579273.db2.gz DZWCBMMHAPJHEK-IRLDBZIGSA-N 2 0 352.453 4.049 20 0 FIADRP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423172907 1096603278 /nfs/dbraw/zinc/60/32/78/1096603278.db2.gz VXVHZQRNSJKUDA-HAXDFEGKSA-N 2 0 372.871 4.181 20 0 FIADRP COc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1OC ZINC000423239570 1096618370 /nfs/dbraw/zinc/61/83/70/1096618370.db2.gz BJKVOEUTDVMGFE-BTYIYWSLSA-N 2 0 374.912 4.036 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423228994 1096624826 /nfs/dbraw/zinc/62/48/26/1096624826.db2.gz GGBZQPXLDDFPLY-GCVQQVDUSA-N 2 0 365.237 4.388 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cc(F)ccc2F)c1 ZINC000423247064 1096628851 /nfs/dbraw/zinc/62/88/51/1096628851.db2.gz KQMDBYUYLMXUKO-JLTOFOAXSA-N 2 0 362.489 4.365 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423248781 1096629908 /nfs/dbraw/zinc/62/99/08/1096629908.db2.gz NUOXRKWHDNFYNP-DNVCBOLYSA-N 2 0 359.311 4.128 20 0 FIADRP Brc1ccccc1[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000423254519 1096631742 /nfs/dbraw/zinc/63/17/42/1096631742.db2.gz YHQICKSSCPSHFQ-BEFAXECRSA-N 2 0 359.311 4.128 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccco2)cc1 ZINC000423260761 1096633575 /nfs/dbraw/zinc/63/35/75/1096633575.db2.gz QPZVIRXYYNAYHD-KBXCAEBGSA-N 2 0 363.299 4.111 20 0 FIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)NCC(C)(C)[NH3+] ZINC000423287018 1096634932 /nfs/dbraw/zinc/63/49/32/1096634932.db2.gz JWYAPJYTTOHJHJ-JTQLQIEISA-N 2 0 368.344 4.269 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000423291487 1096636202 /nfs/dbraw/zinc/63/62/02/1096636202.db2.gz IMECAIKMSBVCMK-DIFFPNOSSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000423291489 1096636245 /nfs/dbraw/zinc/63/62/45/1096636245.db2.gz IMECAIKMSBVCMK-PIGZYNQJSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000423290425 1096636282 /nfs/dbraw/zinc/63/62/82/1096636282.db2.gz CXGJZLNMUPOLDH-ADLMAVQZSA-N 2 0 363.274 4.385 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000423294529 1096643673 /nfs/dbraw/zinc/64/36/73/1096643673.db2.gz UQMHCAGTXVKGDF-KGLIPLIRSA-N 2 0 352.400 4.498 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000423344881 1096646769 /nfs/dbraw/zinc/64/67/69/1096646769.db2.gz XDVDZCDARIVEIS-SJORKVTESA-N 2 0 351.494 4.333 20 0 FIADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423347970 1096647807 /nfs/dbraw/zinc/64/78/07/1096647807.db2.gz ROBYJOSTTYPQNG-JTQLQIEISA-N 2 0 363.221 4.038 20 0 FIADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423330453 1096648850 /nfs/dbraw/zinc/64/88/50/1096648850.db2.gz BXFHBOWJYYMFGV-SNVBAGLBSA-N 2 0 352.322 4.295 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cc1 ZINC000423341461 1096650882 /nfs/dbraw/zinc/65/08/82/1096650882.db2.gz UMUUJEXIACWEBD-IRXDYDNUSA-N 2 0 351.494 4.191 20 0 FIADRP Cc1n[nH]cc1C1CC[NH+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC000664347161 1096655841 /nfs/dbraw/zinc/65/58/41/1096655841.db2.gz FMCVBLINECBTSD-UHFFFAOYSA-N 2 0 352.526 4.084 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CC2)c1 ZINC000423384296 1096662950 /nfs/dbraw/zinc/66/29/50/1096662950.db2.gz KSWOAUYLHAUBSE-LJQANCHMSA-N 2 0 362.395 4.429 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1OC ZINC000423393627 1096663997 /nfs/dbraw/zinc/66/39/97/1096663997.db2.gz QSWMRBVIYWPSAB-MRXNPFEDSA-N 2 0 354.494 4.328 20 0 FIADRP COCC1(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)CC[NH2+]CC1 ZINC000423410585 1096675065 /nfs/dbraw/zinc/67/50/65/1096675065.db2.gz SFCCWHBISOLRNO-KRWDZBQOSA-N 2 0 358.448 4.008 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423448983 1096680033 /nfs/dbraw/zinc/68/00/33/1096680033.db2.gz VRJKFEZZAJORTO-MDASCCDHSA-N 2 0 355.551 4.081 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000423427708 1096682089 /nfs/dbraw/zinc/68/20/89/1096682089.db2.gz ISIRVUAJAIINPN-MSOLQXFVSA-N 2 0 366.509 4.081 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000423457361 1096688079 /nfs/dbraw/zinc/68/80/79/1096688079.db2.gz OWBRHMQTFWOJKF-ZJUUUORDSA-N 2 0 353.226 4.246 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000423459989 1096689175 /nfs/dbraw/zinc/68/91/75/1096689175.db2.gz APWLIRUCJPTCCI-KHIZAZIESA-N 2 0 355.295 4.146 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCS2 ZINC000423472390 1096694296 /nfs/dbraw/zinc/69/42/96/1096694296.db2.gz FUXOJKCSKPTHEA-ZFWWWQNUSA-N 2 0 355.345 4.108 20 0 FIADRP COc1ccc(C[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccc(OC)cc2)cc1 ZINC000423471274 1096694396 /nfs/dbraw/zinc/69/43/96/1096694396.db2.gz DXWUSYAMGXWNNR-OFNKIYASSA-N 2 0 368.521 4.109 20 0 FIADRP CCc1nc(C)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)s1 ZINC000423478075 1096696917 /nfs/dbraw/zinc/69/69/17/1096696917.db2.gz SZTJVIMMCJVYEK-QANKJYHBSA-N 2 0 361.530 4.197 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423454002 1096699754 /nfs/dbraw/zinc/69/97/54/1096699754.db2.gz LFYSXRFTMWYMBA-FZKQIMNGSA-N 2 0 365.290 4.395 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000423496281 1096708138 /nfs/dbraw/zinc/70/81/38/1096708138.db2.gz GKCGSLBYHBVKSY-NIKGAXFTSA-N 2 0 359.311 4.256 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000423515705 1096711174 /nfs/dbraw/zinc/71/11/74/1096711174.db2.gz SVLXDMBHFUWVIF-BBEGDGIKSA-N 2 0 350.840 4.425 20 0 FIADRP COC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000423518082 1096712038 /nfs/dbraw/zinc/71/20/38/1096712038.db2.gz ZFXKQCBTQSGIQX-OALUTQOASA-N 2 0 366.427 4.463 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423536849 1096715723 /nfs/dbraw/zinc/71/57/23/1096715723.db2.gz IHHCVIFELWRMBP-FQEVSTJZSA-N 2 0 358.432 4.277 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)s2)cc1 ZINC000423540292 1096716899 /nfs/dbraw/zinc/71/68/99/1096716899.db2.gz JPDJCDBSICYUHU-VIBAHUMZSA-N 2 0 371.550 4.166 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@H]3C1)CCC2 ZINC000423543573 1096717672 /nfs/dbraw/zinc/71/76/72/1096717672.db2.gz NGGMAFTWCSWMRF-ATNYBXOESA-N 2 0 371.525 4.304 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423547816 1096718356 /nfs/dbraw/zinc/71/83/56/1096718356.db2.gz QGRRWKNNMFVPBQ-CWLKWCNXSA-N 2 0 371.525 4.304 20 0 FIADRP C[C@@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1csc(Cl)c1 ZINC000423580737 1096724905 /nfs/dbraw/zinc/72/49/05/1096724905.db2.gz YHRXKMGYONSUNO-OAHLLOKOSA-N 2 0 363.958 4.046 20 0 FIADRP CCc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2cccc(C[NH+](CC)CC)c2)cc1 ZINC000515527142 1098664104 /nfs/dbraw/zinc/66/41/04/1098664104.db2.gz XVVZIJDLNRNYSJ-GOSISDBHSA-N 2 0 367.537 4.208 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CCOC4(CCCC4)C2)C3)cc1 ZINC000245743292 1098708658 /nfs/dbraw/zinc/70/86/58/1098708658.db2.gz RYRZWWPQBCZTIA-YSFYHYPLSA-N 2 0 354.538 4.263 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000515591805 1098758314 /nfs/dbraw/zinc/75/83/14/1098758314.db2.gz AYROVRJGKKNTME-NQIIRXRSSA-N 2 0 354.542 4.078 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cs1 ZINC000436281581 1098883926 /nfs/dbraw/zinc/88/39/26/1098883926.db2.gz QAEQDIPKWAVJTC-UHFFFAOYSA-N 2 0 366.534 4.414 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2c(-c3ccccc3)nc3ccccn32)CC1 ZINC000533248119 1098909618 /nfs/dbraw/zinc/90/96/18/1098909618.db2.gz DQHMXJGSAMQKFH-UHFFFAOYSA-N 2 0 362.521 4.165 20 0 FIADRP Cc1cccc(C)c1NC(=O)CCC[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000533271625 1098922470 /nfs/dbraw/zinc/92/24/70/1098922470.db2.gz HSFQKLFBQIQQOL-UHFFFAOYSA-N 2 0 359.558 4.074 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)ccc1OC ZINC000841762547 1098959298 /nfs/dbraw/zinc/95/92/98/1098959298.db2.gz XIUDIHMJAVEQBQ-HTAPYJJXSA-N 2 0 368.521 4.459 20 0 FIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000437083788 1099588779 /nfs/dbraw/zinc/58/87/79/1099588779.db2.gz JDDREDCXJUCMKR-HCXYKTFWSA-N 2 0 354.460 4.464 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)[C@H](C)C1 ZINC000437090286 1099594539 /nfs/dbraw/zinc/59/45/39/1099594539.db2.gz AGSNXTKBMJPFAI-PNJWGLBASA-N 2 0 358.570 4.124 20 0 FIADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000261638413 1099628329 /nfs/dbraw/zinc/62/83/29/1099628329.db2.gz AAIOGQSUSDHMKN-MRXNPFEDSA-N 2 0 359.311 4.157 20 0 FIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000516620384 1099661281 /nfs/dbraw/zinc/66/12/81/1099661281.db2.gz KIKCWIASHAENLH-BDHVOXNPSA-N 2 0 356.554 4.365 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)cc1O ZINC000437350645 1099820746 /nfs/dbraw/zinc/82/07/46/1099820746.db2.gz WHSKDSNIMSRXHC-XLIONFOSSA-N 2 0 360.542 4.109 20 0 FIADRP C[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693518 1099823906 /nfs/dbraw/zinc/82/39/06/1099823906.db2.gz CVCMDXPYEWRFFT-WIYYLYMNSA-N 2 0 372.940 4.357 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c1 ZINC000162529435 1099826759 /nfs/dbraw/zinc/82/67/59/1099826759.db2.gz ULAPSZZBQDNIEU-LJQANCHMSA-N 2 0 360.498 4.093 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000508703640 1099858107 /nfs/dbraw/zinc/85/81/07/1099858107.db2.gz ZEWFWECILGOBCE-SXWKCWPCSA-N 2 0 374.532 4.434 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508708804 1099887776 /nfs/dbraw/zinc/88/77/76/1099887776.db2.gz DVUPAKPBNYOWIJ-KNQAVFIVSA-N 2 0 351.538 4.379 20 0 FIADRP C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710597 1099894615 /nfs/dbraw/zinc/89/46/15/1099894615.db2.gz NAZDZNSHSMPOJW-AZUAARDMSA-N 2 0 352.497 4.358 20 0 FIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508709954 1099898079 /nfs/dbraw/zinc/89/80/79/1099898079.db2.gz KMABGVMTWSFDSH-SIKLNZKXSA-N 2 0 351.538 4.379 20 0 FIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2ccccc21 ZINC000516890980 1099912420 /nfs/dbraw/zinc/91/24/20/1099912420.db2.gz YGKHHFYYAWEJHJ-FGZHOGPDSA-N 2 0 367.537 4.386 20 0 FIADRP C[C@H]([NH2+]CCCN(C)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721444 1099937397 /nfs/dbraw/zinc/93/73/97/1099937397.db2.gz USOMYRFZJVVIBK-UNMCSNQZSA-N 2 0 351.538 4.013 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508723169 1099943391 /nfs/dbraw/zinc/94/33/91/1099943391.db2.gz VHPAPWKLYIFFAW-PMVMPFDFSA-N 2 0 363.549 4.013 20 0 FIADRP Cc1nn(C)cc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000517043185 1100014801 /nfs/dbraw/zinc/01/48/01/1100014801.db2.gz LQFFECVKINIYCB-DTHFOOOUSA-N 2 0 372.944 4.086 20 0 FIADRP Cc1nn(C)cc1C[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000517043186 1100015137 /nfs/dbraw/zinc/01/51/37/1100015137.db2.gz LQFFECVKINIYCB-QNKZKCNHSA-N 2 0 372.944 4.086 20 0 FIADRP COc1ccccc1/C=C\CN(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536673997 1100161595 /nfs/dbraw/zinc/16/15/95/1100161595.db2.gz IZXRIRAWACNKRJ-UOMAQRANSA-N 2 0 350.506 4.162 20 0 FIADRP CO[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459447353 1100182849 /nfs/dbraw/zinc/18/28/49/1100182849.db2.gz QJKGZTUBIWMIKR-YWZLYKJASA-N 2 0 359.901 4.070 20 0 FIADRP Cc1nc2scc(C3CC3)n2c1C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000459455484 1100197307 /nfs/dbraw/zinc/19/73/07/1100197307.db2.gz DCMCMKJZRKPBJH-UHFFFAOYSA-N 2 0 372.513 4.072 20 0 FIADRP Fc1cccc([C@H]([NH2+]Cc2cc(C3CC[NH2+]CC3)no2)C2CCCC2)c1 ZINC000425898985 1100198193 /nfs/dbraw/zinc/19/81/93/1100198193.db2.gz KCSBOEQEIMHPNS-OAQYLSRUSA-N 2 0 357.473 4.302 20 0 FIADRP CCN(Cc1c[nH]nc1C(C)(C)C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536709559 1100225189 /nfs/dbraw/zinc/22/51/89/1100225189.db2.gz GESMXMXQTNPNMT-IBGZPJMESA-N 2 0 354.542 4.051 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000536708907 1100227076 /nfs/dbraw/zinc/22/70/76/1100227076.db2.gz BPAIESYYWXUOGA-UHFFFAOYSA-N 2 0 370.537 4.171 20 0 FIADRP Cc1ccc2ncc(C[NH+]3CCC(CC[N@H+]4CCCC[C@@H]4C)CC3)n2c1 ZINC000536711573 1100229682 /nfs/dbraw/zinc/22/96/82/1100229682.db2.gz ZBGDIXHTWJHNNY-IBGZPJMESA-N 2 0 354.542 4.119 20 0 FIADRP C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000379628432 1100244329 /nfs/dbraw/zinc/24/43/29/1100244329.db2.gz JAOGPJPPFIUSTM-LQWHRVPQSA-N 2 0 366.505 4.162 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000536844245 1100356544 /nfs/dbraw/zinc/35/65/44/1100356544.db2.gz HWSNDMDHWMMEEG-NJDAHSKKSA-N 2 0 362.945 4.075 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536849935 1100363292 /nfs/dbraw/zinc/36/32/92/1100363292.db2.gz CBZLDBKSNAQGEO-OTWHNJEPSA-N 2 0 371.352 4.412 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536849934 1100364170 /nfs/dbraw/zinc/36/41/70/1100364170.db2.gz CBZLDBKSNAQGEO-IPMKNSEASA-N 2 0 371.352 4.412 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000536853249 1100366926 /nfs/dbraw/zinc/36/69/26/1100366926.db2.gz QVFMRDNKOVNWMD-NDXORKPFSA-N 2 0 362.583 4.216 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)ccc1OCC(C)C ZINC000459662962 1100410200 /nfs/dbraw/zinc/41/02/00/1100410200.db2.gz VWBBJFGHSITLMK-UHFFFAOYSA-N 2 0 353.466 4.058 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Br)cc2)C1 ZINC000517536621 1100459400 /nfs/dbraw/zinc/45/94/00/1100459400.db2.gz UVDLWSNEMFZPGZ-HZPDHXFCSA-N 2 0 353.348 4.297 20 0 FIADRP CCN1CCC([NH+]2CCC(C(=O)Nc3cccc(C4CCC4)c3)CC2)CC1 ZINC000517756757 1100643341 /nfs/dbraw/zinc/64/33/41/1100643341.db2.gz MOLMECHTWYMCEE-UHFFFAOYSA-N 2 0 369.553 4.089 20 0 FIADRP COc1cccc2c1CC[C@@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)C2 ZINC000426034474 1100700747 /nfs/dbraw/zinc/70/07/47/1100700747.db2.gz FXIPIHPIWYYQGY-NYLDSWQDSA-N 2 0 356.554 4.185 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C1(C)CC[NH2+]CC1 ZINC000414948114 1100900314 /nfs/dbraw/zinc/90/03/14/1100900314.db2.gz XOYGIHAVPFXRAO-UHFFFAOYSA-N 2 0 360.505 4.079 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000414951630 1100911532 /nfs/dbraw/zinc/91/15/32/1100911532.db2.gz HUVQUJOUDSRMQE-HNAYVOBHSA-N 2 0 374.912 4.015 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1O ZINC000426158163 1100920000 /nfs/dbraw/zinc/92/00/00/1100920000.db2.gz AKKHJIWHPDXAFG-SFHVURJKSA-N 2 0 370.537 4.352 20 0 FIADRP Cc1ccc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C[NH+](C)C)c1 ZINC000438846347 1100966432 /nfs/dbraw/zinc/96/64/32/1100966432.db2.gz ASAKFBQHTXUVCA-TZIWHRDSSA-N 2 0 351.538 4.379 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439143898 1101198775 /nfs/dbraw/zinc/19/87/75/1101198775.db2.gz TUZHBTKWYDFZNP-WOSRLPQWSA-N 2 0 357.361 4.424 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)s1 ZINC000439146574 1101200799 /nfs/dbraw/zinc/20/07/99/1101200799.db2.gz NCKPQBPJXULECY-XJKCOSOUSA-N 2 0 355.345 4.178 20 0 FIADRP CCCc1nc(C)c(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)o1 ZINC000426301231 1101233218 /nfs/dbraw/zinc/23/32/18/1101233218.db2.gz LTXXDYUGDZPZTB-UHFFFAOYSA-N 2 0 355.526 4.468 20 0 FIADRP Brc1ccccc1C1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000426325186 1101259226 /nfs/dbraw/zinc/25/92/26/1101259226.db2.gz UMODVYFKWBLHCM-HZPDHXFCSA-N 2 0 363.343 4.087 20 0 FIADRP CC1(C)Cc2ccc(Br)cc2[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000426335052 1101288623 /nfs/dbraw/zinc/28/86/23/1101288623.db2.gz NKPOUSQBKFKIPI-JZXOWHBKSA-N 2 0 363.343 4.289 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000536954544 1101370023 /nfs/dbraw/zinc/37/00/23/1101370023.db2.gz KARFAPMZMBQAMR-FQEVSTJZSA-N 2 0 353.466 4.082 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000537012762 1101394364 /nfs/dbraw/zinc/39/43/64/1101394364.db2.gz GFQJJGAWMNTMGF-FQEVSTJZSA-N 2 0 357.498 4.227 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@@H](C)O[C@H](C)C3)oc21 ZINC000537303646 1101627819 /nfs/dbraw/zinc/62/78/19/1101627819.db2.gz HEBAGZGGBGXKII-KURKYZTESA-N 2 0 374.525 4.372 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)Cc1cccs1 ZINC000537312950 1101643419 /nfs/dbraw/zinc/64/34/19/1101643419.db2.gz WUADSSIMVAWISE-GOSISDBHSA-N 2 0 371.594 4.247 20 0 FIADRP C[N@H+]1CC=C(C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000537384500 1101721030 /nfs/dbraw/zinc/72/10/30/1101721030.db2.gz SAOYRPIKUHELHC-UHFFFAOYSA-N 2 0 350.506 4.050 20 0 FIADRP C[C@H](Cc1ccc(Cl)cc1)[N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168165529 1101758775 /nfs/dbraw/zinc/75/87/75/1101758775.db2.gz DOYGEXFXNBRVOH-OZOXKJRCSA-N 2 0 357.929 4.438 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(C)c1 ZINC000519168600 1101983725 /nfs/dbraw/zinc/98/37/25/1101983725.db2.gz KTKIIAJAILBIIQ-DHIUTWEWSA-N 2 0 352.522 4.193 20 0 FIADRP C[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@@]1(C)C[NH3+] ZINC000415050976 1102262217 /nfs/dbraw/zinc/26/22/17/1102262217.db2.gz FGJVGNCEZYNHIQ-QVKFZJNVSA-N 2 0 371.912 4.009 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)ccc1F ZINC000120938484 1102284585 /nfs/dbraw/zinc/28/45/85/1102284585.db2.gz MNLVOTIOBNCESH-FQEVSTJZSA-N 2 0 354.469 4.423 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000187585684 1102285666 /nfs/dbraw/zinc/28/56/66/1102285666.db2.gz IKFNAQORNMPVMQ-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP O[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1c(Cl)cccc1Cl ZINC001167967525 1102287971 /nfs/dbraw/zinc/28/79/71/1102287971.db2.gz GQAZYGCBTHGMDH-KRWWSPQJSA-N 2 0 369.336 4.022 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)ccc1Oc1cccnc1 ZINC000415075527 1102291508 /nfs/dbraw/zinc/29/15/08/1102291508.db2.gz BQFBVJOJCGPGAE-YZGWKJHDSA-N 2 0 355.457 4.023 20 0 FIADRP Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000187780845 1102316927 /nfs/dbraw/zinc/31/69/27/1102316927.db2.gz BYXUPDNCQYCIDD-LNLFQRSKSA-N 2 0 352.526 4.114 20 0 FIADRP CC(C)C[NH+]1CCC(N[C@H](C)c2cc(Br)ccc2F)CC1 ZINC000532451930 1102342611 /nfs/dbraw/zinc/34/26/11/1102342611.db2.gz ZWSPQUGSENFICW-CYBMUJFWSA-N 2 0 357.311 4.359 20 0 FIADRP CC(C)CC[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000532449816 1102347640 /nfs/dbraw/zinc/34/76/40/1102347640.db2.gz LTONJEGAJAVFEL-NRFANRHFSA-N 2 0 365.993 4.435 20 0 FIADRP C[C@@H]([NH2+]C1CCN(c2ccccn2)CC1)c1cccc(Br)c1 ZINC000121368216 1102390642 /nfs/dbraw/zinc/39/06/42/1102390642.db2.gz VBOPHDJGUHLAAR-CQSZACIVSA-N 2 0 360.299 4.164 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(OC(F)F)c1 ZINC000122327502 1102558318 /nfs/dbraw/zinc/55/83/18/1102558318.db2.gz JQMWHNPMUSHEBA-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000122300381 1102560756 /nfs/dbraw/zinc/56/07/56/1102560756.db2.gz RZWOJQBHBWOMFD-LJQANCHMSA-N 2 0 374.912 4.284 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000550886167 1102658068 /nfs/dbraw/zinc/65/80/68/1102658068.db2.gz DULXXGIHWOIAPA-HSZRJFAPSA-N 2 0 368.521 4.280 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](O)CCc2ccccc2)CC1 ZINC000550907643 1102666293 /nfs/dbraw/zinc/66/62/93/1102666293.db2.gz UPQGOPQUIIMXDB-KXTRFFEISA-N 2 0 366.549 4.013 20 0 FIADRP Fc1ccc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000537650466 1102691310 /nfs/dbraw/zinc/69/13/10/1102691310.db2.gz HFTBCRYWOGJRFI-UHFFFAOYSA-N 2 0 370.516 4.304 20 0 FIADRP COc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC1 ZINC001167979098 1102738076 /nfs/dbraw/zinc/73/80/76/1102738076.db2.gz VEPQJGLUKDRICC-FRIKZZABSA-N 2 0 368.565 4.403 20 0 FIADRP C[N@@H+]1CC[C@H](NC[C@H](c2cccs2)[NH+]2CCCC2)C[C@H]1c1ccccc1 ZINC000550977393 1102740237 /nfs/dbraw/zinc/74/02/37/1102740237.db2.gz SZRQCIVKSMDKPC-PCCBWWKXSA-N 2 0 369.578 4.310 20 0 FIADRP Cc1nocc1C[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000550217257 1102768356 /nfs/dbraw/zinc/76/83/56/1102768356.db2.gz RHWOVPNMWFLNBD-FOUFQHLJSA-N 2 0 359.901 4.340 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cc1N(C)C ZINC000123054851 1102774340 /nfs/dbraw/zinc/77/43/40/1102774340.db2.gz RQMUDZPIXDGQTA-KRWDZBQOSA-N 2 0 355.501 4.338 20 0 FIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000123703854 1102785370 /nfs/dbraw/zinc/78/53/70/1102785370.db2.gz CUYBVWVLTAFTOE-AWEZNQCLSA-N 2 0 362.901 4.270 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000551013469 1102788743 /nfs/dbraw/zinc/78/87/43/1102788743.db2.gz BYUFYGOVVRKVIV-DNQXCXABSA-N 2 0 365.565 4.452 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC3CCN(c4cc[nH+]cc4)CC3)cc2)C1 ZINC000459335994 1102846038 /nfs/dbraw/zinc/84/60/38/1102846038.db2.gz BLEBMSVZCWXJOF-LJQANCHMSA-N 2 0 364.537 4.394 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550263043 1102882109 /nfs/dbraw/zinc/88/21/09/1102882109.db2.gz TXJDBJUKPQNNND-HJNYFJLDSA-N 2 0 356.554 4.084 20 0 FIADRP CN1CC[C@@H]([NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@@H]1c1ccccc1 ZINC000551086694 1102905495 /nfs/dbraw/zinc/90/54/95/1102905495.db2.gz ARNFEWTYCMDCBO-TZWRJOPASA-N 2 0 372.553 4.312 20 0 FIADRP C[NH+](C)CC1CC[NH+](CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000506875943 1102936447 /nfs/dbraw/zinc/93/64/47/1102936447.db2.gz PHMGQTUTSNYGAV-UHFFFAOYSA-N 2 0 355.309 4.043 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1OCc1ccccc1 ZINC000506942951 1102963702 /nfs/dbraw/zinc/96/37/02/1102963702.db2.gz DQVNJQMVJHRCNP-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3nc4ccccc4s3)CC2)C[C@@H](C)O1 ZINC000426808531 1103005619 /nfs/dbraw/zinc/00/56/19/1103005619.db2.gz RWYGXRZPKPORJB-IAGOWNOFSA-N 2 0 373.566 4.008 20 0 FIADRP CCCCOc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1OC ZINC000459378847 1103041939 /nfs/dbraw/zinc/04/19/39/1103041939.db2.gz RNCQMRKPBLNIRD-UHFFFAOYSA-N 2 0 369.509 4.028 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000551373788 1103157009 /nfs/dbraw/zinc/15/70/09/1103157009.db2.gz ZNHJVHBNQMTTHO-OAHLLOKOSA-N 2 0 360.448 4.289 20 0 FIADRP C[C@H](CCc1ccccc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551374693 1103158960 /nfs/dbraw/zinc/15/89/60/1103158960.db2.gz NSNIJUGCLJLRPY-LJQANCHMSA-N 2 0 352.522 4.271 20 0 FIADRP Fc1ccc(C(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccc(F)cc2)cc1 ZINC000666993678 1103306210 /nfs/dbraw/zinc/30/62/10/1103306210.db2.gz BBNQCAPWOQSOKG-FQEVSTJZSA-N 2 0 356.460 4.361 20 0 FIADRP C[C@@H]1[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H]1c1ccccc1 ZINC000551817233 1103676947 /nfs/dbraw/zinc/67/69/47/1103676947.db2.gz OQXDBXUPQXKHRJ-NWVWQQAFSA-N 2 0 364.533 4.441 20 0 FIADRP Cc1nccnc1[C@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000187991426 1103731698 /nfs/dbraw/zinc/73/16/98/1103731698.db2.gz OUQXDMADUJMCME-IBGZPJMESA-N 2 0 366.553 4.171 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000519672256 1103784137 /nfs/dbraw/zinc/78/41/37/1103784137.db2.gz JTAJXNHKKVUZPB-SSZFMOIBSA-N 2 0 352.469 4.496 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])on1 ZINC000519763912 1103835331 /nfs/dbraw/zinc/83/53/31/1103835331.db2.gz HYGDQQBPRITAPU-LPHOPBHVSA-N 2 0 365.477 4.111 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[N@@H+]2C[C@H](C)[C@H](C)C2)cc1)c1cscn1 ZINC000538193968 1104029013 /nfs/dbraw/zinc/02/90/13/1104029013.db2.gz GCSDCCBGVPGJQR-KSZLIROESA-N 2 0 373.566 4.003 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CCCC1 ZINC000538295090 1104111803 /nfs/dbraw/zinc/11/18/03/1104111803.db2.gz YCEAYLCXRDVVBC-HXUWFJFHSA-N 2 0 372.553 4.161 20 0 FIADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538295260 1104113726 /nfs/dbraw/zinc/11/37/26/1104113726.db2.gz BILCWCWOROWOPR-APWZRJJASA-N 2 0 356.535 4.257 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441404538 1104344319 /nfs/dbraw/zinc/34/43/19/1104344319.db2.gz SWRMFXUHNWBXTA-VQIMIIECSA-N 2 0 368.443 4.076 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1F ZINC000112524928 1104374804 /nfs/dbraw/zinc/37/48/04/1104374804.db2.gz KMOANTAJSZZGLZ-KSZLIROESA-N 2 0 356.485 4.286 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc2ccccc2s1 ZINC000188446023 1104468991 /nfs/dbraw/zinc/46/89/91/1104468991.db2.gz XUCAOQDJHDBBGP-JXFKEZNVSA-N 2 0 366.530 4.319 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cccc(CO)c1 ZINC000536308614 1104660491 /nfs/dbraw/zinc/66/04/91/1104660491.db2.gz OGMAVMJMVSIKEC-RTBURBONSA-N 2 0 352.522 4.404 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2c(Cl)oc3ccccc32)C[C@@H](C)O1 ZINC000536413737 1104916466 /nfs/dbraw/zinc/91/64/66/1104916466.db2.gz DJXIPGRQWQXMMC-HUUCEWRRSA-N 2 0 350.890 4.065 20 0 FIADRP Brc1ccc([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)s1 ZINC000190582852 1104933910 /nfs/dbraw/zinc/93/39/10/1104933910.db2.gz XLJZIAMMGFUNAK-BDJLRTHQSA-N 2 0 355.345 4.036 20 0 FIADRP Brc1ccc([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)s1 ZINC000190582813 1104934067 /nfs/dbraw/zinc/93/40/67/1104934067.db2.gz XLJZIAMMGFUNAK-MEDUHNTESA-N 2 0 355.345 4.036 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000190591937 1104944272 /nfs/dbraw/zinc/94/42/72/1104944272.db2.gz COAPLIBVVAIELN-MLGOLLRUSA-N 2 0 357.361 4.283 20 0 FIADRP OCCCCCC[N@H+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001168002769 1104990548 /nfs/dbraw/zinc/99/05/48/1104990548.db2.gz XODGRPXYWGMPHX-VSGJHWFKSA-N 2 0 370.581 4.447 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152415682 1105105034 /nfs/dbraw/zinc/10/50/34/1105105034.db2.gz UUNSJICMJIERPT-WBMJQRKESA-N 2 0 355.309 4.281 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000474006159 1105110294 /nfs/dbraw/zinc/11/02/94/1105110294.db2.gz FSICWOOYTGLLCU-CQSZACIVSA-N 2 0 350.397 4.312 20 0 FIADRP C[C@H]1CC(NC(=[NH2+])c2ccc(Cl)nc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008125 1105162797 /nfs/dbraw/zinc/16/27/97/1105162797.db2.gz CTJRMMJYALOGQE-GJZGRUSLSA-N 2 0 356.901 4.092 20 0 FIADRP CC(C)(C)c1cnc(CN2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)o1 ZINC000536486617 1105167346 /nfs/dbraw/zinc/16/73/46/1105167346.db2.gz SRYINGYFXDHHQH-UHFFFAOYSA-N 2 0 367.537 4.460 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000507934437 1105270545 /nfs/dbraw/zinc/27/05/45/1105270545.db2.gz HCWHQACTFNVKCC-VCWRXUFXSA-N 2 0 366.590 4.235 20 0 FIADRP c1cc2c(o1)CCC[C@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000192930171 1106905492 /nfs/dbraw/zinc/90/54/92/1106905492.db2.gz LCXODXVLVCGPFR-JOCHJYFZSA-N 2 0 368.521 4.318 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)C(C)C ZINC000228652625 1106907131 /nfs/dbraw/zinc/90/71/31/1106907131.db2.gz QKVAPYSWDDQCAU-WOJBJXKFSA-N 2 0 373.585 4.015 20 0 FIADRP CC(C)Cc1ccccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530210045 1106913298 /nfs/dbraw/zinc/91/32/98/1106913298.db2.gz KSNFGINOIGCUNC-GMAHTHKFSA-N 2 0 350.506 4.231 20 0 FIADRP CC(C)Cc1ccccc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530210046 1106913450 /nfs/dbraw/zinc/91/34/50/1106913450.db2.gz KSNFGINOIGCUNC-JTHBVZDNSA-N 2 0 350.506 4.231 20 0 FIADRP [NH3+][C@H]1C[C@H]([NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c2ccccc21 ZINC000530209551 1106913459 /nfs/dbraw/zinc/91/34/59/1106913459.db2.gz IQJYJOGXNSFYNN-PMACEKPBSA-N 2 0 366.509 4.127 20 0 FIADRP OC1(C[NH2+]C2CC[NH+](C3CCCC3)CC2)CCC(c2ccccc2)CC1 ZINC000530232502 1106919824 /nfs/dbraw/zinc/91/98/24/1106919824.db2.gz QKNVXZJFULSHFF-UHFFFAOYSA-N 2 0 356.554 4.072 20 0 FIADRP c1cc(-c2ccccc2)sc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530249878 1106930440 /nfs/dbraw/zinc/93/04/40/1106930440.db2.gz ZOQWXPONEPMTCG-LJQANCHMSA-N 2 0 356.535 4.006 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CCC3(CCCC3)O2)CC1 ZINC000530517514 1107097636 /nfs/dbraw/zinc/09/76/36/1107097636.db2.gz ZVLTUEPWRKICDP-JOCHJYFZSA-N 2 0 356.554 4.322 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC000530517515 1107098131 /nfs/dbraw/zinc/09/81/31/1107098131.db2.gz ZVLTUEPWRKICDP-QFIPXVFZSA-N 2 0 356.554 4.322 20 0 FIADRP Cc1ccc2[nH+]ccc(NCc3ccccc3C[NH+]3CCC(O)CC3)c2c1 ZINC000302137815 1107313769 /nfs/dbraw/zinc/31/37/69/1107313769.db2.gz CBIOQRJHBJCEPC-UHFFFAOYSA-N 2 0 361.489 4.112 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000475577525 1107788305 /nfs/dbraw/zinc/78/83/05/1107788305.db2.gz ZBEIYJCPGCQEJR-YLJYHZDGSA-N 2 0 350.441 4.141 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccsc2)cc1 ZINC000444658087 1108053110 /nfs/dbraw/zinc/05/31/10/1108053110.db2.gz AFYCSLINWWBDRQ-HKBOAZHASA-N 2 0 356.535 4.099 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000531676621 1108063642 /nfs/dbraw/zinc/06/36/42/1108063642.db2.gz YVWQTMPPUVIJQC-PWHSHALESA-N 2 0 374.532 4.358 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000531676622 1108064073 /nfs/dbraw/zinc/06/40/73/1108064073.db2.gz YVWQTMPPUVIJQC-SELNLUPBSA-N 2 0 374.532 4.358 20 0 FIADRP C[C@H](C[NH+]1CC[C@@H](CC(F)(F)F)C1)C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444714761 1108087892 /nfs/dbraw/zinc/08/78/92/1108087892.db2.gz KSZILCIPCHAYBN-BTTYYORXSA-N 2 0 360.386 4.171 20 0 FIADRP FC(F)(F)C[C@@H]1CC[NH+](C/C=C/C[N@H+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000444689651 1108091936 /nfs/dbraw/zinc/09/19/36/1108091936.db2.gz GPEXYPOOJRBXIA-FAVCQXFFSA-N 2 0 358.370 4.091 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000531717590 1108110261 /nfs/dbraw/zinc/11/02/61/1108110261.db2.gz IJXQVEXVGKAOPC-MRXNPFEDSA-N 2 0 352.494 4.150 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453069155 1108120094 /nfs/dbraw/zinc/12/00/94/1108120094.db2.gz YNSZJQSPODDLIX-NRFANRHFSA-N 2 0 363.977 4.189 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccncc1 ZINC000453085295 1108155383 /nfs/dbraw/zinc/15/53/83/1108155383.db2.gz JSSNPLXGNWVBCZ-QFIPXVFZSA-N 2 0 353.510 4.043 20 0 FIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000531789460 1108182311 /nfs/dbraw/zinc/18/23/11/1108182311.db2.gz IVPBDNRPJBSSFS-FRIKZZABSA-N 2 0 350.506 4.467 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453127595 1108205903 /nfs/dbraw/zinc/20/59/03/1108205903.db2.gz PPGBOQLOEPGLFB-YTFSRNRJSA-N 2 0 366.553 4.005 20 0 FIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1 ZINC000453163991 1108235027 /nfs/dbraw/zinc/23/50/27/1108235027.db2.gz FBTIXGOJYUNDBX-YPAWHYETSA-N 2 0 356.554 4.226 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H](NC3CC([NH+]4CCCCC4)C3)[C@H]3CCC[C@@H]32)cc1 ZINC000453220884 1108292263 /nfs/dbraw/zinc/29/22/63/1108292263.db2.gz PKMMWUFFTDZDES-QSBPQZLJSA-N 2 0 367.581 4.036 20 0 FIADRP Cc1ccc(C2(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@H]3C)CC2)c(C)c1 ZINC000453238695 1108316406 /nfs/dbraw/zinc/31/64/06/1108316406.db2.gz AGCHDRNOALSXDQ-OFNKIYASSA-N 2 0 363.549 4.230 20 0 FIADRP CSC1(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)CC[NH+](C)CC1 ZINC000453256147 1108329797 /nfs/dbraw/zinc/32/97/97/1108329797.db2.gz QSBXVXVJBDADRN-QGZVFWFLSA-N 2 0 371.550 4.352 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453270580 1108344493 /nfs/dbraw/zinc/34/44/93/1108344493.db2.gz OKCRATLMOPVHSR-CBGDNZLLSA-N 2 0 354.494 4.190 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]C[C@H](c2cccs2)N2CCN(C)CC2)s1 ZINC000531932425 1108402714 /nfs/dbraw/zinc/40/27/14/1108402714.db2.gz GSLYYZYKURPXML-NVXWUHKLSA-N 2 0 363.596 4.011 20 0 FIADRP CO[C@](C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000453319415 1108407612 /nfs/dbraw/zinc/40/76/12/1108407612.db2.gz KUDADVQDLHAFNJ-JLLPCOHGSA-N 2 0 364.533 4.333 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCc4ccccc43)CC2)cc1 ZINC000531949506 1108432271 /nfs/dbraw/zinc/43/22/71/1108432271.db2.gz KMTVVHSGSHERHR-HSZRJFAPSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCN(C)c2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453386518 1108472054 /nfs/dbraw/zinc/47/20/54/1108472054.db2.gz VETLZMGKGSNRRU-PGRDOPGGSA-N 2 0 367.537 4.249 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453369536 1108487549 /nfs/dbraw/zinc/48/75/49/1108487549.db2.gz VAYDRHBHHXPDCE-VYTWWXLVSA-N 2 0 368.496 4.333 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCCOc2c(Br)cccc21)C1CC1 ZINC000453399849 1108501695 /nfs/dbraw/zinc/50/16/95/1108501695.db2.gz LSONMFYMCOMEDQ-QGZVFWFLSA-N 2 0 367.331 4.127 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000453594327 1108632406 /nfs/dbraw/zinc/63/24/06/1108632406.db2.gz IADPOAZPGIFLFR-UHFFFAOYSA-N 2 0 366.431 4.060 20 0 FIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCCC[N@@H+]3Cc3cncnc3)CC2)cc1 ZINC000453601149 1108652073 /nfs/dbraw/zinc/65/20/73/1108652073.db2.gz SMBYZQKBDSETLO-QHCPKHFHSA-N 2 0 364.537 4.133 20 0 FIADRP CN(c1ccccc1C[NH2+]CCCOC1CCCCC1)C1CC[NH+](C)CC1 ZINC000532107484 1108663281 /nfs/dbraw/zinc/66/32/81/1108663281.db2.gz MMAJWWDZJZPAHO-UHFFFAOYSA-N 2 0 373.585 4.046 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1cccc(O)c1 ZINC000669617959 1108686009 /nfs/dbraw/zinc/68/60/09/1108686009.db2.gz MIRPLCFMBPGTRZ-RBQRNVLBSA-N 2 0 350.506 4.344 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000532193181 1108701681 /nfs/dbraw/zinc/70/16/81/1108701681.db2.gz POZQRNXCZVCVGI-MOPGFXCFSA-N 3 0 354.542 4.343 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 ZINC000532200995 1108706948 /nfs/dbraw/zinc/70/69/48/1108706948.db2.gz UILQUCKBGNOSRF-KRWDZBQOSA-N 2 0 365.521 4.264 20 0 FIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000524968811 1109223753 /nfs/dbraw/zinc/22/37/53/1109223753.db2.gz RRMUVKBCWRUCCI-HDICACEKSA-N 2 0 374.500 4.373 20 0 FIADRP Cc1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc(C)c1OCc1ccccn1 ZINC000508567495 1109247525 /nfs/dbraw/zinc/24/75/25/1109247525.db2.gz YQLLYHFHGCSDNK-FQEVSTJZSA-N 2 0 367.537 4.051 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446938448 1109395599 /nfs/dbraw/zinc/39/55/99/1109395599.db2.gz ISHVNTZDOPYZPA-QGZVFWFLSA-N 2 0 369.734 4.405 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1 ZINC000447030550 1109415895 /nfs/dbraw/zinc/41/58/95/1109415895.db2.gz VPCQDJCPUCMPQC-GOSISDBHSA-N 2 0 351.332 4.364 20 0 FIADRP C[C@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Cl)c1 ZINC000525874952 1109548816 /nfs/dbraw/zinc/54/88/16/1109548816.db2.gz WNLDUEWIIONXFQ-GCJKJVERSA-N 2 0 371.956 4.022 20 0 FIADRP CCC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccsc1 ZINC000525954723 1109563055 /nfs/dbraw/zinc/56/30/55/1109563055.db2.gz YIWTUCVIMYCVIN-SFTDATJTSA-N 2 0 357.567 4.168 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)o1 ZINC000447536045 1109572041 /nfs/dbraw/zinc/57/20/41/1109572041.db2.gz KQPDIQDGYPKPNS-FGTMMUONSA-N 2 0 356.510 4.356 20 0 FIADRP CCO[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000447577578 1109593399 /nfs/dbraw/zinc/59/33/99/1109593399.db2.gz IIYLVXGPLIGTLE-UEVCKROQSA-N 2 0 352.522 4.264 20 0 FIADRP CCO[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000447577579 1109593682 /nfs/dbraw/zinc/59/36/82/1109593682.db2.gz IIYLVXGPLIGTLE-WTIAFYNJSA-N 2 0 352.522 4.264 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1nc(-c2ccccc2)c[nH]1 ZINC000447849475 1109658800 /nfs/dbraw/zinc/65/88/00/1109658800.db2.gz IAPGSUIAOQCWRK-RXVVDRJESA-N 2 0 360.505 4.077 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCSc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000527298597 1109735262 /nfs/dbraw/zinc/73/52/62/1109735262.db2.gz PIMPSLYCXXGGES-PZJWPPBQSA-N 2 0 364.599 4.122 20 0 FIADRP C[C@H]([NH2+]CCCOc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544422444 1109792263 /nfs/dbraw/zinc/79/22/63/1109792263.db2.gz XXIIEMIBPMVVNK-IRXDYDNUSA-N 2 0 350.934 4.352 20 0 FIADRP Cc1cccc([C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)C(C)C)c1 ZINC000527857901 1109840601 /nfs/dbraw/zinc/84/06/01/1109840601.db2.gz FJIPERUELSMGKZ-DEOSSOPVSA-N 2 0 366.549 4.439 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(F)c(Br)cc1F ZINC000527908075 1109859929 /nfs/dbraw/zinc/85/99/29/1109859929.db2.gz CLZFGPRCADPFCI-VOMCLLRMSA-N 2 0 361.274 4.251 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnc(-c3ccccc3F)s2)cc1 ZINC000449063266 1109964992 /nfs/dbraw/zinc/96/49/92/1109964992.db2.gz OLLHOZGAJIVMAN-UHFFFAOYSA-N 2 0 355.482 4.301 20 0 FIADRP c1c2cccnc2oc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000449049223 1109967867 /nfs/dbraw/zinc/96/78/67/1109967867.db2.gz RGZIZRMOFDSENN-RBBKRZOGSA-N 2 0 361.489 4.314 20 0 FIADRP COCc1cccc(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)c1 ZINC000449081977 1109975428 /nfs/dbraw/zinc/97/54/28/1109975428.db2.gz JJBSHXGAAWKABK-LJQANCHMSA-N 2 0 352.522 4.018 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000449108494 1109977279 /nfs/dbraw/zinc/97/72/79/1109977279.db2.gz RFCPHMKEAURNSN-HXUWFJFHSA-N 2 0 373.544 4.463 20 0 FIADRP COc1cc(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc2ccccc21 ZINC000449087673 1109978035 /nfs/dbraw/zinc/97/80/35/1109978035.db2.gz GEZUNEWFCQIWTE-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP COc1cc2ccccc2cc1C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000449091078 1109978568 /nfs/dbraw/zinc/97/85/68/1109978568.db2.gz PGDRRHDDTBORIS-UHFFFAOYSA-N 2 0 364.489 4.079 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449111020 1109979383 /nfs/dbraw/zinc/97/93/83/1109979383.db2.gz IETCTUVEPVCABX-FQEVSTJZSA-N 2 0 362.945 4.366 20 0 FIADRP c1ccc(CC2CC[NH+](CCCC[NH2+][C@@H]3CCOC4(CCC4)C3)CC2)cc1 ZINC000449122521 1109980169 /nfs/dbraw/zinc/98/01/69/1109980169.db2.gz LMKIYOYCRDAWKN-HSZRJFAPSA-N 2 0 370.581 4.413 20 0 FIADRP CC(C)c1nc(CC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)cs1 ZINC000449113624 1109983886 /nfs/dbraw/zinc/98/38/86/1109983886.db2.gz WPPKUTSKYIXURQ-SFHVURJKSA-N 2 0 371.594 4.494 20 0 FIADRP C[C@H](CCc1cccn1C)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449149291 1109985773 /nfs/dbraw/zinc/98/57/73/1109985773.db2.gz NDFLDJMEGRPWJF-UXHICEINSA-N 2 0 353.554 4.031 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCC23CCCCC3)CC1 ZINC000449176500 1109989040 /nfs/dbraw/zinc/98/90/40/1109989040.db2.gz MVXAPCDLDLDFKG-QFIPXVFZSA-N 2 0 356.554 4.236 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000449202767 1109998345 /nfs/dbraw/zinc/99/83/45/1109998345.db2.gz GMVTXKSMLVBYFG-COPCDDAFSA-N 2 0 358.570 4.265 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000449202769 1109998472 /nfs/dbraw/zinc/99/84/72/1109998472.db2.gz GMVTXKSMLVBYFG-STZQEDGTSA-N 2 0 358.570 4.265 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cccnc32)CC1 ZINC000449218612 1109999893 /nfs/dbraw/zinc/99/98/93/1109999893.db2.gz JZQPQNNDCHMAGQ-IBGZPJMESA-N 2 0 359.517 4.420 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCCC34CCC4)C3(C2)CCOCC3)cc1 ZINC000449343626 1110034491 /nfs/dbraw/zinc/03/44/91/1110034491.db2.gz LXEBUXIIVXIMIV-VXKWHMMOSA-N 2 0 368.565 4.228 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCCC2(F)F)CC1 ZINC000449373741 1110045922 /nfs/dbraw/zinc/04/59/22/1110045922.db2.gz CMWDPBONJXGDRH-IEBWSBKVSA-N 2 0 350.497 4.497 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000449430194 1110066601 /nfs/dbraw/zinc/06/66/01/1110066601.db2.gz BQGKHNNUWQHBKB-YOEHRIQHSA-N 2 0 352.404 4.177 20 0 FIADRP C[N@H+](CCCC(=O)c1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000450655662 1110325151 /nfs/dbraw/zinc/32/51/51/1110325151.db2.gz UJLGRENURAWDKI-UHFFFAOYSA-N 2 0 365.521 4.283 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000538394974 1111122317 /nfs/dbraw/zinc/12/23/17/1111122317.db2.gz VQGQPFGEPOTTEF-OAHLLOKOSA-N 2 0 363.933 4.010 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(F)cc1 ZINC000538409327 1111128891 /nfs/dbraw/zinc/12/88/91/1111128891.db2.gz MDZCAVYPKGUXFS-ACRUOGEOSA-N 2 0 362.533 4.270 20 0 FIADRP CC(C)(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(F)cc1 ZINC000538409332 1111129148 /nfs/dbraw/zinc/12/91/48/1111129148.db2.gz MDZCAVYPKGUXFS-PWRODBHTSA-N 2 0 362.533 4.270 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2Cc1ccc(F)c(-c2cccs2)c1 ZINC000538799090 1111295752 /nfs/dbraw/zinc/29/57/52/1111295752.db2.gz MMWQXXMXTUHTMH-NSISKUIASA-N 2 0 374.525 4.238 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000539063650 1111408615 /nfs/dbraw/zinc/40/86/15/1111408615.db2.gz PQRSJOFMZFBLGB-SLFFLAALSA-N 2 0 370.562 4.246 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1csc(C(C)(C)C)n1 ZINC000539045029 1111410141 /nfs/dbraw/zinc/41/01/41/1111410141.db2.gz ZAVNLMPCWNDJNH-XLIONFOSSA-N 2 0 371.594 4.483 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2ccccc12 ZINC000539072429 1111419487 /nfs/dbraw/zinc/41/94/87/1111419487.db2.gz RMCHPOUSTDYFHY-CEXWTWQISA-N 2 0 370.537 4.388 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000539073710 1111419920 /nfs/dbraw/zinc/41/99/20/1111419920.db2.gz XISVMAAZUJIQSI-QGZVFWFLSA-N 2 0 365.521 4.262 20 0 FIADRP COc1cccc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000552033902 1111441617 /nfs/dbraw/zinc/44/16/17/1111441617.db2.gz XKKPPFRQUPFBDH-UHFFFAOYSA-N 2 0 352.522 4.271 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000539159284 1111455158 /nfs/dbraw/zinc/45/51/58/1111455158.db2.gz NQRIOTYOEHKUDX-OXQOHEQNSA-N 2 0 359.514 4.332 20 0 FIADRP CCCCN(C(=O)C1CC[NH+](C(C)C)CC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000462002498 1111457244 /nfs/dbraw/zinc/45/72/44/1111457244.db2.gz AQVPHNOSZVFDDR-UHFFFAOYSA-N 2 0 365.606 4.045 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)C(C)C)cc1 ZINC000539215303 1111478976 /nfs/dbraw/zinc/47/89/76/1111478976.db2.gz LOQCTLNOIKTWRY-YTFSRNRJSA-N 2 0 358.570 4.304 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C[C@H](C)O1 ZINC000539260749 1111497881 /nfs/dbraw/zinc/49/78/81/1111497881.db2.gz HGIFUDCIVZITRY-JTDSTZFVSA-N 2 0 366.933 4.033 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c(C)c1 ZINC000539395846 1111541619 /nfs/dbraw/zinc/54/16/19/1111541619.db2.gz GXCAVKSCBGTMBQ-NRFANRHFSA-N 2 0 366.505 4.081 20 0 FIADRP CN(C)[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccsc1 ZINC000552040653 1111553967 /nfs/dbraw/zinc/55/39/67/1111553967.db2.gz IAERYXKTGBHCDK-HRTMPFAESA-N 2 0 371.594 4.384 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H]2CCC[C@H]21 ZINC000552056384 1111560045 /nfs/dbraw/zinc/56/00/45/1111560045.db2.gz ATHUTBIDRCTHCC-RXABAKJHSA-N 2 0 352.444 4.414 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC000552062044 1111563057 /nfs/dbraw/zinc/56/30/57/1111563057.db2.gz JGCRZYSWOQBXFY-YDPRHXJPSA-N 2 0 352.522 4.441 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000552224316 1111624160 /nfs/dbraw/zinc/62/41/60/1111624160.db2.gz SPQWFENRFPKGPB-SCLBCKFNSA-N 2 0 354.416 4.110 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2ccc(OC)c(OC)c2C)c1 ZINC000552250224 1111628773 /nfs/dbraw/zinc/62/87/73/1111628773.db2.gz YSIDFTKPWRPYAY-QGZVFWFLSA-N 2 0 370.537 4.185 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H]2CCC[C@H]21 ZINC000552258325 1111638926 /nfs/dbraw/zinc/63/89/26/1111638926.db2.gz DMMDQSWACMCYPH-RXABAKJHSA-N 2 0 352.444 4.414 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2COc3ccccc3C2)CC1 ZINC000552252795 1111644932 /nfs/dbraw/zinc/64/49/32/1111644932.db2.gz XVJGUGLIJBGFAF-ORFBVSJDSA-N 2 0 350.506 4.023 20 0 FIADRP Cc1cccn2c(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)cnc12 ZINC000552272905 1111654235 /nfs/dbraw/zinc/65/42/35/1111654235.db2.gz HOKIAPLMYLWGIA-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP COc1cc(F)cc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000552275209 1111655402 /nfs/dbraw/zinc/65/54/02/1111655402.db2.gz OEEUYTHJKYOVQN-UHFFFAOYSA-N 2 0 356.485 4.367 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000552281683 1111658779 /nfs/dbraw/zinc/65/87/79/1111658779.db2.gz GLMOTNNRPVZVEJ-NXWXRZEISA-N 2 0 354.460 4.465 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)ccc1O ZINC000552303937 1111666776 /nfs/dbraw/zinc/66/67/76/1111666776.db2.gz XMOWJXQFSVPRTI-UHFFFAOYSA-N 2 0 354.494 4.067 20 0 FIADRP CC[NH+]1CCC([NH2+]CC2(c3ccc(Br)s3)CCC2)CC1 ZINC000552318113 1111675623 /nfs/dbraw/zinc/67/56/23/1111675623.db2.gz QBSTXKHESCRHNU-UHFFFAOYSA-N 2 0 357.361 4.006 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]CCC3CCCCC3)C3(C2)CCOCC3)cc1 ZINC000552362757 1111685781 /nfs/dbraw/zinc/68/57/81/1111685781.db2.gz LHKSELIFWAIATE-QHCPKHFHSA-N 2 0 370.581 4.475 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479074765 1111944528 /nfs/dbraw/zinc/94/45/28/1111944528.db2.gz ARQABWJQIAIKJG-SFHVURJKSA-N 2 0 369.322 4.361 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479460996 1112032147 /nfs/dbraw/zinc/03/21/47/1112032147.db2.gz AGNNTGHITLJLQP-NQIIRXRSSA-N 2 0 354.469 4.151 20 0 FIADRP Brc1ccc2oc(C[NH+]3CCC(c4ncc[nH]4)CC3)cc2c1 ZINC000667564205 1112161772 /nfs/dbraw/zinc/16/17/72/1112161772.db2.gz FGMNFFOJRXPTFY-UHFFFAOYSA-N 2 0 360.255 4.298 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCO[C@H](C(F)(F)F)C2)CC1 ZINC000554049185 1112176147 /nfs/dbraw/zinc/17/61/47/1112176147.db2.gz LXHUQNRWZUUEPR-MOPGFXCFSA-N 2 0 370.459 4.118 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[NH+](C)CC23CCCCC3)cc1)C(C)C ZINC000480067811 1112267804 /nfs/dbraw/zinc/26/78/04/1112267804.db2.gz NIKMEUANFWRLCQ-UHFFFAOYSA-N 2 0 371.569 4.007 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cc(F)cc(F)c1 ZINC000480229361 1112340342 /nfs/dbraw/zinc/34/03/42/1112340342.db2.gz PXPPJKWEGHDLHZ-BRWVUGGUSA-N 2 0 374.475 4.425 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(F)cc(F)c1 ZINC000480229359 1112340375 /nfs/dbraw/zinc/34/03/75/1112340375.db2.gz PXPPJKWEGHDLHZ-BBWFWOEESA-N 2 0 374.475 4.425 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC000554742524 1112467626 /nfs/dbraw/zinc/46/76/26/1112467626.db2.gz XUBKGVOWGCOGSW-VXKWHMMOSA-N 2 0 367.537 4.228 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000480610229 1112500328 /nfs/dbraw/zinc/50/03/28/1112500328.db2.gz NBFNZZLQBIIIBR-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)nnn1-c1ccc(C)cc1 ZINC000480615895 1112502992 /nfs/dbraw/zinc/50/29/92/1112502992.db2.gz VTHIATNWBXTJCR-OALUTQOASA-N 2 0 369.557 4.047 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000480604883 1112504869 /nfs/dbraw/zinc/50/48/69/1112504869.db2.gz GCOFDOOYFDFTKW-JKSUJKDBSA-N 2 0 352.494 4.148 20 0 FIADRP COc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1OC(F)F ZINC000480606302 1112506361 /nfs/dbraw/zinc/50/63/61/1112506361.db2.gz CSQZKNKBVODTMD-HOTGVXAUSA-N 2 0 370.484 4.459 20 0 FIADRP COc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1OC(F)F ZINC000480606301 1112506531 /nfs/dbraw/zinc/50/65/31/1112506531.db2.gz CSQZKNKBVODTMD-CVEARBPZSA-N 2 0 370.484 4.459 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000480619463 1112511935 /nfs/dbraw/zinc/51/19/35/1112511935.db2.gz UNMFETFXYUAGCW-IBGZPJMESA-N 2 0 374.573 4.379 20 0 FIADRP Cc1ccncc1CCC[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000554861689 1112526741 /nfs/dbraw/zinc/52/67/41/1112526741.db2.gz PFPVMNALJDWZCQ-WOJBJXKFSA-N 2 0 351.538 4.069 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480710632 1112565071 /nfs/dbraw/zinc/56/50/71/1112565071.db2.gz PHRUIMJWQCUJBI-IRMYBRCSSA-N 3 0 369.597 4.140 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCc2c1cccc2OC ZINC000480725729 1112572322 /nfs/dbraw/zinc/57/23/22/1112572322.db2.gz GBJSCNUGGWMZLD-NRFANRHFSA-N 2 0 368.521 4.193 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3ccc(OC)cc32)cc1 ZINC000480731765 1112575432 /nfs/dbraw/zinc/57/54/32/1112575432.db2.gz XWCVAOBTNAPMQW-HSZRJFAPSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000480744275 1112583168 /nfs/dbraw/zinc/58/31/68/1112583168.db2.gz YFLYOXDUVBMKPJ-SJXGUFTOSA-N 2 0 357.325 4.366 20 0 FIADRP CCC[C@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000480769572 1112587776 /nfs/dbraw/zinc/58/77/76/1112587776.db2.gz IGVVZVBCDDFZOC-IBGZPJMESA-N 2 0 372.384 4.452 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C[C@@H](C)O1 ZINC000480832542 1112631871 /nfs/dbraw/zinc/63/18/71/1112631871.db2.gz KDTYQFKZPXUHBQ-PWHSHALESA-N 2 0 370.512 4.394 20 0 FIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000480914690 1112668376 /nfs/dbraw/zinc/66/83/76/1112668376.db2.gz VFOMUZMYYHTFRX-CYFREDJKSA-N 2 0 363.549 4.162 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC000481241242 1112823163 /nfs/dbraw/zinc/82/31/63/1112823163.db2.gz JZRKZDHLFZPZDN-BEFAXECRSA-N 2 0 373.368 4.263 20 0 FIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000481344304 1112909160 /nfs/dbraw/zinc/90/91/60/1112909160.db2.gz WNTGEQMXZMQUGM-CTNGQTDRSA-N 2 0 360.517 4.325 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3cccc(Br)c3C2)C1 ZINC000555536834 1112913440 /nfs/dbraw/zinc/91/34/40/1112913440.db2.gz ABJGDEPZEZCZIM-DOTOQJQBSA-N 2 0 365.359 4.016 20 0 FIADRP CN(c1ccccc1C[NH2+]Cc1coc2ccccc12)C1CC[NH+](C)CC1 ZINC000555591223 1112934207 /nfs/dbraw/zinc/93/42/07/1112934207.db2.gz SPUWTVBJZDDVPJ-UHFFFAOYSA-N 2 0 363.505 4.253 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000065932097 1112987545 /nfs/dbraw/zinc/98/75/45/1112987545.db2.gz ORNMYGNYBDVRAD-UHFFFAOYSA-N 2 0 364.892 4.490 20 0 FIADRP C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]c3cc(OC(F)(F)F)ccc32)C1 ZINC000899877868 1113041554 /nfs/dbraw/zinc/04/15/54/1113041554.db2.gz KGCNLWXUFBEUKJ-GUYCJALGSA-N 2 0 365.399 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000481731886 1113058609 /nfs/dbraw/zinc/05/86/09/1113058609.db2.gz GCZOFFFLXXLBBV-FXAWDEMLSA-N 2 0 366.977 4.344 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2coc(-c3cc(Cl)cc(Cl)c3)n2)CC1 ZINC000629521940 1113093492 /nfs/dbraw/zinc/09/34/92/1113093492.db2.gz YSNLFTAZOIYOCR-UHFFFAOYSA-N 2 0 368.308 4.470 20 0 FIADRP C[N@H+](CCCc1ccc2c(c1)CCO2)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000482159206 1113187291 /nfs/dbraw/zinc/18/72/91/1113187291.db2.gz WFKUQNTUNHAMNF-QFIPXVFZSA-N 2 0 364.533 4.008 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCCc1c(Cl)cccc1Cl ZINC000482172187 1113192000 /nfs/dbraw/zinc/19/20/00/1113192000.db2.gz RSCZTRSEVPAJRF-ZMYBRWDISA-N 2 0 371.352 4.110 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc2c(c1)OCCO2 ZINC000162911528 1113225340 /nfs/dbraw/zinc/22/53/40/1113225340.db2.gz CYUKORWOOPFWJS-OAQYLSRUSA-N 2 0 366.505 4.295 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)c(Br)c2)C1 ZINC000482340828 1113229958 /nfs/dbraw/zinc/22/99/58/1113229958.db2.gz BWKLDFTVEVIRCZ-ZIAGYGMSSA-N 2 0 357.311 4.359 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000482441436 1113257346 /nfs/dbraw/zinc/25/73/46/1113257346.db2.gz VBGJVNANOBGTBG-RBBKRZOGSA-N 2 0 374.532 4.088 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000482462123 1113268358 /nfs/dbraw/zinc/26/83/58/1113268358.db2.gz UVTZSSFLJFSYGV-NTKDMRAZSA-N 2 0 374.532 4.028 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](COC)c2cccc(C(F)(F)F)c2)CC1 ZINC000482499928 1113278778 /nfs/dbraw/zinc/27/87/78/1113278778.db2.gz GQGGEMQJMDCDQN-GOSISDBHSA-N 2 0 358.448 4.105 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cnc2ccsc2c1 ZINC000482550409 1113291985 /nfs/dbraw/zinc/29/19/85/1113291985.db2.gz FRDPJQDARFNZTI-INIZCTEOSA-N 2 0 369.534 4.130 20 0 FIADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000482554470 1113298008 /nfs/dbraw/zinc/29/80/08/1113298008.db2.gz WNXUKKZFZWITOJ-SXSPYAJSSA-N 2 0 358.570 4.194 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1cc2ccccc2o1 ZINC000482565227 1113298590 /nfs/dbraw/zinc/29/85/90/1113298590.db2.gz XQKZULKROOXEKT-KRWDZBQOSA-N 2 0 352.478 4.267 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1OC ZINC000482647783 1113319380 /nfs/dbraw/zinc/31/93/80/1113319380.db2.gz CCFJZHCPTDDYRX-QGZVFWFLSA-N 2 0 360.542 4.022 20 0 FIADRP COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162372782 1113462284 /nfs/dbraw/zinc/46/22/84/1113462284.db2.gz VTTMOHHLRCDNDK-MSOLQXFVSA-N 2 0 356.510 4.356 20 0 FIADRP CCC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000483213084 1113466756 /nfs/dbraw/zinc/46/67/56/1113466756.db2.gz LKXBVYLXBUKBHA-JXFKEZNVSA-N 2 0 350.934 4.272 20 0 FIADRP COc1cc(C)c(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000486522133 1113587875 /nfs/dbraw/zinc/58/78/75/1113587875.db2.gz YCJRZYCGTHPXMR-ICSRJNTNSA-N 2 0 368.521 4.012 20 0 FIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1SC ZINC000486521728 1113590335 /nfs/dbraw/zinc/59/03/35/1113590335.db2.gz XAIMUVYCQQSQBA-YLJYHZDGSA-N 2 0 370.562 4.417 20 0 FIADRP Fc1ccc2cc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)[nH]c2c1 ZINC000486691259 1113624506 /nfs/dbraw/zinc/62/45/06/1113624506.db2.gz WRUKBZCWRRMXAW-UHFFFAOYSA-N 2 0 357.498 4.370 20 0 FIADRP Cc1ccc(CCC[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000668713685 1113681527 /nfs/dbraw/zinc/68/15/27/1113681527.db2.gz XXAVZDQBDQEDGB-QHCPKHFHSA-N 2 0 363.549 4.215 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)CC1 ZINC000488051319 1113846779 /nfs/dbraw/zinc/84/67/79/1113846779.db2.gz UDEROGPBDBPLCQ-HMXCVIKNSA-N 2 0 374.956 4.099 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000488292409 1113901801 /nfs/dbraw/zinc/90/18/01/1113901801.db2.gz IATXSNNUVAEGKX-KRWDZBQOSA-N 2 0 356.514 4.160 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000488356268 1113914618 /nfs/dbraw/zinc/91/46/18/1113914618.db2.gz BUQKSWBFGPRHOP-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000488365875 1113916673 /nfs/dbraw/zinc/91/66/73/1113916673.db2.gz ZKANNNAUXCLTOZ-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000488445347 1113933418 /nfs/dbraw/zinc/93/34/18/1113933418.db2.gz FRQKCBYZDFIVPS-ADHNFCLRSA-N 2 0 358.570 4.439 20 0 FIADRP Cc1ccc(C)c([C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2)c1 ZINC000490118486 1114220167 /nfs/dbraw/zinc/22/01/67/1114220167.db2.gz KLIZMWDKRMKGHI-XMMPIXPASA-N 2 0 365.565 4.008 20 0 FIADRP COc1cc(OC)c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000658356111 1114305501 /nfs/dbraw/zinc/30/55/01/1114305501.db2.gz HGNWYCOEEVROKS-CQSZACIVSA-N 2 0 366.933 4.130 20 0 FIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@@H](N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000490988139 1114359606 /nfs/dbraw/zinc/35/96/06/1114359606.db2.gz OOAFNTGYNCUZIE-XQBPLPMBSA-N 2 0 357.586 4.003 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](CN[C@H](c3ccccc3)c3ccccn3)C2)cc1 ZINC000491019704 1114362137 /nfs/dbraw/zinc/36/21/37/1114362137.db2.gz LGESSCDMXFYBPT-RCZVLFRGSA-N 2 0 371.528 4.325 20 0 FIADRP C[C@H](c1cccc(Cl)c1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000588710619 1114602056 /nfs/dbraw/zinc/60/20/56/1114602056.db2.gz KFYJXOZIPMGACW-IXDOHACOSA-N 2 0 350.934 4.222 20 0 FIADRP CSc1ccc(C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000572895397 1114805186 /nfs/dbraw/zinc/80/51/86/1114805186.db2.gz WLOITPPZQXYGJA-IYBDPMFKSA-N 2 0 368.612 4.181 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)CC1 ZINC000589832003 1114846434 /nfs/dbraw/zinc/84/64/34/1114846434.db2.gz UKMFPBLBXRLTBX-UHFFFAOYSA-N 2 0 360.505 4.152 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000589837424 1114847555 /nfs/dbraw/zinc/84/75/55/1114847555.db2.gz ULLWOBQPXIEOGO-KDURUIRLSA-N 2 0 354.542 4.233 20 0 FIADRP COc1ccc(-c2ccccc2C)cc1C[NH+]1CCC(OCCC[NH3+])CC1 ZINC000573120079 1115046265 /nfs/dbraw/zinc/04/62/65/1115046265.db2.gz DFDSCVUVRPSVSP-UHFFFAOYSA-N 2 0 368.521 4.000 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000591711957 1115126538 /nfs/dbraw/zinc/12/65/38/1115126538.db2.gz DHOHXTHUQLZRMI-UHFFFAOYSA-N 2 0 374.532 4.279 20 0 FIADRP COc1cccc(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)c1OC1CCCC1 ZINC000573793193 1115181322 /nfs/dbraw/zinc/18/13/22/1115181322.db2.gz WUCNMNOENGXXAW-VQTJNVASSA-N 2 0 352.478 4.251 20 0 FIADRP CCc1noc(C)c1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000573867872 1115192830 /nfs/dbraw/zinc/19/28/30/1115192830.db2.gz JYQPPULGFZCSFY-XKCSPQBFSA-N 2 0 367.537 4.326 20 0 FIADRP Cn1cncc1CC[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000574013318 1115230197 /nfs/dbraw/zinc/23/01/97/1115230197.db2.gz ADYJECMHCCZUPB-LJQANCHMSA-N 2 0 370.294 4.104 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)CCc2ccc(F)cc2F)[C@H](C)C1 ZINC000574062427 1115288225 /nfs/dbraw/zinc/28/82/25/1115288225.db2.gz TZZIUVHSOJESPB-LZJOCLMNSA-N 2 0 368.512 4.013 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)cc1 ZINC000574572730 1115424056 /nfs/dbraw/zinc/42/40/56/1115424056.db2.gz FGCBYPZHRJPCLT-GOSISDBHSA-N 2 0 363.274 4.288 20 0 FIADRP c1cn(-c2cccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)cn1 ZINC000574633466 1115430673 /nfs/dbraw/zinc/43/06/73/1115430673.db2.gz UJYRLWGBMOBXHY-VILGAWFOSA-N 2 0 372.516 4.158 20 0 FIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1F ZINC000669683861 1115782488 /nfs/dbraw/zinc/78/24/88/1115782488.db2.gz YTDFSULSLHMRBH-HKUYNNGSSA-N 2 0 356.485 4.225 20 0 FIADRP c1c2ccccc2oc1CC[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000606913144 1115982765 /nfs/dbraw/zinc/98/27/65/1115982765.db2.gz KPYSYAGQYGRDOK-UHFFFAOYSA-N 2 0 364.489 4.240 20 0 FIADRP C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000607279432 1116014786 /nfs/dbraw/zinc/01/47/86/1116014786.db2.gz WCWIBVQGGQTPHU-QZTJIDSGSA-N 2 0 357.542 4.262 20 0 FIADRP C[N@H+](CCOC(c1ccccc1)c1ccccc1)C[C@@H]1CCC[NH+](C)C1 ZINC000607358128 1116022626 /nfs/dbraw/zinc/02/26/26/1116022626.db2.gz AXYABDXCPOTRAT-HXUWFJFHSA-N 2 0 352.522 4.066 20 0 FIADRP CC1(C)CN(Cc2ccccc2)CC[C@@H]1[NH2+]CC1=Cc2ccccc2OC1 ZINC000509448703 1116198572 /nfs/dbraw/zinc/19/85/72/1116198572.db2.gz NTGUPELACXAHOP-QHCPKHFHSA-N 2 0 362.517 4.353 20 0 FIADRP CCN(Cc1cc(OC)cc(C)n1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000535286135 1116290313 /nfs/dbraw/zinc/29/03/13/1116290313.db2.gz YONXTHZMBJKOJH-NQIIRXRSSA-N 2 0 353.510 4.056 20 0 FIADRP Fc1cccc(C2([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)CC2)c1 ZINC000152867182 1116358217 /nfs/dbraw/zinc/35/82/17/1116358217.db2.gz NITPEGDXAAHQHE-UHFFFAOYSA-N 2 0 354.469 4.079 20 0 FIADRP CCc1oc2ccccc2c1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000539820816 1116385360 /nfs/dbraw/zinc/38/53/60/1116385360.db2.gz QTZPWYRDJLYQJT-UHFFFAOYSA-N 2 0 356.510 4.072 20 0 FIADRP c1[nH]nc(-c2ccccc2)c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000539852606 1116393108 /nfs/dbraw/zinc/39/31/08/1116393108.db2.gz AFPZWVCTKHWAHT-UHFFFAOYSA-N 2 0 352.526 4.165 20 0 FIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000462747961 1117750596 /nfs/dbraw/zinc/75/05/96/1117750596.db2.gz YTABBXQJDNXHSN-FQEVSTJZSA-N 2 0 357.586 4.141 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000462769345 1117766421 /nfs/dbraw/zinc/76/64/21/1117766421.db2.gz YDANKHODVNRTNL-UHFFFAOYSA-N 2 0 369.336 4.481 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1)CC1CC1 ZINC000539957967 1117776463 /nfs/dbraw/zinc/77/64/63/1117776463.db2.gz WIIZDXYEPHYMOI-UHFFFAOYSA-N 2 0 366.553 4.411 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000462797161 1117778841 /nfs/dbraw/zinc/77/88/41/1117778841.db2.gz BIDSUPHJHMVTOO-GOSISDBHSA-N 2 0 354.542 4.294 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000462796884 1117779246 /nfs/dbraw/zinc/77/92/46/1117779246.db2.gz YLFHWOSAJINJAJ-UEVCKROQSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000462812280 1117782121 /nfs/dbraw/zinc/78/21/21/1117782121.db2.gz HBQWAFBJZYRRAQ-DYXWJJEUSA-N 2 0 373.560 4.285 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CC(=O)Nc2cccc(C)c2C)CC1)CC1CC1 ZINC000540046514 1117827493 /nfs/dbraw/zinc/82/74/93/1117827493.db2.gz FPIVFAWVTAYOLG-UHFFFAOYSA-N 2 0 371.569 4.076 20 0 FIADRP Fc1ccc(CC[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1Br ZINC000540143869 1117895018 /nfs/dbraw/zinc/89/50/18/1117895018.db2.gz DUQPUGOVGZKKGV-UHFFFAOYSA-N 2 0 369.322 4.127 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2-c2cnn(C)c2)CC1 ZINC000540148662 1117900038 /nfs/dbraw/zinc/90/00/38/1117900038.db2.gz YDJFOBHQQLVSEE-FDDCHVKYSA-N 2 0 366.553 4.220 20 0 FIADRP C[C@H]([NH2+]Cc1cc2c(s1)CCCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000540167231 1117910911 /nfs/dbraw/zinc/91/09/11/1117910911.db2.gz SNPAORIOIKJHJU-INIZCTEOSA-N 2 0 358.551 4.418 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1OC ZINC000540172799 1117913627 /nfs/dbraw/zinc/91/36/27/1117913627.db2.gz WPMMIAOWBYPUSQ-SFHVURJKSA-N 2 0 370.537 4.265 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(OCC[NH+](C)C)cc1 ZINC000540193048 1117922619 /nfs/dbraw/zinc/92/26/19/1117922619.db2.gz USRMYMXWEIOBIQ-CQSZACIVSA-N 2 0 352.931 4.235 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(OCC[NH+](C)C)cc1 ZINC000540193047 1117922920 /nfs/dbraw/zinc/92/29/20/1117922920.db2.gz USRMYMXWEIOBIQ-AWEZNQCLSA-N 2 0 352.931 4.235 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C(C)C)CC1 ZINC000540262421 1117963111 /nfs/dbraw/zinc/96/31/11/1117963111.db2.gz IHNTUPOZUGSQCH-IBGZPJMESA-N 2 0 372.384 4.308 20 0 FIADRP C[NH+](C)CC[C@H]([NH2+]C1CCN(Cc2ccccc2Cl)CC1)C(C)(C)C ZINC000463124061 1117973702 /nfs/dbraw/zinc/97/37/02/1117973702.db2.gz MJCVMUOKIRLWHK-FQEVSTJZSA-N 2 0 365.993 4.260 20 0 FIADRP C[C@H]1C[C@H](NCCC[NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463130735 1117978454 /nfs/dbraw/zinc/97/84/54/1117978454.db2.gz IHTPYYSHVZIRBT-XUZZJYLKSA-N 2 0 365.565 4.151 20 0 FIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCC4CCOCC4)CC[C@@H]32)cc1 ZINC000463293164 1118076782 /nfs/dbraw/zinc/07/67/82/1118076782.db2.gz DVKSUPSKBMTOBP-GOTSBHOMSA-N 2 0 356.554 4.180 20 0 FIADRP CCc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C(C)C)cc1 ZINC000540988758 1118339134 /nfs/dbraw/zinc/33/91/34/1118339134.db2.gz OKZBKGBZNQCNEC-BJKOFHAPSA-N 2 0 366.549 4.303 20 0 FIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000540992167 1118342085 /nfs/dbraw/zinc/34/20/85/1118342085.db2.gz VTPMGSYITYDTFY-DENIHFKCSA-N 2 0 352.522 4.111 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cc(C)ccc2C)CC1 ZINC000541087184 1118378705 /nfs/dbraw/zinc/37/87/05/1118378705.db2.gz YFUUKSZAVUZRKO-HXUWFJFHSA-N 2 0 373.585 4.464 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)CC2)c1 ZINC000464073779 1118432066 /nfs/dbraw/zinc/43/20/66/1118432066.db2.gz JKOCYOXZVMMEOE-HSALFYBXSA-N 2 0 362.583 4.145 20 0 FIADRP Brc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000541223479 1118435199 /nfs/dbraw/zinc/43/51/99/1118435199.db2.gz VMMWGFRCINSQOG-LJQANCHMSA-N 2 0 363.343 4.433 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)CCCc2ccccc2Br)CC1 ZINC000541350117 1118482846 /nfs/dbraw/zinc/48/28/46/1118482846.db2.gz UKUOXLZRVWTZSX-UHFFFAOYSA-N 2 0 353.348 4.186 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000541378906 1118494997 /nfs/dbraw/zinc/49/49/97/1118494997.db2.gz XWJLYAYDVUXNNR-NRFANRHFSA-N 2 0 350.441 4.264 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]([NH+]1CCC3(C[NH+](Cc4ccccc4)C3)CC1)C2 ZINC001168438343 1118549256 /nfs/dbraw/zinc/54/92/56/1118549256.db2.gz ADVOLQWGTKIUTO-QHCPKHFHSA-N 2 0 364.508 4.281 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)C1 ZINC000541546619 1118551221 /nfs/dbraw/zinc/55/12/21/1118551221.db2.gz FZFGZLBISVOCJG-XMSQKQJNSA-N 2 0 355.501 4.412 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)C1 ZINC000541546617 1118551271 /nfs/dbraw/zinc/55/12/71/1118551271.db2.gz FZFGZLBISVOCJG-GCJKJVERSA-N 2 0 355.501 4.412 20 0 FIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000541738764 1118627193 /nfs/dbraw/zinc/62/71/93/1118627193.db2.gz OYIGZMXYUSVTNM-QYRPDUKASA-N 2 0 369.578 4.445 20 0 FIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303090222 1118796835 /nfs/dbraw/zinc/79/68/35/1118796835.db2.gz ZHNSSGWGUUBAKR-HNNXBMFYSA-N 2 0 356.432 4.454 20 0 FIADRP CS[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000542312262 1118897371 /nfs/dbraw/zinc/89/73/71/1118897371.db2.gz UIEMODPOBJZYTI-FQEVSTJZSA-N 2 0 363.615 4.084 20 0 FIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442521 1118988219 /nfs/dbraw/zinc/98/82/19/1118988219.db2.gz VWPLVJJWKFJUTQ-AUSIDOKSSA-N 2 0 352.497 4.137 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1 ZINC000173449194 1119041334 /nfs/dbraw/zinc/04/13/34/1119041334.db2.gz OYVSRZPPPFIOTB-SFHVURJKSA-N 2 0 361.599 4.009 20 0 FIADRP CCSc1cccc(C[NH2+]Cc2ccccc2N2CC[NH+](CC)CC2)c1 ZINC000492313978 1119067197 /nfs/dbraw/zinc/06/71/97/1119067197.db2.gz QSDLEEHXMCZKTF-UHFFFAOYSA-N 2 0 369.578 4.230 20 0 FIADRP COc1cccc(CCC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000492469441 1119099824 /nfs/dbraw/zinc/09/98/24/1119099824.db2.gz XZSDOSLPIREMJS-KNQAVFIVSA-N 2 0 352.522 4.128 20 0 FIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)s1 ZINC000177751669 1119349570 /nfs/dbraw/zinc/34/95/70/1119349570.db2.gz TVZQKTXFRJWNLF-OAGGEKHMSA-N 2 0 373.566 4.220 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000178046291 1119367813 /nfs/dbraw/zinc/36/78/13/1119367813.db2.gz ZJQCUCBDLOYZAB-IBGZPJMESA-N 2 0 368.569 4.114 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311807399 1119389593 /nfs/dbraw/zinc/38/95/93/1119389593.db2.gz LHQQEMSQCKHTJH-NNWRFLSQSA-N 2 0 356.554 4.369 20 0 FIADRP C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311863739 1119392992 /nfs/dbraw/zinc/39/29/92/1119392992.db2.gz VOPDMBSJSLOOHB-BVSLBCMMSA-N 2 0 356.554 4.369 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)[C@H]2CCCO[C@H]21 ZINC000312112554 1119402285 /nfs/dbraw/zinc/40/22/85/1119402285.db2.gz NBTSMUCCBCCROV-DXBBTUNJSA-N 2 0 356.554 4.082 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2ccccc2Cl)c1 ZINC000493252176 1119435583 /nfs/dbraw/zinc/43/55/83/1119435583.db2.gz VRBXVHGFKFTEOM-NRFANRHFSA-N 2 0 372.940 4.093 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000493904515 1119504298 /nfs/dbraw/zinc/50/42/98/1119504298.db2.gz DGVFWSRMWCNVRP-UWJYYQICSA-N 2 0 358.551 4.326 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000493923335 1119509586 /nfs/dbraw/zinc/50/95/86/1119509586.db2.gz AWESDVQHXWQPED-BHIFYINESA-N 2 0 354.538 4.110 20 0 FIADRP C[C@H]1CC[NH+](Cc2cccc(C[N@@H+]3CCS[C@@H](C)CC3)c2)CCS1 ZINC000494151959 1119547558 /nfs/dbraw/zinc/54/75/58/1119547558.db2.gz GMHCBNWHACVXLB-ROUUACIJSA-N 2 0 364.624 4.341 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)CC1 ZINC000542475363 1119549038 /nfs/dbraw/zinc/54/90/38/1119549038.db2.gz WJZKQFSNTWAPNG-OAQYLSRUSA-N 2 0 359.464 4.161 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183196424 1119568465 /nfs/dbraw/zinc/56/84/65/1119568465.db2.gz NHPKBHIHABRBKT-BBTUJRGHSA-N 2 0 366.553 4.484 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000183197429 1119568495 /nfs/dbraw/zinc/56/84/95/1119568495.db2.gz PDHLEFUGGIWOCK-OKZBNKHCSA-N 2 0 360.542 4.316 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCO2 ZINC000183187562 1119568516 /nfs/dbraw/zinc/56/85/16/1119568516.db2.gz DOUOGQBRRUXTQT-HQRMLTQVSA-N 2 0 358.526 4.152 20 0 FIADRP Cc1cncc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000184379586 1119605647 /nfs/dbraw/zinc/60/56/47/1119605647.db2.gz BNLIGTYNROYIJF-FQEVSTJZSA-N 2 0 367.537 4.112 20 0 FIADRP CCOCCCN1CC[C@@H]([NH2+]Cc2c(C)cc(C)c(C(C)=O)c2C)[C@H](C)C1 ZINC000187020588 1119761546 /nfs/dbraw/zinc/76/15/46/1119761546.db2.gz GHFACCINHKTJSK-XMSQKQJNSA-N 2 0 374.569 4.041 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@@H]2c2cccc3ccccc32)CC1 ZINC000191460556 1119978167 /nfs/dbraw/zinc/97/81/67/1119978167.db2.gz MBYHUTSWQHLPDB-XMMPIXPASA-N 2 0 365.565 4.393 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCSc3ccc(OC)cc32)c1 ZINC000191510476 1119981184 /nfs/dbraw/zinc/98/11/84/1119981184.db2.gz WYVHJMZTPPAOGQ-HXUWFJFHSA-N 2 0 356.535 4.474 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccnn1-c1ccccc1 ZINC000467374497 1119981643 /nfs/dbraw/zinc/98/16/43/1119981643.db2.gz XRAFDDDNGBPDSX-PZJWPPBQSA-N 2 0 360.505 4.045 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000191862557 1119998988 /nfs/dbraw/zinc/99/89/88/1119998988.db2.gz WJDXRPJSEZTMPV-JZWVFAODSA-N 2 0 368.521 4.055 20 0 FIADRP Fc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC(F)F ZINC000192934806 1120091327 /nfs/dbraw/zinc/09/13/27/1120091327.db2.gz KOZVYPPTYQGFLC-QGZVFWFLSA-N 2 0 364.411 4.039 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Cl)cs2)C[C@@H](C)O1 ZINC000193031268 1120095432 /nfs/dbraw/zinc/09/54/32/1120095432.db2.gz JPBCDMIZXAYEGR-HUUCEWRRSA-N 2 0 364.942 4.301 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000193980541 1120224388 /nfs/dbraw/zinc/22/43/88/1120224388.db2.gz MZHNWBJXTGZLLS-MRXNPFEDSA-N 2 0 372.475 4.117 20 0 FIADRP Cc1noc(C2CCC([NH2+]Cc3cccc(C[N@@H+](C)C(C)C)c3)CC2)n1 ZINC000494903935 1120367317 /nfs/dbraw/zinc/36/73/17/1120367317.db2.gz PMACXMRNTOCMND-UHFFFAOYSA-N 2 0 356.514 4.034 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000494926306 1120381954 /nfs/dbraw/zinc/38/19/54/1120381954.db2.gz XEMCPGJZTQZQHF-WEMPKCCASA-N 2 0 362.533 4.251 20 0 FIADRP Cc1noc(C2CCC([NH2+]C[C@H]3CCC[N@@H+]3CC3CCCCC3)CC2)n1 ZINC000495069798 1120460624 /nfs/dbraw/zinc/46/06/24/1120460624.db2.gz UEAXRCWQMXNFSC-SOAGJPPSSA-N 2 0 360.546 4.039 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)c1 ZINC000303020274 1120725675 /nfs/dbraw/zinc/72/56/75/1120725675.db2.gz QXJXJXHHMZBPKE-JOCHJYFZSA-N 2 0 365.521 4.132 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)Cc1ccc(Br)cc1 ZINC000233433574 1120863626 /nfs/dbraw/zinc/86/36/26/1120863626.db2.gz NMCUOZCKLJDDPB-CVEARBPZSA-N 2 0 355.364 4.480 20 0 FIADRP Cc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000237623132 1120980395 /nfs/dbraw/zinc/98/03/95/1120980395.db2.gz UPWDGXQFHPZYSP-KDURUIRLSA-N 2 0 352.522 4.202 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1ccc(C)c(F)c1 ZINC000028899150 1121026500 /nfs/dbraw/zinc/02/65/00/1121026500.db2.gz ZRVDCLDZRJKRFQ-QGZVFWFLSA-N 2 0 371.500 4.093 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1COCc1ccccc1)C1CC[NH+](C)CC1 ZINC000155049730 1121175420 /nfs/dbraw/zinc/17/54/20/1121175420.db2.gz FLAPILSICAKAIV-LJQANCHMSA-N 2 0 352.522 4.223 20 0 FIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Cl)c(Br)c2)CC1 ZINC000715510188 1121521165 /nfs/dbraw/zinc/52/11/65/1121521165.db2.gz HZOHNXLTNIMPLL-UHFFFAOYSA-N 2 0 359.739 4.455 20 0 FIADRP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1OCc1ccccc1 ZINC000062427197 1121540926 /nfs/dbraw/zinc/54/09/26/1121540926.db2.gz DZXKHAYRWGGXQZ-NRFANRHFSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cc1 ZINC000064735695 1121630172 /nfs/dbraw/zinc/63/01/72/1121630172.db2.gz QZDJQWMJHMPTMW-JQVVWYNYSA-N 2 0 371.569 4.006 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCCCO3)c1 ZINC000123933771 1121646335 /nfs/dbraw/zinc/64/63/35/1121646335.db2.gz FGBGARIWPOEPBS-KRWDZBQOSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000124593488 1121707324 /nfs/dbraw/zinc/70/73/24/1121707324.db2.gz QNSFWKMFYYHING-PMAPCBKXSA-N 2 0 350.506 4.073 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124655696 1121711706 /nfs/dbraw/zinc/71/17/06/1121711706.db2.gz HROINLYQUWYUSO-KSZLIROESA-N 2 0 356.510 4.302 20 0 FIADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000671754083 1121754154 /nfs/dbraw/zinc/75/41/54/1121754154.db2.gz QLGLYCARKRWYNY-TZRRMPRUSA-N 2 0 363.549 4.213 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000125183178 1121754184 /nfs/dbraw/zinc/75/41/84/1121754184.db2.gz YVNKMZIRSOTVBU-MOPGFXCFSA-N 2 0 354.542 4.281 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2cccc(Cl)c2F)cc1 ZINC001649096525 1121759123 /nfs/dbraw/zinc/75/91/23/1121759123.db2.gz ZLWVCTJYEXAPER-UHFFFAOYSA-N 2 0 350.865 4.099 20 0 FIADRP COCCC[C@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764482 1121797830 /nfs/dbraw/zinc/79/78/30/1121797830.db2.gz ORWNPHSQWAPOLK-VQIMIIECSA-N 2 0 352.950 4.170 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)CCO2)cc1 ZINC001168597476 1121805749 /nfs/dbraw/zinc/80/57/49/1121805749.db2.gz BDCXCVBMAPFEOK-YSNWRPKNSA-N 2 0 360.542 4.049 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125730499 1121818101 /nfs/dbraw/zinc/81/81/01/1121818101.db2.gz YLZNBVBGADXAEW-OALUTQOASA-N 2 0 374.573 4.331 20 0 FIADRP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000069753249 1121879500 /nfs/dbraw/zinc/87/95/00/1121879500.db2.gz CPNIJHJHOLVFNF-UTKZUKDTSA-N 2 0 354.494 4.167 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126727884 1121981504 /nfs/dbraw/zinc/98/15/04/1121981504.db2.gz UWELNGOMBYLGGA-DNVCBOLYSA-N 2 0 373.541 4.367 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cccs2)CC1 ZINC000127236097 1122067830 /nfs/dbraw/zinc/06/78/30/1122067830.db2.gz WLAYFJHSUULOBQ-CVEARBPZSA-N 2 0 361.530 4.441 20 0 FIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616145 1122104026 /nfs/dbraw/zinc/10/40/26/1122104026.db2.gz QODCVAMIOVCXGE-RUCRBOMBSA-N 2 0 360.542 4.158 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000066960581 1122115850 /nfs/dbraw/zinc/11/58/50/1122115850.db2.gz SDNCKNQZXBLIDG-IBGZPJMESA-N 2 0 359.558 4.074 20 0 FIADRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(SC2CCCC2)cc1 ZINC000127833535 1122151837 /nfs/dbraw/zinc/15/18/37/1122151837.db2.gz NOJQRGFLZIUHSU-ZWKOTPCHSA-N 2 0 361.599 4.008 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127833063 1122152176 /nfs/dbraw/zinc/15/21/76/1122152176.db2.gz NOJQRGFLZIUHSU-ROUUACIJSA-N 2 0 361.599 4.008 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC001168619658 1122167118 /nfs/dbraw/zinc/16/71/18/1122167118.db2.gz ZLUHQBNBAOWUMR-NFBKMPQASA-N 2 0 372.553 4.302 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000655826061 1122203536 /nfs/dbraw/zinc/20/35/36/1122203536.db2.gz FIKCVEJSDBNPGB-DRQUAOQDSA-N 2 0 369.456 4.259 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000497409955 1122220657 /nfs/dbraw/zinc/22/06/57/1122220657.db2.gz BWUPZKQLKROGHO-HCUBDLJJSA-N 2 0 364.533 4.264 20 0 FIADRP C[C@@H](CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCC[NH2+]C1 ZINC000262640643 1122279146 /nfs/dbraw/zinc/27/91/46/1122279146.db2.gz KASOZLHTUOAVST-OALUTQOASA-N 2 0 371.569 4.415 20 0 FIADRP Cc1ccc([C@H]([NH3+])C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000262667435 1122418032 /nfs/dbraw/zinc/41/80/32/1122418032.db2.gz QBYYGOJFTAELNE-NRFANRHFSA-N 2 0 351.494 4.010 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2c(-c3ccccc3)nc3sccn23)CC1 ZINC000918000186 1122519734 /nfs/dbraw/zinc/51/97/34/1122519734.db2.gz XTHGWMWFWMMAAX-UHFFFAOYSA-N 2 0 368.550 4.227 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(OC)c(OC)cc2-c2ccccc2)C1 ZINC000069160345 1122557788 /nfs/dbraw/zinc/55/77/88/1122557788.db2.gz SPZPNAFJHDEXEQ-SFHVURJKSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)c2)CCO1 ZINC000129471467 1122608772 /nfs/dbraw/zinc/60/87/72/1122608772.db2.gz WQCGBUBQRQRLEI-AYOQOUSVSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(F)c2ccccc21 ZINC000556119355 1122670693 /nfs/dbraw/zinc/67/06/93/1122670693.db2.gz WIQLWPSMTDZINN-RXYZOABWSA-N 2 0 356.485 4.007 20 0 FIADRP CN1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)cc3)C2)C[C@H]1c1ccccc1 ZINC000556131844 1122678490 /nfs/dbraw/zinc/67/84/90/1122678490.db2.gz XPFRXZPGHLNBNT-VWPQPMDRSA-N 2 0 369.940 4.344 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1cnn(C)c1 ZINC000129861535 1122705443 /nfs/dbraw/zinc/70/54/43/1122705443.db2.gz JPTAVLOIQIEBRQ-JOCHJYFZSA-N 2 0 354.542 4.426 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000556204451 1122729606 /nfs/dbraw/zinc/72/96/06/1122729606.db2.gz HRDNUSWREUBULJ-LRQRDZAKSA-N 2 0 356.485 4.363 20 0 FIADRP CC(C)CC[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231492 1122748781 /nfs/dbraw/zinc/74/87/81/1122748781.db2.gz WFPYVTVTSFAHED-IFMALSPDSA-N 2 0 358.570 4.330 20 0 FIADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230729 1122757000 /nfs/dbraw/zinc/75/70/00/1122757000.db2.gz ANFIPZXFMCDWRS-XPWALMASSA-N 2 0 370.581 4.474 20 0 FIADRP COc1cc(OC)c([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1Cl ZINC000556231849 1122757308 /nfs/dbraw/zinc/75/73/08/1122757308.db2.gz XOVLWJFFQQOKDE-OAHLLOKOSA-N 2 0 354.922 4.274 20 0 FIADRP Cn1ncc(Cl)c1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000130439675 1122847502 /nfs/dbraw/zinc/84/75/02/1122847502.db2.gz HSIUNJWRODPPIU-UHFFFAOYSA-N 2 0 368.912 4.092 20 0 FIADRP C/C(=C\c1ccccc1)C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556407827 1122874211 /nfs/dbraw/zinc/87/42/11/1122874211.db2.gz KFISRGXKEMUDBH-KNTRCKAVSA-N 2 0 350.506 4.353 20 0 FIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)o1 ZINC000131084703 1122974202 /nfs/dbraw/zinc/97/42/02/1122974202.db2.gz HSMWXQSWZFSRDQ-UHFFFAOYSA-N 2 0 356.514 4.111 20 0 FIADRP CCc1cnc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000556870757 1123151173 /nfs/dbraw/zinc/15/11/73/1123151173.db2.gz QJTUNUIMDYXZRT-UHFFFAOYSA-N 2 0 357.567 4.281 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc3c(c2)COC3)CC1 ZINC000556886495 1123163335 /nfs/dbraw/zinc/16/33/35/1123163335.db2.gz KQDRZGKBRKSMGX-UHFFFAOYSA-N 2 0 350.506 4.250 20 0 FIADRP Fc1ccc2c(c1)[C@H]([NH2+]CCc1nccn1Cc1ccccc1)CCCO2 ZINC000132145706 1123222590 /nfs/dbraw/zinc/22/25/90/1123222590.db2.gz IHBRENVZKXNRLM-HXUWFJFHSA-N 2 0 365.452 4.117 20 0 FIADRP Cc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(-c2ccnn2C)c1 ZINC000556965306 1123268983 /nfs/dbraw/zinc/26/89/83/1123268983.db2.gz YOQKXKMPHLKDRC-UHFFFAOYSA-N 2 0 366.553 4.282 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1cccc(F)c1 ZINC000499232943 1123341604 /nfs/dbraw/zinc/34/16/04/1123341604.db2.gz ZFUNUWZLYUSKAJ-AGOPTVSRSA-N 2 0 368.496 4.378 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc2c(s1)CCC2 ZINC000132704930 1123343642 /nfs/dbraw/zinc/34/36/42/1123343642.db2.gz AOYPBTJHIQAIDO-INIZCTEOSA-N 2 0 370.562 4.044 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1C ZINC000132819300 1123365280 /nfs/dbraw/zinc/36/52/80/1123365280.db2.gz USGIQEVLHBBYLK-HXUWFJFHSA-N 2 0 366.549 4.419 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000133465496 1123490038 /nfs/dbraw/zinc/49/00/38/1123490038.db2.gz USXJYDMYFNPYRR-LAUBAEHRSA-N 2 0 354.494 4.192 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2cc(F)ccc2C)c1 ZINC000079307379 1123873928 /nfs/dbraw/zinc/87/39/28/1123873928.db2.gz WRGYQTMOPWHTMI-KRWDZBQOSA-N 2 0 371.500 4.093 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(SC)cc2)[C@@H](C)C1 ZINC000245463964 1124042089 /nfs/dbraw/zinc/04/20/89/1124042089.db2.gz PCBORRLRTYOSJR-ZWOKBUDYSA-N 2 0 350.572 4.196 20 0 FIADRP COCc1ccccc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245657215 1124170198 /nfs/dbraw/zinc/17/01/98/1124170198.db2.gz DUTKYMSQUCPYPY-NUNAXRQHSA-N 2 0 350.506 4.118 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2[C@@H]4Cc5ccccc5[C@H]24)C3)cc1 ZINC000245661222 1124177341 /nfs/dbraw/zinc/17/73/41/1124177341.db2.gz FTYJDMQEVJSUHT-VOIBFUHESA-N 2 0 358.529 4.358 20 0 FIADRP COc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245696483 1124205266 /nfs/dbraw/zinc/20/52/66/1124205266.db2.gz LCEOMNXUZIISCA-DKUWSORSSA-N 2 0 350.506 4.023 20 0 FIADRP COCc1cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1F ZINC000245769868 1124246056 /nfs/dbraw/zinc/24/60/56/1124246056.db2.gz XABLBCUBMJHQEH-KOUNCHBCSA-N 2 0 368.496 4.257 20 0 FIADRP c1cnn(-c2ccccc2C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245778129 1124248116 /nfs/dbraw/zinc/24/81/16/1124248116.db2.gz YJZCHDJWLHXEFN-WBDAEOGXSA-N 2 0 372.516 4.158 20 0 FIADRP CN1CC[C@H]([NH2+]CCCOCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000518575427 1124370467 /nfs/dbraw/zinc/37/04/67/1124370467.db2.gz WCZLWLYQOHCVPH-XZOQPEGZSA-N 2 0 352.522 4.061 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000246528684 1124524272 /nfs/dbraw/zinc/52/42/72/1124524272.db2.gz GGTKMPVJGFPPMH-BRWVUGGUSA-N 2 0 374.475 4.425 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2cccs2)C2CCCC2)CC1 ZINC000246528817 1124524502 /nfs/dbraw/zinc/52/45/02/1124524502.db2.gz VEZFJTCGEYXOEL-ZVDOUQERSA-N 2 0 362.583 4.337 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cc1 ZINC000246640316 1124544857 /nfs/dbraw/zinc/54/48/57/1124544857.db2.gz XAEMHGDTPWASBH-FGTMMUONSA-N 2 0 356.485 4.286 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cnn(Cc2ccccc2)c1 ZINC000246809899 1124562458 /nfs/dbraw/zinc/56/24/58/1124562458.db2.gz AOFTYYZYLNDLAT-VQTJNVASSA-N 2 0 354.542 4.237 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1cc(F)ccc1F ZINC000246928971 1124574698 /nfs/dbraw/zinc/57/46/98/1124574698.db2.gz HBHRMBOXRNUENF-JKSUJKDBSA-N 2 0 360.448 4.036 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCCCCc1ccccc1 ZINC000247101003 1124590188 /nfs/dbraw/zinc/59/01/88/1124590188.db2.gz SGQSGWPLVGDHCV-NZQKXSOJSA-N 2 0 351.538 4.295 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)s1 ZINC000248441657 1124769165 /nfs/dbraw/zinc/76/91/65/1124769165.db2.gz KHKOEJBYPOFFJR-IAGOWNOFSA-N 2 0 364.942 4.209 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1Cl ZINC000248443517 1124769525 /nfs/dbraw/zinc/76/95/25/1124769525.db2.gz LLDYYKSQSGDVTQ-LPHOPBHVSA-N 2 0 358.913 4.148 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)cc1 ZINC000248439346 1124769844 /nfs/dbraw/zinc/76/98/44/1124769844.db2.gz INDRUXXDXQPIQO-RTWAWAEBSA-N 2 0 358.913 4.148 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)C2 ZINC001168683860 1124801484 /nfs/dbraw/zinc/80/14/84/1124801484.db2.gz APMNAHDMRXGOHS-KLJZETAQSA-N 2 0 366.936 4.307 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000248710726 1124804799 /nfs/dbraw/zinc/80/47/99/1124804799.db2.gz BGCXCQSUVQFPAJ-QTGUNEKASA-N 2 0 368.521 4.198 20 0 FIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168686169 1124823693 /nfs/dbraw/zinc/82/36/93/1124823693.db2.gz WLAFZJABJFKWBO-FQEVSTJZSA-N 2 0 354.925 4.309 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C1 ZINC000249255960 1124852498 /nfs/dbraw/zinc/85/24/98/1124852498.db2.gz GNCKJSMCLYBNJU-QRVBRYPASA-N 2 0 354.460 4.262 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000249345599 1124854704 /nfs/dbraw/zinc/85/47/04/1124854704.db2.gz FCAGPLURENDKIL-LJQANCHMSA-N 2 0 366.553 4.202 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000091266000 1125059238 /nfs/dbraw/zinc/05/92/38/1125059238.db2.gz QHPQYXGFZFPDDR-CQSZACIVSA-N 2 0 356.901 4.139 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000091372383 1125069340 /nfs/dbraw/zinc/06/93/40/1125069340.db2.gz MKBCXLCGHPQCSB-JOCHJYFZSA-N 2 0 351.494 4.048 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2csc(COc3ccc(C)cc3)n2)CC1 ZINC000113335899 1125154562 /nfs/dbraw/zinc/15/45/62/1125154562.db2.gz MWXJNNXJCAVXMW-UHFFFAOYSA-N 2 0 373.566 4.242 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2)ccc1OC ZINC000182285262 1125322445 /nfs/dbraw/zinc/32/24/45/1125322445.db2.gz YKPZUTVBPOAWMG-IERDGZPVSA-N 2 0 374.500 4.060 20 0 FIADRP C[NH+]1CCC(O)(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000543016697 1125410843 /nfs/dbraw/zinc/41/08/43/1125410843.db2.gz KHUYUAAEPBLCBI-IBGZPJMESA-N 2 0 350.934 4.008 20 0 FIADRP CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000602565035 567995509 /nfs/dbraw/zinc/99/55/09/567995509.db2.gz OJAQVGHIWCHJAY-ZPKOFLGFSA-N 2 0 374.594 4.024 20 0 FIADRP CSc1cc(C[NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)ccn1 ZINC000563120106 568224902 /nfs/dbraw/zinc/22/49/02/568224902.db2.gz RNYYBVOVAYVWJJ-IBGZPJMESA-N 2 0 353.535 4.090 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCCC23CC[NH2+]CC3)nc1 ZINC001164420528 718911756 /nfs/dbraw/zinc/91/17/56/718911756.db2.gz KIURIBUXVCKFDU-HXUWFJFHSA-N 2 0 356.558 4.131 20 0 FIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CC[NH+](C3CCCC3)CC2)nc1 ZINC001165033363 721861995 /nfs/dbraw/zinc/86/19/95/721861995.db2.gz LBHSWMKRMCXELE-NRFANRHFSA-N 2 0 356.558 4.083 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000619772564 1125701026 /nfs/dbraw/zinc/70/10/26/1125701026.db2.gz OVMCUPUJBLFYRS-HXUWFJFHSA-N 2 0 374.532 4.361 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](CO)c2ccccc2)cc1C[NH+]1CCCCC1 ZINC000182977249 1125709917 /nfs/dbraw/zinc/70/99/17/1125709917.db2.gz YXBADGVMKKWYPM-XMSQKQJNSA-N 2 0 368.521 4.065 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCCCSC)cc1C[NH+]1CCCCC1 ZINC000182994549 1125713705 /nfs/dbraw/zinc/71/37/05/1125713705.db2.gz UYNOECYNMAMJOO-KRWDZBQOSA-N 2 0 350.572 4.475 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)NC2CC[NH+](C(C)C)CC2)ccc1OC ZINC000183165774 1125767516 /nfs/dbraw/zinc/76/75/16/1125767516.db2.gz GHZVLOPIECHRPZ-GOSISDBHSA-N 2 0 361.574 4.060 20 0 FIADRP Brc1ccccc1C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643547239 1079678178 /nfs/dbraw/zinc/67/81/78/1079678178.db2.gz BSOHHACQNCDQIP-FUHWJXTLSA-N 2 0 363.343 4.035 20 0 FIADRP CC[N@H+](C[C@@H](C[NH+](C)Cc1ccccc1)c1ccccc1)C[C@@H]1CCOC1 ZINC001167063836 1079898011 /nfs/dbraw/zinc/89/80/11/1079898011.db2.gz VBPGXGIKWPGCJQ-LADGPHEKSA-N 2 0 366.549 4.261 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC001625795724 1079911359 /nfs/dbraw/zinc/91/13/59/1079911359.db2.gz BBEBEFSKODCHGY-PMACEKPBSA-N 2 0 373.585 4.016 20 0 FIADRP Cc1cc(Cl)ccc1NC(=O)[C@@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000533409046 1080124279 /nfs/dbraw/zinc/12/42/79/1080124279.db2.gz QDAAOPGQCWBZTH-MRXNPFEDSA-N 2 0 365.949 4.028 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274808428 1080162005 /nfs/dbraw/zinc/16/20/05/1080162005.db2.gz XGECVZSNQFFGFO-ZMUKGBGYSA-N 2 0 364.533 4.407 20 0 FIADRP COCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000579898017 1080846981 /nfs/dbraw/zinc/84/69/81/1080846981.db2.gz VSXIMYIYARUOAM-DKUWSORSSA-N 2 0 356.554 4.369 20 0 FIADRP C[NH+](C)CCc1ccccc1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000275564263 1080964738 /nfs/dbraw/zinc/96/47/38/1080964738.db2.gz DVOXKTJEYWGCFZ-UHFFFAOYSA-N 2 0 365.521 4.029 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2oc3ccccc3c2Br)CC1 ZINC000655783320 1081196661 /nfs/dbraw/zinc/19/66/61/1081196661.db2.gz BPHVKODEKWKPAJ-UHFFFAOYSA-N 2 0 351.288 4.158 20 0 FIADRP COc1ccc([C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c2ccccc2Cl)cc1 ZINC000655804911 1081211728 /nfs/dbraw/zinc/21/17/28/1081211728.db2.gz FWMMZQZVRRXNIZ-XPIZARPCSA-N 2 0 358.913 4.368 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1Br ZINC001648816714 1081237372 /nfs/dbraw/zinc/23/73/72/1081237372.db2.gz FOMULYBCBFPCOJ-OAHLLOKOSA-N 2 0 353.348 4.359 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000655848612 1081257130 /nfs/dbraw/zinc/25/71/30/1081257130.db2.gz JEFWVMMYWFOEMV-UIFIKXQLSA-N 2 0 357.542 4.134 20 0 FIADRP CC[NH+](CC)Cc1cccc(CNC2CC[NH+](C3CCCCC3)CC2)c1 ZINC001648826825 1081262908 /nfs/dbraw/zinc/26/29/08/1081262908.db2.gz QLNBDOCPDKQZOA-UHFFFAOYSA-N 2 0 357.586 4.415 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cccc(CC3CCC3)c2)cc1 ZINC001648828662 1081265933 /nfs/dbraw/zinc/26/59/33/1081265933.db2.gz NUTKPXFEMRPDEG-UHFFFAOYSA-N 2 0 352.522 4.259 20 0 FIADRP CCOC(=O)c1cnc2ccc(C)cc2c1N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000525460360 1081276038 /nfs/dbraw/zinc/27/60/38/1081276038.db2.gz XBAGPDRRXYHSLO-UHFFFAOYSA-N 2 0 369.509 4.031 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(OC)cc3c2C1 ZINC000122998715 1081419770 /nfs/dbraw/zinc/41/97/70/1081419770.db2.gz FWELKIOZHBFWNZ-SJORKVTESA-N 2 0 357.542 4.134 20 0 FIADRP C[C@H](NC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000471601584 1082042565 /nfs/dbraw/zinc/04/25/65/1082042565.db2.gz JURLHZKSXPNEPE-CQIJRDABSA-N 2 0 357.586 4.311 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000580713695 1082096317 /nfs/dbraw/zinc/09/63/17/1082096317.db2.gz GAAHQOUXKRZCEZ-OAHLLOKOSA-N 2 0 371.912 4.152 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1nccc2ccccc21 ZINC000580803140 1082145369 /nfs/dbraw/zinc/14/53/69/1082145369.db2.gz BKFDDCTWCLUEHU-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000580909618 1082218505 /nfs/dbraw/zinc/21/85/05/1082218505.db2.gz ASSGVENGGZELMO-UGKGYDQZSA-N 2 0 355.570 4.209 20 0 FIADRP FC(F)(F)[C@@H](C[NH2+]Cc1cc(-n2ccnc2)cs1)Cc1ccccc1 ZINC000580983219 1082268987 /nfs/dbraw/zinc/26/89/87/1082268987.db2.gz WMKOEKTWEIWSPD-OAHLLOKOSA-N 2 0 365.424 4.445 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCCCc2ccc(Cl)cc21 ZINC000581155073 1082351236 /nfs/dbraw/zinc/35/12/36/1082351236.db2.gz SBALNWZRHYQHRY-FQEVSTJZSA-N 2 0 373.928 4.233 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CCC(F)(F)CC3)CC2)c1 ZINC000647170307 1082743816 /nfs/dbraw/zinc/74/38/16/1082743816.db2.gz UYBRWAKKIHYXEN-UHFFFAOYSA-N 2 0 365.512 4.065 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2nc3ccccc3s2)CC1 ZINC000581911416 1083023115 /nfs/dbraw/zinc/02/31/15/1083023115.db2.gz STOSSTWNIFXOAD-QFBILLFUSA-N 2 0 357.567 4.472 20 0 FIADRP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+]CCSCc3ccccc3)C2)cc1 ZINC000430760096 1083153941 /nfs/dbraw/zinc/15/39/41/1083153941.db2.gz QPERIILUCLTANP-QFIPXVFZSA-N 2 0 354.563 4.074 20 0 FIADRP C[C@@H](c1cccc(F)c1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430913548 1083234720 /nfs/dbraw/zinc/23/47/20/1083234720.db2.gz WCSREKPRKQAPGQ-SFHVURJKSA-N 2 0 361.549 4.015 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000430922870 1083236962 /nfs/dbraw/zinc/23/69/62/1083236962.db2.gz CREZHEZBEFXFAT-DLBZAZTESA-N 2 0 351.494 4.059 20 0 FIADRP Cc1cccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2cccc(F)c2)c1 ZINC000510716015 1083259241 /nfs/dbraw/zinc/25/92/41/1083259241.db2.gz OFPIXZMNUYPZSK-DHIUTWEWSA-N 2 0 370.512 4.050 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1SC ZINC000090586542 1083304286 /nfs/dbraw/zinc/30/42/86/1083304286.db2.gz TXCKMGQWZMOVDN-DLBZAZTESA-N 2 0 350.572 4.436 20 0 FIADRP CC(C)OC1CCC([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000130265397 1083354904 /nfs/dbraw/zinc/35/49/04/1083354904.db2.gz NOMMDHWGOWDPSR-UHFFFAOYSA-N 2 0 373.585 4.043 20 0 FIADRP Cn1cc(C[C@@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000658236085 1083375641 /nfs/dbraw/zinc/37/56/41/1083375641.db2.gz SYIMPHRUPLXRRE-FPOVZHCZSA-N 2 0 374.617 4.400 20 0 FIADRP CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000658288434 1083394493 /nfs/dbraw/zinc/39/44/93/1083394493.db2.gz PHUYPAQOMKQNKC-CDNPAEQRSA-N 2 0 370.537 4.036 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)s1 ZINC000658319514 1083406118 /nfs/dbraw/zinc/40/61/18/1083406118.db2.gz DSRAMHYCPDJCHQ-APWZRJJASA-N 2 0 355.551 4.404 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccc(O)c1 ZINC000658320443 1083408551 /nfs/dbraw/zinc/40/85/51/1083408551.db2.gz YDENUTMZUMBHEX-WIYYLYMNSA-N 2 0 350.506 4.345 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000093734888 1083493504 /nfs/dbraw/zinc/49/35/04/1083493504.db2.gz VEOVQZMSJRSMHA-UHFFFAOYSA-N 2 0 354.494 4.023 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc(CC(F)(F)F)s1 ZINC000892465062 1083528825 /nfs/dbraw/zinc/52/88/25/1083528825.db2.gz BNEHLARLBFJZTF-UHFFFAOYSA-N 2 0 371.472 4.380 20 0 FIADRP Cc1cn2c(n1)[C@H](C[NH2+]C1CCC([N@H+](C)Cc3ccccc3)CC1)CCC2 ZINC000375842751 1083676348 /nfs/dbraw/zinc/67/63/48/1083676348.db2.gz WQRBQUGVPHZGEW-HWELCPFYSA-N 2 0 366.553 4.102 20 0 FIADRP Cc1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1Oc1cccnc1 ZINC000535806066 1083691137 /nfs/dbraw/zinc/69/11/37/1083691137.db2.gz CFXDUBRQECAMSL-TZIWHRDSSA-N 2 0 351.494 4.098 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1cccc(OCC[NH+](C)C)c1 ZINC000181342121 1083873708 /nfs/dbraw/zinc/87/37/08/1083873708.db2.gz PPIGFZGZDMVUMF-QGZVFWFLSA-N 2 0 371.525 4.050 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@]1(C)CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000382384492 1084129574 /nfs/dbraw/zinc/12/95/74/1084129574.db2.gz SDBDFIMOLWISRV-PKTZIBPZSA-N 2 0 350.506 4.184 20 0 FIADRP CCn1nc(C[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)c2ccccc21 ZINC000472038278 1084134399 /nfs/dbraw/zinc/13/43/99/1084134399.db2.gz OFRLNLYYQLRDEH-UHFFFAOYSA-N 2 0 350.510 4.188 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000537960154 1084255396 /nfs/dbraw/zinc/25/53/96/1084255396.db2.gz KISUAMZQIMKWJK-HSQYWUDLSA-N 2 0 358.570 4.403 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC2(CC1)c1ccccc1NC2=O ZINC000157892751 1084576449 /nfs/dbraw/zinc/57/64/49/1084576449.db2.gz ZQQLGNKAAFSLQA-MVBMGLOESA-N 2 0 369.553 4.063 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657338070 1084631293 /nfs/dbraw/zinc/63/12/93/1084631293.db2.gz IAIAKQKAGGOATI-IBGZPJMESA-N 2 0 370.403 4.036 20 0 FIADRP Cc1c(F)cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc1Br ZINC001140554361 1084675711 /nfs/dbraw/zinc/67/57/11/1084675711.db2.gz AYIMBVHTOANFPC-UHFFFAOYSA-N 2 0 369.322 4.204 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000066593992 1084728195 /nfs/dbraw/zinc/72/81/95/1084728195.db2.gz SKDPAMVFNGMSSQ-UHFFFAOYSA-N 2 0 374.960 4.390 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cs1 ZINC000548712097 1084791983 /nfs/dbraw/zinc/79/19/83/1084791983.db2.gz SJZUKOCZNGLQHV-CEMLEFRQSA-N 2 0 369.578 4.274 20 0 FIADRP C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000414239801 1084889816 /nfs/dbraw/zinc/88/98/16/1084889816.db2.gz ZDTBSLPFIWMDEY-QGZVFWFLSA-N 2 0 355.526 4.170 20 0 FIADRP C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000414240339 1084891169 /nfs/dbraw/zinc/89/11/69/1084891169.db2.gz ZVWGKEWILJJZOD-QGZVFWFLSA-N 2 0 355.526 4.170 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2c(C3CCC3)cnn2C)C[N@@H+]1Cc1ccccc1 ZINC000657415907 1084953089 /nfs/dbraw/zinc/95/30/89/1084953089.db2.gz OVQYVYXLJVCZOL-UYAOXDASSA-N 2 0 366.553 4.078 20 0 FIADRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000414300389 1084991654 /nfs/dbraw/zinc/99/16/54/1084991654.db2.gz IUANONVUJBYFQI-OAQYLSRUSA-N 2 0 374.475 4.033 20 0 FIADRP Cc1ccc([C@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)C2CCC2)o1 ZINC000414305127 1085011284 /nfs/dbraw/zinc/01/12/84/1085011284.db2.gz NGIUNXLAMCPAKV-JOCHJYFZSA-N 2 0 368.521 4.046 20 0 FIADRP COCc1csc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000657470981 1085162793 /nfs/dbraw/zinc/16/27/93/1085162793.db2.gz XOIJFOIUHFGHRC-LJQANCHMSA-N 2 0 358.551 4.286 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)C2)cc1 ZINC000684928075 1085195615 /nfs/dbraw/zinc/19/56/15/1085195615.db2.gz YQVCYVVFHVGJSS-KAOXLYBCSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000537938742 1085390804 /nfs/dbraw/zinc/39/08/04/1085390804.db2.gz MZYJDMGAGGUOQL-JLHGSKIFSA-N 2 0 356.485 4.223 20 0 FIADRP CCCCCOc1ccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000657536637 1085454939 /nfs/dbraw/zinc/45/49/39/1085454939.db2.gz LVXCBEMKRMNJTI-UHFFFAOYSA-N 2 0 374.569 4.236 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc(C)c3C)CC2)cc1 ZINC000063319670 1085516479 /nfs/dbraw/zinc/51/64/79/1085516479.db2.gz SHDQCYPSKVDQGU-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@]1(Cc2ccc(Cl)cc2)CCCOC1 ZINC000661428818 1085567678 /nfs/dbraw/zinc/56/76/78/1085567678.db2.gz UJCAAXQEPKYBPN-HXUWFJFHSA-N 2 0 361.917 4.007 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000040227371 1085575979 /nfs/dbraw/zinc/57/59/79/1085575979.db2.gz BSXFHSTZOGHLPT-SFHVURJKSA-N 2 0 351.332 4.291 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)C1 ZINC000563460838 1085648404 /nfs/dbraw/zinc/64/84/04/1085648404.db2.gz ZBGNTIHZZYTZFX-NQIIRXRSSA-N 2 0 374.912 4.318 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](c2cccnc2)C2CCCCC2)C[C@H](C)O1 ZINC000652166532 1085733481 /nfs/dbraw/zinc/73/34/81/1085733481.db2.gz VHTBRZOWHUVUGX-JQVVWYNYSA-N 2 0 359.558 4.182 20 0 FIADRP CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2[nH]cc(CC[NH+]3CCCC3)c2c1 ZINC001167625558 1085810433 /nfs/dbraw/zinc/81/04/33/1085810433.db2.gz VFIISHDATPQXNM-UHFFFAOYSA-N 2 0 368.569 4.291 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(NC(C)=O)c2)cc1 ZINC000120583603 1085852527 /nfs/dbraw/zinc/85/25/27/1085852527.db2.gz KLLOGDSRIUZRQV-QGZVFWFLSA-N 2 0 353.510 4.338 20 0 FIADRP COc1ccc([C@@H]([NH2+][C@H](C)C2CC[NH+](C)CC2)c2ccccc2OC)cc1 ZINC000090772242 1085883086 /nfs/dbraw/zinc/88/30/86/1085883086.db2.gz HERVJGPRHBBXKN-UZUQRXQVSA-N 2 0 368.521 4.113 20 0 FIADRP COc1ccccc1OC[C@@H](C)C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000090937715 1085908116 /nfs/dbraw/zinc/90/81/16/1085908116.db2.gz DCDBCXZAABSXCJ-SFHVURJKSA-N 2 0 360.542 4.097 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000652348451 1085927578 /nfs/dbraw/zinc/92/75/78/1085927578.db2.gz FESKZTPOJRTARD-LZLYRXPVSA-N 2 0 368.974 4.041 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@H](C)O1 ZINC000583184682 1086367997 /nfs/dbraw/zinc/36/79/97/1086367997.db2.gz JGWYTJYRAANPHU-OEWRPIJISA-N 2 0 352.522 4.461 20 0 FIADRP Cc1cc(Cl)cc(Cl)c1CNc1cccc(CN2CC[C@@H]([NH3+])C2)c1 ZINC001167795496 1086386945 /nfs/dbraw/zinc/38/69/45/1086386945.db2.gz IKNGHMWASLJNCV-MRXNPFEDSA-N 2 0 364.320 4.447 20 0 FIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295714 1086399783 /nfs/dbraw/zinc/39/97/83/1086399783.db2.gz HYEVVSGHLTXEBF-RHSMWYFYSA-N 2 0 374.916 4.163 20 0 FIADRP COc1cccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000662295537 1086401022 /nfs/dbraw/zinc/40/10/22/1086401022.db2.gz UUTARTJBJBKJLD-SFHVURJKSA-N 2 0 371.550 4.030 20 0 FIADRP COc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C)[C@H]3CCC[NH3+])cs2)cc1 ZINC000662311954 1086406812 /nfs/dbraw/zinc/40/68/12/1086406812.db2.gz DRETXBVRIBAUEY-DNVCBOLYSA-N 2 0 359.539 4.158 20 0 FIADRP C[C@@H](c1cc(F)ccc1F)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327711 1086418594 /nfs/dbraw/zinc/41/85/94/1086418594.db2.gz LJKINXUYFMWJAO-AWEZNQCLSA-N 2 0 374.479 4.096 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@H]1CCCSc2ccc(Br)cc21 ZINC000663438128 1086542104 /nfs/dbraw/zinc/54/21/04/1086542104.db2.gz FHCUGQBYYCIOCD-HNNXBMFYSA-N 2 0 357.361 4.308 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(Br)cs1 ZINC000663465830 1086565849 /nfs/dbraw/zinc/56/58/49/1086565849.db2.gz LRVLCSPCXWZJRZ-GXTWGEPZSA-N 2 0 357.361 4.283 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469980 1086575896 /nfs/dbraw/zinc/57/58/96/1086575896.db2.gz SHCQPUDPUWJRFY-QUCCMNQESA-N 2 0 371.569 4.239 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@H]2C[C@H](c3nc(C)cs3)O[C@@H]2C1 ZINC001167821767 1086592053 /nfs/dbraw/zinc/59/20/53/1086592053.db2.gz FOMLPVWJTRPBHK-FCGDIQPGSA-N 2 0 365.587 4.114 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCc2ccc(Br)cc2C1 ZINC001167824183 1086606504 /nfs/dbraw/zinc/60/65/04/1086606504.db2.gz CMZUEYTWSSBPDJ-OAHLLOKOSA-N 2 0 353.348 4.318 20 0 FIADRP CCOc1ccc(C(=O)C2CC[NH+]([C@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167824709 1086610245 /nfs/dbraw/zinc/61/02/45/1086610245.db2.gz FUHAHLQKFVGISI-LJQANCHMSA-N 2 0 374.569 4.491 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COc2cccnc2)C1 ZINC001167825850 1086613880 /nfs/dbraw/zinc/61/38/80/1086613880.db2.gz UBNAKYHAQBIZLI-SJBKTWHCSA-N 2 0 359.558 4.073 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H](c3ncc[nH]3)c3ccccc3)CC2)c1 ZINC000126458299 1086624105 /nfs/dbraw/zinc/62/41/05/1086624105.db2.gz JSORTJOZJWCLJD-HXUWFJFHSA-N 2 0 366.534 4.062 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+][C@@H]3CCC34CCOCC4)cc2)C1 ZINC000548794519 1086671839 /nfs/dbraw/zinc/67/18/39/1086671839.db2.gz KDZKWXYFWDUTLN-WOIUINJBSA-N 2 0 356.554 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@](C)(CNC(=O)OC(C)(C)C)C1 ZINC001167835214 1086700704 /nfs/dbraw/zinc/70/07/04/1086700704.db2.gz OWFSGGDLDGBVCV-GHTZIAJQSA-N 2 0 369.594 4.124 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(COc2ccc(F)cc2)CC1 ZINC001167837512 1086711515 /nfs/dbraw/zinc/71/15/15/1086711515.db2.gz LWTHXXVIDWMBJS-SFHVURJKSA-N 2 0 350.522 4.427 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001167838251 1086712147 /nfs/dbraw/zinc/71/21/47/1086712147.db2.gz SNJPBYITHWHYDQ-PXNSSMCTSA-N 2 0 352.950 4.398 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N(C)Cc2ccccc2F)CC1 ZINC001167840655 1086727419 /nfs/dbraw/zinc/72/74/19/1086727419.db2.gz GYTQBNLDHQJVHX-IBGZPJMESA-N 2 0 363.565 4.232 20 0 FIADRP Cn1ccnc1[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CC1 ZINC000127564719 1086735095 /nfs/dbraw/zinc/73/50/95/1086735095.db2.gz AANVBXDJWBZPQO-QHCPKHFHSA-N 2 0 374.532 4.390 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cc(Br)ccc1Cl ZINC000925807358 1086745460 /nfs/dbraw/zinc/74/54/60/1086745460.db2.gz ACEOPZMHSKWCNB-JTQLQIEISA-N 2 0 368.706 4.115 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000650706439 1086755481 /nfs/dbraw/zinc/75/54/81/1086755481.db2.gz KOJFAGDMBVZWKY-ILZDJORESA-N 2 0 374.525 4.273 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Cl)s1 ZINC000583523014 1086766257 /nfs/dbraw/zinc/76/62/57/1086766257.db2.gz ITYXHBWLYUZIMZ-OAHLLOKOSA-N 2 0 367.946 4.368 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](CCCc3c(Cl)cccc3Cl)C2)C1 ZINC000650708696 1086767851 /nfs/dbraw/zinc/76/78/51/1086767851.db2.gz JBQZGCCPFXZOMI-SPYBWZPUSA-N 2 0 371.352 4.144 20 0 FIADRP Clc1ccc2c(ccn2CCN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000583528306 1086771519 /nfs/dbraw/zinc/77/15/19/1086771519.db2.gz NVVLAHKOHABPDL-UWJYYQICSA-N 2 0 357.929 4.243 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650713023 1086785288 /nfs/dbraw/zinc/78/52/88/1086785288.db2.gz BWJIVUFOXMWKRU-UHFFFAOYSA-N 2 0 360.505 4.066 20 0 FIADRP C[C@@H](C[NH2+]Cc1ncc(CN(C)C)s1)c1c(Cl)cccc1Cl ZINC000512128225 1086795818 /nfs/dbraw/zinc/79/58/18/1086795818.db2.gz DQNMVMXIWFTYHS-NSHDSACASA-N 2 0 358.338 4.405 20 0 FIADRP COCC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657773891 1086855833 /nfs/dbraw/zinc/85/58/33/1086855833.db2.gz VOWCRMGIKFAYFO-ORFBVSJDSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000650745691 1086928406 /nfs/dbraw/zinc/92/84/06/1086928406.db2.gz LVRJSFYBHZFNJA-LBPRGKRZSA-N 2 0 367.324 4.267 20 0 FIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1 ZINC000650746178 1086929829 /nfs/dbraw/zinc/92/98/29/1086929829.db2.gz XTFJEKPRNYNOII-GOSISDBHSA-N 2 0 350.840 4.426 20 0 FIADRP CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)[NH2+]CCC2(C[NH3+])CC2)nc1 ZINC000650748672 1086939803 /nfs/dbraw/zinc/93/98/03/1086939803.db2.gz ZGUOVQNMSDWFHP-OAQYLSRUSA-N 2 0 371.956 4.170 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)cc(Br)c1 ZINC000650754502 1086961857 /nfs/dbraw/zinc/96/18/57/1086961857.db2.gz KIBTWFKVLLBZMQ-KRWDZBQOSA-N 2 0 369.253 4.427 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC1CC[NH2+]CC1)CCC2 ZINC000650763762 1086993479 /nfs/dbraw/zinc/99/34/79/1086993479.db2.gz JCKUYXMWLYYGSH-QGZVFWFLSA-N 2 0 359.514 4.306 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650764265 1086994673 /nfs/dbraw/zinc/99/46/73/1086994673.db2.gz UWKAWFSESZFOOQ-GOSISDBHSA-N 2 0 371.550 4.175 20 0 FIADRP CCc1oc2ccccc2c1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CCOC ZINC000583878297 1087012658 /nfs/dbraw/zinc/01/26/58/1087012658.db2.gz XQBCAELZXGCBPD-JWTNVVGKSA-N 2 0 356.510 4.069 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(-n2ccnc2)c1 ZINC000151661283 1087197045 /nfs/dbraw/zinc/19/70/45/1087197045.db2.gz MMKSWGMPYICNTE-GOSISDBHSA-N 2 0 352.526 4.320 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000151796416 1087260615 /nfs/dbraw/zinc/26/06/15/1087260615.db2.gz GHUSDDDHAMNRAX-LLVKDONJSA-N 2 0 365.732 4.002 20 0 FIADRP Cc1cc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)ccc1Oc1cccnc1 ZINC000584343864 1087273035 /nfs/dbraw/zinc/27/30/35/1087273035.db2.gz QAOGSRKRMOVWMW-NRFANRHFSA-N 2 0 365.521 4.346 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@H]1CCCn2nccc21)C1CCCCC1 ZINC000657841468 1087279427 /nfs/dbraw/zinc/27/94/27/1087279427.db2.gz GUVOASVJEDGJEX-NRFANRHFSA-N 2 0 352.526 4.272 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657842144 1087284497 /nfs/dbraw/zinc/28/44/97/1087284497.db2.gz UNBBVCLJCMFCDL-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]CCC(=O)Nc3ccccc3)cc2)CC1 ZINC000548826282 1087333371 /nfs/dbraw/zinc/33/33/71/1087333371.db2.gz IQQNURBACKKXFJ-UHFFFAOYSA-N 2 0 365.521 4.037 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(SC2CCCC2)cc1 ZINC000151883558 1087357769 /nfs/dbraw/zinc/35/77/69/1087357769.db2.gz JRYFERURADPJCB-KRWDZBQOSA-N 2 0 362.583 4.076 20 0 FIADRP c1ccc([C@@H](C[C@H]2CCOC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089214759 1087380323 /nfs/dbraw/zinc/38/03/23/1087380323.db2.gz GLZOBDYGTKHJMD-NFBKMPQASA-N 2 0 365.521 4.056 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)CC1 ZINC000091285546 1087426820 /nfs/dbraw/zinc/42/68/20/1087426820.db2.gz IRVIQSILHTYCJW-APWZRJJASA-N 2 0 371.491 4.018 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091333616 1087427557 /nfs/dbraw/zinc/42/75/57/1087427557.db2.gz YPHFVZLKMWIVGD-IBGZPJMESA-N 2 0 371.491 4.020 20 0 FIADRP c1csc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000093769300 1087456235 /nfs/dbraw/zinc/45/62/35/1087456235.db2.gz SKUFSCTTXHYCNO-UHFFFAOYSA-N 2 0 358.555 4.226 20 0 FIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)cc2cccnc21 ZINC000685456755 1087573059 /nfs/dbraw/zinc/57/30/59/1087573059.db2.gz ZCCNYQJQLONNIR-UHFFFAOYSA-N 2 0 351.469 4.458 20 0 FIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C(C)(C)C(F)F ZINC000657896698 1087592128 /nfs/dbraw/zinc/59/21/28/1087592128.db2.gz BXBKVALGGBAJMK-KRWDZBQOSA-N 2 0 368.512 4.327 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cccc(C[NH+]2CCCCC2)c1 ZINC000413577438 1087654511 /nfs/dbraw/zinc/65/45/11/1087654511.db2.gz NANSYPFVRRUKLD-UHFFFAOYSA-N 2 0 365.521 4.295 20 0 FIADRP CC(C)[C@H]1C[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658070840 1087710891 /nfs/dbraw/zinc/71/08/91/1087710891.db2.gz RUWWWDSOFKOGBW-PKTZIBPZSA-N 2 0 356.554 4.352 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)cc1 ZINC000658071545 1087711336 /nfs/dbraw/zinc/71/13/36/1087711336.db2.gz XKTUYAUMUMZZIH-QFIPXVFZSA-N 2 0 362.533 4.394 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc(F)ccc1F ZINC000658134549 1087727243 /nfs/dbraw/zinc/72/72/43/1087727243.db2.gz BGCZWMRGJAFLNG-KNQAVFIVSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@H]([NH2+]CCc1ccnc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658128247 1087733343 /nfs/dbraw/zinc/73/33/43/1087733343.db2.gz CCHFXPMRKMXOGU-UGKGYDQZSA-N 2 0 359.517 4.278 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccccc1 ZINC000658143558 1087735229 /nfs/dbraw/zinc/73/52/29/1087735229.db2.gz ZHUYNVREMRVGRZ-XZOQPEGZSA-N 2 0 352.522 4.130 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000658137316 1087741699 /nfs/dbraw/zinc/74/16/99/1087741699.db2.gz GLFMTADMPPNYJJ-DLBZAZTESA-N 2 0 364.942 4.209 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](c3cccs3)C3CCCC3)cc2)C1 ZINC000658140663 1087745300 /nfs/dbraw/zinc/74/53/00/1087745300.db2.gz QOBDEHGQNQIKBY-RBBKRZOGSA-N 2 0 370.562 4.336 20 0 FIADRP CC(C)c1nc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cs1 ZINC000658163922 1087757304 /nfs/dbraw/zinc/75/73/04/1087757304.db2.gz BZXMSIFRCKIILI-INIZCTEOSA-N 2 0 358.555 4.224 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc(F)ccc1F ZINC000658164838 1087760442 /nfs/dbraw/zinc/76/04/42/1087760442.db2.gz FVDVOGCTKMIHRP-NRFANRHFSA-N 2 0 359.464 4.313 20 0 FIADRP C[C@H](CCc1ccccc1F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165306 1087762420 /nfs/dbraw/zinc/76/24/20/1087762420.db2.gz IJCQZIOFOPWZEV-GOSISDBHSA-N 2 0 355.501 4.044 20 0 FIADRP CCO[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C12CCCCC2 ZINC000658166756 1087762959 /nfs/dbraw/zinc/76/29/59/1087762959.db2.gz ONHFFQABZVIDTF-FCHUYYIVSA-N 2 0 371.569 4.011 20 0 FIADRP Cc1ccc([C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CCC2)o1 ZINC000658166296 1087763126 /nfs/dbraw/zinc/76/31/26/1087763126.db2.gz NSEOWILFEYXJRU-JOCHJYFZSA-N 2 0 353.510 4.326 20 0 FIADRP Cc1cc([C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)ccc1F ZINC000658168122 1087763773 /nfs/dbraw/zinc/76/37/73/1087763773.db2.gz VVMPMEPZBZJPCF-QHCPKHFHSA-N 2 0 367.512 4.482 20 0 FIADRP Cc1cc([C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)ccc1F ZINC000658168115 1087764949 /nfs/dbraw/zinc/76/49/49/1087764949.db2.gz VVMPMEPZBZJPCF-HSZRJFAPSA-N 2 0 367.512 4.482 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+][C@H]2CCC23CCOCC3)C1 ZINC000548861105 1087770511 /nfs/dbraw/zinc/77/05/11/1087770511.db2.gz GYYMNLUFYOGXFK-KNKQGSTJSA-N 2 0 356.554 4.213 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(Cl)c1 ZINC000424265558 1087886220 /nfs/dbraw/zinc/88/62/20/1087886220.db2.gz JXDONPIOQOGKGX-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H]1CC2(C[N@@H+]1Cc1nc(-c3c(F)cccc3F)cs1)CC[NH2+]CC2 ZINC000424296634 1087902337 /nfs/dbraw/zinc/90/23/37/1087902337.db2.gz SCSUQQWVJLXXII-ZDUSSCGKSA-N 2 0 363.477 4.052 20 0 FIADRP CC(C)c1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424299763 1087904741 /nfs/dbraw/zinc/90/47/41/1087904741.db2.gz VREUQWFYPILBRO-SFHVURJKSA-N 2 0 371.569 4.336 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(Cl)c1 ZINC000424319219 1087917611 /nfs/dbraw/zinc/91/76/11/1087917611.db2.gz SCKYLFNVZJTGTH-ZDUSSCGKSA-N 2 0 350.865 4.400 20 0 FIADRP c1cc(-c2ccccc2)sc1C[NH+]1CCC(n2ncc3c2C[NH2+]C3)CC1 ZINC000424374599 1087962376 /nfs/dbraw/zinc/96/23/76/1087962376.db2.gz IHNVANXYYWXWMP-UHFFFAOYSA-N 2 0 364.518 4.052 20 0 FIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000504896668 1087969114 /nfs/dbraw/zinc/96/91/14/1087969114.db2.gz ZDYQTFLXIBOYHO-CVDCTZTESA-N 2 0 363.549 4.081 20 0 FIADRP CCOc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccccc2)cc1 ZINC000647551135 1088066301 /nfs/dbraw/zinc/06/63/01/1088066301.db2.gz ZKQHHBXVHDXCJJ-ZZLPTCMGSA-N 2 0 350.506 4.152 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000414808105 1088178044 /nfs/dbraw/zinc/17/80/44/1088178044.db2.gz KCARCKXLSAHBNN-MRXNPFEDSA-N 2 0 357.929 4.114 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414810472 1088201001 /nfs/dbraw/zinc/20/10/01/1088201001.db2.gz OERVQEYCAAWZPH-IRXDYDNUSA-N 2 0 353.510 4.337 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCc3c2cccc3F)C[C@H](C)O1 ZINC000513867228 1088494244 /nfs/dbraw/zinc/49/42/44/1088494244.db2.gz CZLWHLRIIOQLIO-MFEFFIJZSA-N 2 0 368.496 4.212 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000311395649 1088619784 /nfs/dbraw/zinc/61/97/84/1088619784.db2.gz OVWADUDAWLKEAT-CVDCTZTESA-N 2 0 352.522 4.128 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(COCc3ccccc3)c2)[C@H]2CCC[C@H]21 ZINC000514090569 1088736456 /nfs/dbraw/zinc/73/64/56/1088736456.db2.gz VLBBGXOMWHMGAV-TZRRMPRUSA-N 2 0 364.533 4.366 20 0 FIADRP c1nc(CN2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)oc1C1CC1 ZINC000366604219 1089025302 /nfs/dbraw/zinc/02/53/02/1089025302.db2.gz AIEYUVIUVSHNEE-UHFFFAOYSA-N 2 0 351.494 4.040 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000415011003 1089039700 /nfs/dbraw/zinc/03/97/00/1089039700.db2.gz VPYQTTFREJAAHH-HZMBPMFUSA-N 2 0 354.338 4.331 20 0 FIADRP CCc1ccccc1[C@H]([NH3+])CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000415044211 1089083675 /nfs/dbraw/zinc/08/36/75/1089083675.db2.gz BLIWTZSOCJKAGQ-PQFKCJEGSA-N 2 0 363.549 4.034 20 0 FIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415049268 1089086495 /nfs/dbraw/zinc/08/64/95/1089086495.db2.gz XROLECQLZPREDO-OFNKIYASSA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000415054530 1089098269 /nfs/dbraw/zinc/09/82/69/1089098269.db2.gz NRQNRMDZISZICL-JOCHJYFZSA-N 2 0 371.956 4.374 20 0 FIADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000415080266 1089134026 /nfs/dbraw/zinc/13/40/26/1089134026.db2.gz JDIJINLUOGXWOK-WMLDXEAASA-N 2 0 370.368 4.078 20 0 FIADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCc1nc(-c2ccncc2)cs1 ZINC000415083148 1089139977 /nfs/dbraw/zinc/13/99/77/1089139977.db2.gz MZCTZVFJFWZNLJ-WMZOPIPTSA-N 2 0 358.555 4.038 20 0 FIADRP C[C@H](C[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000415116474 1089176354 /nfs/dbraw/zinc/17/63/54/1089176354.db2.gz BJSLARBBAWLQMZ-MDASCCDHSA-N 2 0 370.459 4.027 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3cc(-c4ccccc4)cs3)CC2)C1 ZINC000415126458 1089178700 /nfs/dbraw/zinc/17/87/00/1089178700.db2.gz PIHLSDQPBDHFTL-FPOVZHCZSA-N 2 0 356.535 4.133 20 0 FIADRP Cc1ccc(-c2cccc(C[NH+]3CCC([C@H]4C[C@H]([NH3+])CCO4)CC3)c2)cc1 ZINC000415126090 1089180788 /nfs/dbraw/zinc/18/07/88/1089180788.db2.gz PCUFXKGOXFUNGU-DNQXCXABSA-N 2 0 364.533 4.380 20 0 FIADRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000415120969 1089182137 /nfs/dbraw/zinc/18/21/37/1089182137.db2.gz GWZRKDRRTQUJEA-TZIWHRDSSA-N 2 0 374.525 4.273 20 0 FIADRP CC(C)[C@@H](C[NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000415134191 1089190216 /nfs/dbraw/zinc/19/02/16/1089190216.db2.gz OBWLETCZLGWFOF-HSZRJFAPSA-N 2 0 365.565 4.009 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3)CC2)C1 ZINC000415130259 1089194786 /nfs/dbraw/zinc/19/47/86/1089194786.db2.gz WOKSBOWIKROKAL-XZOQPEGZSA-N 2 0 350.506 4.072 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000514602027 1089257723 /nfs/dbraw/zinc/25/77/23/1089257723.db2.gz DJSNIDXZKDSVKJ-DENIHFKCSA-N 2 0 374.532 4.158 20 0 FIADRP C[C@@H]1COCC[C@@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549236667 1089309751 /nfs/dbraw/zinc/30/97/51/1089309751.db2.gz DBGXKGOQMMKLIC-HFRGQYLWSA-N 2 0 362.945 4.269 20 0 FIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCCC3CCOCC3)C2)s1 ZINC000514865068 1089555691 /nfs/dbraw/zinc/55/56/91/1089555691.db2.gz FKWPVLIWYXJXTQ-IBGZPJMESA-N 2 0 350.572 4.017 20 0 FIADRP COc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c(-c2ccccc2)cc1OC ZINC000435396843 1089604453 /nfs/dbraw/zinc/60/44/53/1089604453.db2.gz ZNRQNWMKLADRNJ-YOFSQIOKSA-N 2 0 366.505 4.086 20 0 FIADRP Cc1nccn1CCCC[NH2+]Cc1sccc1NC(=O)OC(C)(C)C ZINC000893030025 1089706180 /nfs/dbraw/zinc/70/61/80/1089706180.db2.gz OOWPCXXLHLSIEQ-UHFFFAOYSA-N 2 0 364.515 4.170 20 0 FIADRP COc1ccc2[nH]cc(C3CC[NH+](CC[C@@H]4CCCC[N@@H+]4C)CC3)c2c1 ZINC000472855357 1089779098 /nfs/dbraw/zinc/77/90/98/1089779098.db2.gz HDQOLDPIYLQSOJ-SFHVURJKSA-N 2 0 355.526 4.230 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000378398340 1090344999 /nfs/dbraw/zinc/34/49/99/1090344999.db2.gz QOXMXORYQLRLQT-HARLFGEKSA-N 2 0 368.521 4.055 20 0 FIADRP Fc1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000363863361 1090418468 /nfs/dbraw/zinc/41/84/68/1090418468.db2.gz KQVDCPTWPUDMDJ-IRLDBZIGSA-N 2 0 360.517 4.433 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000511565599 1090441265 /nfs/dbraw/zinc/44/12/65/1090441265.db2.gz KJLJRHPULSHRIC-QPXQOZNCSA-N 2 0 352.522 4.069 20 0 FIADRP CC(C)[NH+]1CCN(C2CC[NH+](C[C@@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000660151625 1090655074 /nfs/dbraw/zinc/65/50/74/1090655074.db2.gz UQBNYJIGGFMWGM-FYYLOGMGSA-N 2 0 369.597 4.061 20 0 FIADRP Cc1n[nH]cc1C1CC[NH+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000584707382 1090758314 /nfs/dbraw/zinc/75/83/14/1090758314.db2.gz PTLNFVXZBUQTTJ-UHFFFAOYSA-N 2 0 352.526 4.084 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CCCO1 ZINC000584759984 1090845285 /nfs/dbraw/zinc/84/52/85/1090845285.db2.gz BOMNJVSWNMSBOW-WMZHIEFXSA-N 2 0 370.512 4.200 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)cc2)CC1 ZINC000418042055 1091035827 /nfs/dbraw/zinc/03/58/27/1091035827.db2.gz LBBZNLDMZUTJNY-REWPJTCUSA-N 2 0 350.506 4.053 20 0 FIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000136745815 1091152979 /nfs/dbraw/zinc/15/29/79/1091152979.db2.gz CAYNYMDZXUVYRD-OAQYLSRUSA-N 2 0 372.553 4.133 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000511772556 1091657176 /nfs/dbraw/zinc/65/71/76/1091657176.db2.gz MPIMTXJENRGRTE-WOIUINJBSA-N 2 0 352.522 4.214 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4cccc5cccnc54)C3)C2)cc1 ZINC000512237840 1091943708 /nfs/dbraw/zinc/94/37/08/1091943708.db2.gz WTPYPGUPFMGXJI-DEOSSOPVSA-N 2 0 357.501 4.333 20 0 FIADRP [NH2+]=C(NCCCC[NH3+])Nc1cc(-c2ccccc2)c2cc(Cl)ccc2n1 ZINC001167881151 1091950473 /nfs/dbraw/zinc/95/04/73/1091950473.db2.gz XJYCCTYKKYXLDI-UHFFFAOYSA-N 2 0 367.884 4.230 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccc5ncccc5c4)C3)C2)cc1 ZINC000512246898 1091960101 /nfs/dbraw/zinc/96/01/01/1091960101.db2.gz VYCQAZXHRYGVDO-XMMPIXPASA-N 2 0 357.501 4.333 20 0 FIADRP CCCC[N@H+](C)CC1CCN(CC(=O)Nc2ccc(Cl)cc2C)CC1 ZINC000512250463 1091964829 /nfs/dbraw/zinc/96/48/29/1091964829.db2.gz ULNPHKRYZSQJKR-UHFFFAOYSA-N 2 0 365.949 4.031 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCO1 ZINC000512286058 1092009540 /nfs/dbraw/zinc/00/95/40/1092009540.db2.gz ADOCEWMLFDBZRI-UDIRQSBCSA-N 2 0 370.581 4.470 20 0 FIADRP CC(C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000236701378 1092035873 /nfs/dbraw/zinc/03/58/73/1092035873.db2.gz LJMHSWKBOOVIRK-UHFFFAOYSA-N 2 0 374.475 4.464 20 0 FIADRP CCN1CCC([NH2+][C@@H](C)C[C@@H]2CCCCCN2C(=O)OC(C)(C)C)CC1 ZINC000236859011 1092070414 /nfs/dbraw/zinc/07/04/14/1092070414.db2.gz PORMDSNBODFSPR-HKUYNNGSSA-N 2 0 367.578 4.019 20 0 FIADRP COc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)c(-c2ccccc2)cc1OC ZINC000093088844 1092229170 /nfs/dbraw/zinc/22/91/70/1092229170.db2.gz DIRMEVCBRXARFK-UHFFFAOYSA-N 2 0 368.521 4.144 20 0 FIADRP Cc1ccccc1OCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012156 1092332245 /nfs/dbraw/zinc/33/22/45/1092332245.db2.gz XBGWBVAVNLVPBA-PMACEKPBSA-N 2 0 352.522 4.405 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccc(C[NH+](C)C)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012184 1092345473 /nfs/dbraw/zinc/34/54/73/1092345473.db2.gz XOPDXFYFDRLVNU-PMACEKPBSA-N 3 0 365.565 4.279 20 0 FIADRP Clc1ccc(-c2nc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cs2)cc1 ZINC000520959646 1092373761 /nfs/dbraw/zinc/37/37/61/1092373761.db2.gz ALPJHHNUMLBIGQ-UHFFFAOYSA-N 2 0 361.942 4.428 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(Cl)c2)CC1 ZINC000236803130 1092424508 /nfs/dbraw/zinc/42/45/08/1092424508.db2.gz QDHJMEIAIXZREF-UHFFFAOYSA-N 2 0 357.929 4.162 20 0 FIADRP C[NH+]1CCN(C[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)c2ccccc2)CC1 ZINC000549734080 1092732247 /nfs/dbraw/zinc/73/22/47/1092732247.db2.gz PNBQSQAXEWXOTM-XMMPIXPASA-N 2 0 363.549 4.032 20 0 FIADRP C[NH+]1CCN(C[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)c2ccccc2)CC1 ZINC000549734079 1092732743 /nfs/dbraw/zinc/73/27/43/1092732743.db2.gz PNBQSQAXEWXOTM-DEOSSOPVSA-N 2 0 363.549 4.032 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)C2)cc1 ZINC000442709030 1092734165 /nfs/dbraw/zinc/73/41/65/1092734165.db2.gz MZVAONBPDSRHFM-KYJSFNMBSA-N 2 0 352.444 4.415 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)n2)c1 ZINC000442756192 1092755734 /nfs/dbraw/zinc/75/57/34/1092755734.db2.gz YVHTZGDZQIDNFS-IHPCNDPISA-N 2 0 366.509 4.316 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)CC2)CC1 ZINC000442815833 1092786446 /nfs/dbraw/zinc/78/64/46/1092786446.db2.gz CWQJVNCLCBAWIA-XBMUEBEBSA-N 2 0 351.538 4.268 20 0 FIADRP CCC[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000442872578 1092819472 /nfs/dbraw/zinc/81/94/72/1092819472.db2.gz JUNMTAMBLFEZNC-GOSISDBHSA-N 2 0 371.491 4.162 20 0 FIADRP C[N@@H+]1CCN(CC[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1(C)C ZINC000442874966 1092822114 /nfs/dbraw/zinc/82/21/14/1092822114.db2.gz RXDXXVPDEIGOOE-NRFANRHFSA-N 2 0 371.956 4.045 20 0 FIADRP CC(C)[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000442877172 1092829784 /nfs/dbraw/zinc/82/97/84/1092829784.db2.gz QZVNAPGBATXDKE-GOSISDBHSA-N 2 0 371.491 4.018 20 0 FIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000442918941 1092866525 /nfs/dbraw/zinc/86/65/25/1092866525.db2.gz DILBXKMHVWNIAR-ZDUSSCGKSA-N 2 0 369.456 4.390 20 0 FIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1OC(C)C ZINC000521817499 1092935831 /nfs/dbraw/zinc/93/58/31/1092935831.db2.gz DWSVLKPMOXHVHN-OALUTQOASA-N 2 0 362.558 4.330 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)C[N@@H+]1Cc1ccccc1 ZINC000474039826 1092951076 /nfs/dbraw/zinc/95/10/76/1092951076.db2.gz TWOLZINXHHLXJL-HYPCABPSSA-N 2 0 370.581 4.472 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000474042941 1093037367 /nfs/dbraw/zinc/03/73/67/1093037367.db2.gz FJEJFZDGEYSNBS-XPWALMASSA-N 2 0 356.554 4.357 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cs1 ZINC000512636277 1093053908 /nfs/dbraw/zinc/05/39/08/1093053908.db2.gz KWGPJIKUDMDHPD-SESVDKBCSA-N 2 0 369.578 4.138 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]CC3CCCCCC3)C3(C2)CCOCC3)cc1 ZINC000549867913 1093104589 /nfs/dbraw/zinc/10/45/89/1093104589.db2.gz HQZBXOGGMDJKOD-HSZRJFAPSA-N 2 0 370.581 4.475 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000474065130 1093173733 /nfs/dbraw/zinc/17/37/33/1093173733.db2.gz IKLIAFJMGMFQFW-QFIPXVFZSA-N 2 0 368.521 4.148 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000474065128 1093173958 /nfs/dbraw/zinc/17/39/58/1093173958.db2.gz IKLIAFJMGMFQFW-JOCHJYFZSA-N 2 0 368.521 4.148 20 0 FIADRP C[C@H](O)C[NH+]1CCC(C[N@H+](C)[C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000443584876 1093284389 /nfs/dbraw/zinc/28/43/89/1093284389.db2.gz TXGNBUYMPFWZCA-ORAYPTAESA-N 2 0 371.352 4.005 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000443623545 1093343581 /nfs/dbraw/zinc/34/35/81/1093343581.db2.gz PURMMEJMIAMNBI-JXFKEZNVSA-N 2 0 372.944 4.410 20 0 FIADRP Cc1ccc(NC(=O)[C@@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc2)cc1 ZINC000419300263 1093503492 /nfs/dbraw/zinc/50/34/92/1093503492.db2.gz LQMBSGBJVIYHPY-QFIPXVFZSA-N 2 0 365.521 4.139 20 0 FIADRP COc1ccc(Oc2ccc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cc2)cc1 ZINC000544183379 1093511383 /nfs/dbraw/zinc/51/13/83/1093511383.db2.gz FDUVRURZVFMUFQ-GOSISDBHSA-N 2 0 352.478 4.061 20 0 FIADRP C[C@H]1CC(NC(=[NH2+])c2cccnc2Cl)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168028548 1093537830 /nfs/dbraw/zinc/53/78/30/1093537830.db2.gz PHCRNWGKBSGWQS-GJZGRUSLSA-N 2 0 356.901 4.092 20 0 FIADRP C[C@H]1CC(NCc2cncnc2C(C)(C)F)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168030468 1093580117 /nfs/dbraw/zinc/58/01/17/1093580117.db2.gz VWPYPZRPPYEAMO-IRXDYDNUSA-N 2 0 370.516 4.212 20 0 FIADRP CCCC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535918018 1093597513 /nfs/dbraw/zinc/59/75/13/1093597513.db2.gz JFTLIOZIUZLCNC-IBGZPJMESA-N 2 0 372.384 4.452 20 0 FIADRP Clc1ccc(-c2nc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cs2)cc1 ZINC000246447112 1093676940 /nfs/dbraw/zinc/67/69/40/1093676940.db2.gz OZZIFLSSCKZDLR-AEFFLSMTSA-N 2 0 361.942 4.222 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(OC)c(OC)cc2-c2ccccc2)C1 ZINC000067222654 1093719150 /nfs/dbraw/zinc/71/91/50/1093719150.db2.gz CFQKCAVGVOHYDK-SFHVURJKSA-N 2 0 368.521 4.192 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc3ccccc3n2)cc1 ZINC000614387532 1093805305 /nfs/dbraw/zinc/80/53/05/1093805305.db2.gz JXSJPGACGIUQMB-GOSISDBHSA-N 2 0 360.505 4.294 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000474474550 1093819706 /nfs/dbraw/zinc/81/97/06/1093819706.db2.gz HFRCMLJDVXUSSZ-OTWHNJEPSA-N 2 0 362.558 4.298 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)CCCC[NH+]3CCCC3)cc2)CC1 ZINC000729321093 1093962343 /nfs/dbraw/zinc/96/23/43/1093962343.db2.gz RFLPAUWQKPECBJ-UHFFFAOYSA-N 2 0 357.542 4.123 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(F)cc23)CC1 ZINC000513231521 1094014509 /nfs/dbraw/zinc/01/45/09/1094014509.db2.gz DUWYDKRHUQFABQ-KSFYIVLOSA-N 2 0 357.517 4.482 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](Cc2ccccn2)c2cccnc2)c1 ZINC000513364817 1094081385 /nfs/dbraw/zinc/08/13/85/1094081385.db2.gz JMMNRTYYVWTDEL-HSZRJFAPSA-N 2 0 360.505 4.002 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OC(F)F ZINC000513365674 1094082396 /nfs/dbraw/zinc/08/23/96/1094082396.db2.gz RRCGKMQESSSOFY-GOEBONIOSA-N 2 0 368.468 4.039 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)cc1 ZINC000513372731 1094090053 /nfs/dbraw/zinc/09/00/53/1094090053.db2.gz QZDJQWMJHMPTMW-IPJJNNNSSA-N 2 0 371.569 4.006 20 0 FIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(OC)c1 ZINC000513510500 1094184948 /nfs/dbraw/zinc/18/49/48/1094184948.db2.gz DDNMHCOUICJICE-QUCCMNQESA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(F)c(C)c2)CC1 ZINC000236984663 1094335951 /nfs/dbraw/zinc/33/59/51/1094335951.db2.gz YFOOWHPNUOHIBT-KRWDZBQOSA-N 2 0 373.491 4.266 20 0 FIADRP CC(C)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168037177 1094350094 /nfs/dbraw/zinc/35/00/94/1094350094.db2.gz XCRDOJRQEMMQHA-ZFCUDEJISA-N 2 0 357.586 4.408 20 0 FIADRP CCC(CC)([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501004522 1094414388 /nfs/dbraw/zinc/41/43/88/1094414388.db2.gz BBYLWIOLZOYSRY-UHFFFAOYSA-N 2 0 365.993 4.361 20 0 FIADRP CC(C)Oc1cccc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501032585 1094431269 /nfs/dbraw/zinc/43/12/69/1094431269.db2.gz QCVURYYSSHXJQK-UHFFFAOYSA-N 2 0 353.510 4.217 20 0 FIADRP CC(C)C[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501057674 1094468282 /nfs/dbraw/zinc/46/82/82/1094468282.db2.gz XDUKEXHSUJXDLQ-NRFANRHFSA-N 2 0 365.993 4.433 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CCCCC1 ZINC000474720101 1094540391 /nfs/dbraw/zinc/54/03/91/1094540391.db2.gz ORLUKERUKNQJAI-LJQANCHMSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccc2c(c1)[C@H]([N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1)CCO2 ZINC000420296737 1094856209 /nfs/dbraw/zinc/85/62/09/1094856209.db2.gz DRJNZFNXULHETF-XMSQKQJNSA-N 2 0 366.505 4.021 20 0 FIADRP c1cc(C[N@@H+](CCCCC2CCOCC2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000420320635 1094882152 /nfs/dbraw/zinc/88/21/52/1094882152.db2.gz YUCJSGMHYCFWPE-HXUWFJFHSA-N 2 0 362.583 4.289 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420394244 1094910834 /nfs/dbraw/zinc/91/08/34/1094910834.db2.gz RNBKUGOAESANCE-DWQUBVKVSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420398870 1094912011 /nfs/dbraw/zinc/91/20/11/1094912011.db2.gz ZGIFIHOHJCFTAD-HNJNHCNJSA-N 2 0 357.325 4.273 20 0 FIADRP CC1CC[NH+](Cc2ccc(-c3noc([C@H]4CC[N@H+](C)[C@@H](C)C4)n3)cc2)CC1 ZINC000420480258 1094933505 /nfs/dbraw/zinc/93/35/05/1094933505.db2.gz IWPHSFNIMLTGBI-PXNSSMCTSA-N 2 0 368.525 4.166 20 0 FIADRP Cc1[nH+]ccc(N2CCc3c(ncn3CCc3ccccc3)C2)c1Cl ZINC000502014918 1095056558 /nfs/dbraw/zinc/05/65/58/1095056558.db2.gz KUWSVXJNXQHNCD-UHFFFAOYSA-N 2 0 352.869 4.045 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CCSC2(CCC2)CC1)C1CC[NH+](C)CC1 ZINC000414476078 1095137006 /nfs/dbraw/zinc/13/70/06/1095137006.db2.gz IRUGQADZKMORKB-UHFFFAOYSA-N 2 0 373.610 4.079 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000502239937 1095244774 /nfs/dbraw/zinc/24/47/74/1095244774.db2.gz DHRBFIONTKHNOR-LJQANCHMSA-N 2 0 362.558 4.045 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)CC1 ZINC000502239548 1095245166 /nfs/dbraw/zinc/24/51/66/1095245166.db2.gz CPTUGMWNTCTTHO-JOCHJYFZSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000502254654 1095274109 /nfs/dbraw/zinc/27/41/09/1095274109.db2.gz NVPPJGPGUNJRRB-UGKGYDQZSA-N 2 0 356.554 4.500 20 0 FIADRP COc1cc(C)c(C[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000502281372 1095302043 /nfs/dbraw/zinc/30/20/43/1095302043.db2.gz AEAKEYRLHBIELQ-RTBURBONSA-N 2 0 362.558 4.187 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000502281367 1095302942 /nfs/dbraw/zinc/30/29/42/1095302942.db2.gz AEAKEYRLHBIELQ-OALUTQOASA-N 2 0 362.558 4.187 20 0 FIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000502453304 1095473717 /nfs/dbraw/zinc/47/37/17/1095473717.db2.gz PCLOEDOWMSGZCC-XMSQKQJNSA-N 2 0 356.510 4.206 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000502469993 1095497418 /nfs/dbraw/zinc/49/74/18/1095497418.db2.gz DMCSBZQJLXXDDZ-OTWHNJEPSA-N 2 0 374.569 4.186 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)cc1 ZINC000237195473 1095522764 /nfs/dbraw/zinc/52/27/64/1095522764.db2.gz PYLVGVDGNMQMSY-UHFFFAOYSA-N 2 0 353.293 4.224 20 0 FIADRP COCCC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000281933374 1095747808 /nfs/dbraw/zinc/74/78/08/1095747808.db2.gz KOXKKVIHJNPIQD-JOCHJYFZSA-N 2 0 374.500 4.024 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000503074296 1096051018 /nfs/dbraw/zinc/05/10/18/1096051018.db2.gz QJOPOUFOBPDRHL-UYAOXDASSA-N 2 0 374.573 4.246 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)c2ccc(OC)cc2)cc1 ZINC000503076955 1096054335 /nfs/dbraw/zinc/05/43/35/1096054335.db2.gz WOVQFOICAPMELG-NFBKMPQASA-N 2 0 368.521 4.062 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000503162523 1096100635 /nfs/dbraw/zinc/10/06/35/1096100635.db2.gz VBAUMFGEYBXHRI-AKHDSKFASA-N 2 0 357.542 4.261 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H](c3ccc(F)cc3)C3CC3)cc2)CC1 ZINC000271754864 1096125527 /nfs/dbraw/zinc/12/55/27/1096125527.db2.gz SCJZCFJCKCHOAS-QHCPKHFHSA-N 2 0 368.496 4.023 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000422701934 1096456905 /nfs/dbraw/zinc/45/69/05/1096456905.db2.gz JNTNNCGMGAYPQS-CYBMUJFWSA-N 2 0 363.427 4.250 20 0 FIADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(OCc2ccccn2)cc1 ZINC000422718944 1096470613 /nfs/dbraw/zinc/47/06/13/1096470613.db2.gz LQSFANYTFFQQKH-AZUAARDMSA-N 2 0 353.510 4.061 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3c(cc2OC)C[C@H](C)O3)c1 ZINC000613262355 1096475882 /nfs/dbraw/zinc/47/58/82/1096475882.db2.gz UPHBXTJVKGHZSX-KRWDZBQOSA-N 2 0 368.521 4.150 20 0 FIADRP C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)CC1 ZINC000422747204 1096481057 /nfs/dbraw/zinc/48/10/57/1096481057.db2.gz PMCLBCJLKAMUGC-RLLPEYFOSA-N 2 0 355.570 4.112 20 0 FIADRP C[C@H]([NH2+]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl)C1C[NH2+]C1 ZINC000422765546 1096485378 /nfs/dbraw/zinc/48/53/78/1096485378.db2.gz QKOBTRQJQFELAT-KBXCAEBGSA-N 2 0 353.897 4.151 20 0 FIADRP CSc1cccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000422796282 1096493870 /nfs/dbraw/zinc/49/38/70/1096493870.db2.gz YBGHFIGGZZJXGQ-ORAYPTAESA-N 2 0 350.478 4.493 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422801659 1096495139 /nfs/dbraw/zinc/49/51/39/1096495139.db2.gz CIENTPLWLHIEPC-JLMDMGSGSA-N 2 0 356.554 4.363 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OC(C)C ZINC000422805429 1096496476 /nfs/dbraw/zinc/49/64/76/1096496476.db2.gz GSIYKGYULUUKPT-GJZGRUSLSA-N 2 0 357.498 4.056 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)Cc1ccc(Cl)cc1Cl ZINC000422862514 1096506547 /nfs/dbraw/zinc/50/65/47/1096506547.db2.gz PXDSEGPLFJWIJF-NEPJUHHUSA-N 2 0 352.309 4.437 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000422875524 1096518408 /nfs/dbraw/zinc/51/84/08/1096518408.db2.gz PAIUDNNLWYYYOG-UGSOOPFHSA-N 2 0 365.290 4.395 20 0 FIADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000422909865 1096521145 /nfs/dbraw/zinc/52/11/45/1096521145.db2.gz PDDMTAIKFKDGEP-CYFREDJKSA-N 2 0 374.532 4.076 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccccc2)cc1OC ZINC000422908919 1096521329 /nfs/dbraw/zinc/52/13/29/1096521329.db2.gz NDFBVLFAVZAFSO-FBPXKMNZSA-N 2 0 368.521 4.095 20 0 FIADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911372 1096521562 /nfs/dbraw/zinc/52/15/62/1096521562.db2.gz KPUSVCHKBDTWAC-VQIMIIECSA-N 2 0 357.567 4.281 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H](C)CCCC[NH3+])CCC3)cc1 ZINC000422912910 1096522372 /nfs/dbraw/zinc/52/23/72/1096522372.db2.gz XIQUZKCRVIAFFP-PBHICJAKSA-N 2 0 359.539 4.303 20 0 FIADRP C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414703562 1096524635 /nfs/dbraw/zinc/52/46/35/1096524635.db2.gz CKYXUSSDKBLLED-UTKZUKDTSA-N 2 0 372.557 4.185 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+]C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000422937182 1096529385 /nfs/dbraw/zinc/52/93/85/1096529385.db2.gz NSZQAIXJQSNJHG-SFHVURJKSA-N 2 0 367.320 4.426 20 0 FIADRP Clc1cccc2c1OCC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422947456 1096537026 /nfs/dbraw/zinc/53/70/26/1096537026.db2.gz QDCLOUHFSAEJKS-WFXMLNOXSA-N 2 0 370.880 4.009 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2ccc(Br)cc2)CCC1 ZINC000422947564 1096537079 /nfs/dbraw/zinc/53/70/79/1096537079.db2.gz YLAUOXYYWNGXHY-AWEZNQCLSA-N 2 0 374.326 4.341 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000423019421 1096550335 /nfs/dbraw/zinc/55/03/35/1096550335.db2.gz VNOOEKVDOPIYOM-BBRMVZONSA-N 2 0 364.839 4.153 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000423038639 1096557066 /nfs/dbraw/zinc/55/70/66/1096557066.db2.gz OTEVTTPRTZLNCV-CUHUQNRHSA-N 2 0 362.517 4.472 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](Cc2cccc(Br)c2)CC2CC2)CC1 ZINC000423046091 1096559950 /nfs/dbraw/zinc/55/99/50/1096559950.db2.gz DCURNWZHMJYNPQ-DAWZGUTISA-N 2 0 351.332 4.020 20 0 FIADRP Fc1ccccc1Oc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)ccn1 ZINC000423085751 1096569879 /nfs/dbraw/zinc/56/98/79/1096569879.db2.gz KMKUZNLDOFZNJA-YSIASYRMSA-N 2 0 369.484 4.413 20 0 FIADRP FC(F)(F)COc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423096250 1096572963 /nfs/dbraw/zinc/57/29/63/1096572963.db2.gz OHLVEJJDIVZPAB-GUDVDZBRSA-N 2 0 370.459 4.071 20 0 FIADRP c1cc2cc(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2s1 ZINC000423120917 1096579120 /nfs/dbraw/zinc/57/91/20/1096579120.db2.gz HVDUCMGSXFNWKE-RXVVDRJESA-N 2 0 350.487 4.247 20 0 FIADRP Fc1ccc(C2CC2)cc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423147293 1096587005 /nfs/dbraw/zinc/58/70/05/1096587005.db2.gz RPYOYVKZHFAVTR-IRLDBZIGSA-N 2 0 352.453 4.049 20 0 FIADRP COc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1OCc1ccccc1 ZINC000503949153 1096596728 /nfs/dbraw/zinc/59/67/28/1096596728.db2.gz XWMLGQFBDLHOTN-UHFFFAOYSA-N 2 0 368.521 4.096 20 0 FIADRP CCOc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1 ZINC000414721075 1096607603 /nfs/dbraw/zinc/60/76/03/1096607603.db2.gz FJEMWPRQWIQLTP-FQEVSTJZSA-N 2 0 356.535 4.291 20 0 FIADRP CCOc1cccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000414724260 1096621720 /nfs/dbraw/zinc/62/17/20/1096621720.db2.gz RJNRXTCYIPWRQD-HXUWFJFHSA-N 2 0 356.535 4.291 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000423229904 1096624748 /nfs/dbraw/zinc/62/47/48/1096624748.db2.gz IEHFZVUVSGWOKV-SEEARECTSA-N 2 0 357.723 4.413 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)NCC(C)(C)[NH3+] ZINC000423286333 1096634748 /nfs/dbraw/zinc/63/47/48/1096634748.db2.gz GPOSEOANDWTMGE-JTQLQIEISA-N 2 0 368.344 4.269 20 0 FIADRP CCC([NH3+])(CC)C[NH2+][C@@H](CCCOC)c1ccc(Br)cc1 ZINC000423289950 1096635705 /nfs/dbraw/zinc/63/57/05/1096635705.db2.gz YOZIDZKAUIYVRZ-INIZCTEOSA-N 2 0 357.336 4.024 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(C(F)(F)F)c1 ZINC000423290087 1096636007 /nfs/dbraw/zinc/63/60/07/1096636007.db2.gz CIMPJJZPXHLTTE-SCLBCKFNSA-N 2 0 352.400 4.202 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(C(F)(F)F)c1 ZINC000423290088 1096636164 /nfs/dbraw/zinc/63/61/64/1096636164.db2.gz CIMPJJZPXHLTTE-UGSOOPFHSA-N 2 0 352.400 4.202 20 0 FIADRP Cc1c([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cnn1-c1ccc(F)cc1 ZINC000423290908 1096636267 /nfs/dbraw/zinc/63/62/67/1096636267.db2.gz FWUIXTDDFFDNML-GJZGRUSLSA-N 2 0 352.457 4.190 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH3+])c1ccc(Br)cc1C(F)(F)F ZINC000423328650 1096648548 /nfs/dbraw/zinc/64/85/48/1096648548.db2.gz OAXIJNQZTPXSRS-ZDUSSCGKSA-N 2 0 353.226 4.248 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423359227 1096656228 /nfs/dbraw/zinc/65/62/28/1096656228.db2.gz URWVPXAZXNVRFL-KHUIQGCPSA-N 2 0 361.533 4.431 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423368993 1096658353 /nfs/dbraw/zinc/65/83/53/1096658353.db2.gz DQGPXNIFRILGFK-XMMPIXPASA-N 2 0 358.485 4.372 20 0 FIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1F ZINC000423386029 1096662909 /nfs/dbraw/zinc/66/29/09/1096662909.db2.gz LSRDQJRMTXYYDA-TZIWHRDSSA-N 2 0 354.469 4.254 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[NH2+][C@H](C)C2)nc1 ZINC000423390043 1096663572 /nfs/dbraw/zinc/66/35/72/1096663572.db2.gz VOVXMVFZKGMVGQ-XGRCMKMKSA-N 2 0 371.956 4.181 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)nc1 ZINC000423390037 1096663971 /nfs/dbraw/zinc/66/39/71/1096663971.db2.gz VOVXMVFZKGMVGQ-HVETUWLQSA-N 2 0 371.956 4.181 20 0 FIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000423421313 1096669458 /nfs/dbraw/zinc/66/94/58/1096669458.db2.gz KBFYPKLGGLQYBB-FIKGOQFSSA-N 2 0 357.929 4.374 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423407433 1096673535 /nfs/dbraw/zinc/67/35/35/1096673535.db2.gz VVMKIARZVPCOHZ-BFVZDQMLSA-N 2 0 354.338 4.373 20 0 FIADRP Brc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407250 1096673824 /nfs/dbraw/zinc/67/38/24/1096673824.db2.gz ZPDFVJUXPFDNNG-IBGZPJMESA-N 2 0 357.295 4.220 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423448985 1096680397 /nfs/dbraw/zinc/68/03/97/1096680397.db2.gz VRJKFEZZAJORTO-ZOCIIQOWSA-N 2 0 355.551 4.081 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(Br)cc1C(F)(F)F ZINC000423457359 1096688063 /nfs/dbraw/zinc/68/80/63/1096688063.db2.gz OWBRHMQTFWOJKF-VHSXEESVSA-N 2 0 353.226 4.246 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(-c2ccccc2)s1 ZINC000423506958 1096701043 /nfs/dbraw/zinc/70/10/43/1096701043.db2.gz JAXNYYRRKAVNIH-QHGAOEGBSA-N 2 0 369.578 4.282 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000423508625 1096702004 /nfs/dbraw/zinc/70/20/04/1096702004.db2.gz NUKXLGXCINBGPS-NIKGAXFTSA-N 2 0 359.311 4.256 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)ccc1OC(F)F ZINC000423494502 1096706957 /nfs/dbraw/zinc/70/69/57/1096706957.db2.gz AQPSULWBBGORBA-PBHICJAKSA-N 2 0 364.436 4.427 20 0 FIADRP [NH3+]C1(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)C2CC3CC(C2)CC1C3 ZINC000423530376 1096708971 /nfs/dbraw/zinc/70/89/71/1096708971.db2.gz RHIRQZLREOUVQO-OQVIFBIZSA-N 2 0 372.528 4.037 20 0 FIADRP FC(F)(F)Oc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C2CC2)c1 ZINC000423544595 1096717457 /nfs/dbraw/zinc/71/74/57/1096717457.db2.gz OMWJSYJSADJAHU-BVIKNXMNSA-N 2 0 354.416 4.014 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc(OCc2ccccc2)c1 ZINC000423553910 1096720256 /nfs/dbraw/zinc/72/02/56/1096720256.db2.gz WHWOEYSCHZMHMR-AGOPTVSRSA-N 2 0 350.506 4.304 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423554487 1096720454 /nfs/dbraw/zinc/72/04/54/1096720454.db2.gz WOUXFVAWUMFGAE-LCGIIJARSA-N 2 0 359.514 4.296 20 0 FIADRP CCC1(C[NH2+]Cc2cnn(C(C)C)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000533148881 1098821038 /nfs/dbraw/zinc/82/10/38/1098821038.db2.gz NTZQWWHPOQAYRT-UHFFFAOYSA-N 2 0 354.542 4.246 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000436238002 1098844889 /nfs/dbraw/zinc/84/48/89/1098844889.db2.gz IDSJVFBCWPMXAE-XZOQPEGZSA-N 2 0 364.533 4.069 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cn1 ZINC000436278047 1098880968 /nfs/dbraw/zinc/88/09/68/1098880968.db2.gz AOKFCSXACPEDKK-UHFFFAOYSA-N 2 0 361.489 4.109 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@@H](C)C1 ZINC000436302387 1098916139 /nfs/dbraw/zinc/91/61/39/1098916139.db2.gz UEADMBQOXNCXAC-GIUOSPMZSA-N 2 0 364.961 4.313 20 0 FIADRP C[C@@H](CCc1n[nH]c2ccccc21)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436307817 1098930082 /nfs/dbraw/zinc/93/00/82/1098930082.db2.gz LOZDPJSMPYVGAT-PKOBYXMFSA-N 2 0 354.542 4.271 20 0 FIADRP C[C@@H](CCc1n[nH]c2ccccc21)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436307814 1098930287 /nfs/dbraw/zinc/93/02/87/1098930287.db2.gz LOZDPJSMPYVGAT-HKUYNNGSSA-N 2 0 354.542 4.271 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H]2COCc3ccccc32)ccc1OC ZINC000841762548 1098959165 /nfs/dbraw/zinc/95/91/65/1098959165.db2.gz XIUDIHMJAVEQBQ-JTSKRJEESA-N 2 0 368.521 4.459 20 0 FIADRP CC[NH+](CC)Cc1ccccc1-n1cc(N)c(=[NH2+])c(-c2cccc(F)c2)c1 ZINC001211991903 1099063429 /nfs/dbraw/zinc/06/34/29/1099063429.db2.gz TZZKCIAMOQSTOL-UHFFFAOYSA-N 2 0 364.468 4.187 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1C ZINC000533447234 1099071701 /nfs/dbraw/zinc/07/17/01/1099071701.db2.gz PKNCLIJZTXZWHN-KGLIPLIRSA-N 2 0 372.340 4.127 20 0 FIADRP c1ccc(-c2ncc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)cn2)cc1 ZINC000533558028 1099167849 /nfs/dbraw/zinc/16/78/49/1099167849.db2.gz YVBQJOVYQYURSM-UHFFFAOYSA-N 2 0 364.537 4.232 20 0 FIADRP COc1ccc(NC(=[NH2+])NCC2CC[NH+](CCC(C)C)CC2)cc1Cl ZINC000079918203 1099204475 /nfs/dbraw/zinc/20/44/75/1099204475.db2.gz CVZLBCVXIDTBKT-UHFFFAOYSA-N 2 0 366.937 4.043 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1OC ZINC000459388290 1099360705 /nfs/dbraw/zinc/36/07/05/1099360705.db2.gz KPBGCXXGDSDBAI-QGZVFWFLSA-N 2 0 369.509 4.199 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000467352573 1099538793 /nfs/dbraw/zinc/53/87/93/1099538793.db2.gz HXTGFDOOBFGJSW-OAQYLSRUSA-N 2 0 356.485 4.453 20 0 FIADRP CC(C)N(C)c1ccccc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437096500 1099598657 /nfs/dbraw/zinc/59/86/57/1099598657.db2.gz MKHZMAQXAJYWDP-IBGZPJMESA-N 2 0 369.553 4.322 20 0 FIADRP CCCC[NH+]1CCC([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000164478479 1099701849 /nfs/dbraw/zinc/70/18/49/1099701849.db2.gz INKCRZOPAVBQQI-UHFFFAOYSA-N 2 0 363.977 4.159 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CC[C@@](O)(C(F)(F)F)C2)CC1 ZINC000648592478 1099749531 /nfs/dbraw/zinc/74/95/31/1099749531.db2.gz GXKMFGQLEXZVBS-YJBOKZPZSA-N 2 0 364.496 4.101 20 0 FIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000162520732 1099814250 /nfs/dbraw/zinc/81/42/50/1099814250.db2.gz QLPAFCMDQCNWAY-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC000508693242 1099827222 /nfs/dbraw/zinc/82/72/22/1099827222.db2.gz CPNJAKCBBLYOLJ-PKOBYXMFSA-N 2 0 357.567 4.309 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000508695416 1099827479 /nfs/dbraw/zinc/82/74/79/1099827479.db2.gz FKIRDUFWWYDLQR-XHYAQGIWSA-N 2 0 350.506 4.051 20 0 FIADRP CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000508702558 1099856439 /nfs/dbraw/zinc/85/64/39/1099856439.db2.gz ZKXCZHZWMQHWIP-MSYGRNIXSA-N 2 0 358.570 4.470 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)ccc1SC ZINC000162578237 1099889188 /nfs/dbraw/zinc/88/91/88/1099889188.db2.gz JFEAMMIFDVSUKT-MRXNPFEDSA-N 2 0 374.550 4.208 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709834 1099898778 /nfs/dbraw/zinc/89/87/78/1099898778.db2.gz JWNLOLYUTWNSMH-ZMUKGBGYSA-N 2 0 364.533 4.407 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711700 1099900423 /nfs/dbraw/zinc/90/04/23/1099900423.db2.gz OZVDSXUEROQNBC-JTAQYXEDSA-N 2 0 366.549 4.374 20 0 FIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000162587671 1099902570 /nfs/dbraw/zinc/90/25/70/1099902570.db2.gz PIMSEUDESQUXHM-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000508711703 1099902837 /nfs/dbraw/zinc/90/28/37/1099902837.db2.gz OZVDSXUEROQNBC-MIZPHKNDSA-N 2 0 366.549 4.374 20 0 FIADRP C[C@H]([NH2+]CCc1nc2c(s1)CCCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508711775 1099903915 /nfs/dbraw/zinc/90/39/15/1099903915.db2.gz PDVKWNNWWQQBIQ-PKOBYXMFSA-N 2 0 369.578 4.065 20 0 FIADRP C[C@@H]([NH2+]CCCCOc1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721368 1099937719 /nfs/dbraw/zinc/93/77/19/1099937719.db2.gz PGLIQDTZLOHXOY-CTNGQTDRSA-N 2 0 370.512 4.485 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722902 1099943116 /nfs/dbraw/zinc/94/31/16/1099943116.db2.gz YQTRHQVGUUTNIR-TZIWHRDSSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459401815 1100107519 /nfs/dbraw/zinc/10/75/19/1100107519.db2.gz YGHHOGIMOFJLIP-OAHLLOKOSA-N 2 0 363.427 4.290 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)C[C@@H]1C ZINC000536659682 1100129504 /nfs/dbraw/zinc/12/95/04/1100129504.db2.gz RLSRDSMMULFLMU-AZUAARDMSA-N 2 0 353.510 4.487 20 0 FIADRP Cc1ccc([C@H]2OCCC[C@@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459431900 1100169674 /nfs/dbraw/zinc/16/96/74/1100169674.db2.gz ZBZYIUHDSAPVQQ-NFBKMPQASA-N 2 0 365.521 4.116 20 0 FIADRP CCO[C@@H]1C[C@H]([NH2+]C2CCC(C[NH+](C)C)CC2)[C@H]1Sc1ccccc1 ZINC000459454485 1100194869 /nfs/dbraw/zinc/19/48/69/1100194869.db2.gz UERUTKRWCISZLQ-JEJBDDBXSA-N 2 0 362.583 4.035 20 0 FIADRP Fc1cccc([C@@H]([NH2+]Cc2cc(C3CC[NH2+]CC3)no2)C2CCCC2)c1 ZINC000425898983 1100198872 /nfs/dbraw/zinc/19/88/72/1100198872.db2.gz KCSBOEQEIMHPNS-NRFANRHFSA-N 2 0 357.473 4.302 20 0 FIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459466353 1100210806 /nfs/dbraw/zinc/21/08/06/1100210806.db2.gz PBYZZQOVALQYJN-HNNXBMFYSA-N 2 0 363.427 4.290 20 0 FIADRP Fc1ccc(C2=CC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)CC2)cc1 ZINC000459469032 1100214615 /nfs/dbraw/zinc/21/46/15/1100214615.db2.gz UGCKLSOXEUDLEN-FQEVSTJZSA-N 2 0 351.469 4.415 20 0 FIADRP C[C@H](CC[NH2+]C1CCN(c2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000379620520 1100219297 /nfs/dbraw/zinc/21/92/97/1100219297.db2.gz DCOCTEXWLPNEOS-HXUWFJFHSA-N 2 0 351.538 4.156 20 0 FIADRP C[C@@H](C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1)C[NH+]1CCCC1 ZINC000425913813 1100239665 /nfs/dbraw/zinc/23/96/65/1100239665.db2.gz GFTQQPWQDUOWGO-UWJYYQICSA-N 2 0 357.929 4.340 20 0 FIADRP C[C@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000459502216 1100241353 /nfs/dbraw/zinc/24/13/53/1100241353.db2.gz DVBZJPLJDJAQEK-OAHLLOKOSA-N 2 0 363.427 4.463 20 0 FIADRP Cc1nccn1CC[NH2+][C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000425921551 1100256964 /nfs/dbraw/zinc/25/69/64/1100256964.db2.gz QYNUPJSMLRWFOF-QGZVFWFLSA-N 2 0 366.278 4.224 20 0 FIADRP Fc1ccc(-c2ccc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)o2)cc1 ZINC000536755339 1100280343 /nfs/dbraw/zinc/28/03/43/1100280343.db2.gz ICMUUADHHYXOTN-UHFFFAOYSA-N 2 0 365.452 4.487 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cnccc2C)CC1 ZINC000536775405 1100297260 /nfs/dbraw/zinc/29/72/60/1100297260.db2.gz IJSRHGRYZFTWJE-MSOLQXFVSA-N 2 0 370.516 4.083 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000536853229 1100356286 /nfs/dbraw/zinc/35/62/86/1100356286.db2.gz QVFMRDNKOVNWMD-DQLDELGASA-N 2 0 362.583 4.216 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000425939191 1100361766 /nfs/dbraw/zinc/36/17/66/1100361766.db2.gz ZDZXFOUBSIDOLJ-GHTZIAJQSA-N 2 0 357.929 4.340 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cs1 ZINC000438104560 1100430608 /nfs/dbraw/zinc/43/06/08/1100430608.db2.gz NGMOITFEQNQPDX-UHFFFAOYSA-N 2 0 358.555 4.226 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]CC3=Cc4ccccc4OC3)cc2)CC1 ZINC000517538136 1100458997 /nfs/dbraw/zinc/45/89/97/1100458997.db2.gz LYRXCQZJBZZVBD-UHFFFAOYSA-N 2 0 362.517 4.484 20 0 FIADRP CCOc1cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc(Cl)c1O ZINC000506330137 1100871859 /nfs/dbraw/zinc/87/18/59/1100871859.db2.gz IBDNEUSUOFCXON-UHFFFAOYSA-N 2 0 374.912 4.330 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000414951629 1100911503 /nfs/dbraw/zinc/91/15/03/1100911503.db2.gz HUVQUJOUDSRMQE-DNVCBOLYSA-N 2 0 374.912 4.015 20 0 FIADRP Oc1cccc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC000518300839 1101076185 /nfs/dbraw/zinc/07/61/85/1101076185.db2.gz INDCUDZRHDFYNX-UHFFFAOYSA-N 2 0 352.522 4.217 20 0 FIADRP Cn1ccnc1CC1CC[NH+](CCOc2cccc(C(C)(C)C)c2)CC1 ZINC000506464457 1101084717 /nfs/dbraw/zinc/08/47/17/1101084717.db2.gz WKIOFSLUTRVPPA-UHFFFAOYSA-N 2 0 355.526 4.051 20 0 FIADRP CC1(C)Cc2c(cccc2Br)[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000426331140 1101292448 /nfs/dbraw/zinc/29/24/48/1101292448.db2.gz NHACVWOOGJIICH-GLJUWKHASA-N 2 0 363.343 4.289 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+]C2(Cc3ccccc3Br)CC2)CC1 ZINC000426341000 1101314946 /nfs/dbraw/zinc/31/49/46/1101314946.db2.gz XWWNARCCZYPFRD-UHFFFAOYSA-N 2 0 365.359 4.377 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3nc(-c4ccccc4)c[nH]3)CC2)c1 ZINC000194274379 1101317518 /nfs/dbraw/zinc/31/75/18/1101317518.db2.gz PWMVFXAXOZJBKT-UHFFFAOYSA-N 2 0 366.534 4.140 20 0 FIADRP COc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c(-c2ccccc2)cc1OC ZINC000459729285 1101347253 /nfs/dbraw/zinc/34/72/53/1101347253.db2.gz IXWZJJJTZLWOCA-SFHVURJKSA-N 2 0 368.521 4.192 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1O ZINC000426360957 1101363751 /nfs/dbraw/zinc/36/37/51/1101363751.db2.gz LHVBOQRODXLREG-KMFTYDHNSA-N 2 0 374.569 4.355 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013767 1101393193 /nfs/dbraw/zinc/39/31/93/1101393193.db2.gz QODUNEOYGMFSCH-ZRBLBEILSA-N 2 0 374.544 4.415 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013845 1101394063 /nfs/dbraw/zinc/39/40/63/1101394063.db2.gz SKVHNSHPAWIEIK-YPAWHYETSA-N 2 0 360.517 4.024 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000467384572 1101399201 /nfs/dbraw/zinc/39/92/01/1101399201.db2.gz WYZGDXHKBMZLPU-JOCHJYFZSA-N 2 0 368.496 4.323 20 0 FIADRP CCO[C@@H]1C[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C12CCCCC2 ZINC000537294005 1101613705 /nfs/dbraw/zinc/61/37/05/1101613705.db2.gz PZTRJNABXWTFRV-NHCUHLMSSA-N 2 0 357.542 4.016 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[N@@H+]1C ZINC000537310078 1101631151 /nfs/dbraw/zinc/63/11/51/1101631151.db2.gz CYCANGWTQJOFAC-AEFFLSMTSA-N 2 0 366.534 4.173 20 0 FIADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000519189555 1101996913 /nfs/dbraw/zinc/99/69/13/1101996913.db2.gz DJYYZIVJQXDJFF-PUHATCMVSA-N 2 0 370.581 4.474 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](C)CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168284120 1102055470 /nfs/dbraw/zinc/05/54/70/1102055470.db2.gz RPDKLDNXMBGCLX-QHCPKHFHSA-N 2 0 364.533 4.006 20 0 FIADRP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001168183355 1102087635 /nfs/dbraw/zinc/08/76/35/1102087635.db2.gz PRBVIPKZWMSDIA-QFBILLFUSA-N 2 0 364.961 4.283 20 0 FIADRP C[N@@H+](Cc1ccccc1)C[C@@H](C[NH+]1CC[C@@]2(CCOC2)C1)c1ccccc1 ZINC001168184409 1102106349 /nfs/dbraw/zinc/10/63/49/1102106349.db2.gz PIAJMEMUOIXWFE-BJKOFHAPSA-N 2 0 364.533 4.015 20 0 FIADRP CCC[NH+](CCC)CCN1CC[NH+]([C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168188750 1102193072 /nfs/dbraw/zinc/19/30/72/1102193072.db2.gz OHPLSCLYACUERN-LJQANCHMSA-N 2 0 365.993 4.011 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000467399099 1102230018 /nfs/dbraw/zinc/23/00/18/1102230018.db2.gz CYLUZKLHCNGIGD-LPHOPBHVSA-N 2 0 372.475 4.240 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccc(F)cc2)CC1 ZINC000462819258 1102242879 /nfs/dbraw/zinc/24/28/79/1102242879.db2.gz RTYYLRADUQCTFL-MBDNFAEBSA-N 2 0 360.517 4.288 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)ccc1Oc1cccnc1 ZINC000415075524 1102291771 /nfs/dbraw/zinc/29/17/71/1102291771.db2.gz BQFBVJOJCGPGAE-YSIASYRMSA-N 2 0 355.457 4.023 20 0 FIADRP CN(Cc1cnc(C(C)(C)C)s1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000537632828 1102328124 /nfs/dbraw/zinc/32/81/24/1102328124.db2.gz UKJHUOIBCMLWKH-GOSISDBHSA-N 2 0 357.567 4.395 20 0 FIADRP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cn2)c1 ZINC000415107309 1102354617 /nfs/dbraw/zinc/35/46/17/1102354617.db2.gz NQPGKINCARXWDM-SLFFLAALSA-N 2 0 355.457 4.023 20 0 FIADRP Fc1ccccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CCOCC1 ZINC001167969382 1102369984 /nfs/dbraw/zinc/36/99/84/1102369984.db2.gz BOOWSMOQPBFLOB-CRHVVPOVSA-N 2 0 372.528 4.288 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1cccc(Br)c1 ZINC000532488676 1102429473 /nfs/dbraw/zinc/42/94/73/1102429473.db2.gz XOWCKHHFOQVKMX-KEYYUXOJSA-N 2 0 353.348 4.045 20 0 FIADRP Fc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CCOCC2)c1 ZINC001167971241 1102440115 /nfs/dbraw/zinc/44/01/15/1102440115.db2.gz UQKAFVBGCSZKRS-WVUPVLJSSA-N 2 0 372.528 4.288 20 0 FIADRP FC(F)(F)c1ccccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167971232 1102440522 /nfs/dbraw/zinc/44/05/22/1102440522.db2.gz UFJGGYALHLOBDC-AYHJJNSGSA-N 2 0 352.444 4.243 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Br)cc3Cl)CC2)CC[N@@H+]1C ZINC000550882924 1102653702 /nfs/dbraw/zinc/65/37/02/1102653702.db2.gz RTCGIYPVRHRIOI-GXTWGEPZSA-N 2 0 371.750 4.206 20 0 FIADRP C[C@@H]1C[C@H]([N@@H+]2CC(C)(C)[C@H]2C2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000664835003 1102654969 /nfs/dbraw/zinc/65/49/69/1102654969.db2.gz BSRMMHKOZBMHCS-STZQEDGTSA-N 2 0 356.554 4.177 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cn2ccccc2n1 ZINC000550886245 1102658029 /nfs/dbraw/zinc/65/80/29/1102658029.db2.gz NOKFQIKJNQAKAT-RBUKOAKNSA-N 2 0 362.521 4.417 20 0 FIADRP C[C@H](O)CCC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000550897446 1102672927 /nfs/dbraw/zinc/67/29/27/1102672927.db2.gz DNXCSHNLVGSMPV-GHTZIAJQSA-N 2 0 350.522 4.130 20 0 FIADRP C[C@H](c1cnccn1)[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837035 1102697151 /nfs/dbraw/zinc/69/71/51/1102697151.db2.gz YYANQLCFTMVPCB-GCJKJVERSA-N 2 0 364.537 4.160 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000280782126 1102717878 /nfs/dbraw/zinc/71/78/78/1102717878.db2.gz GWBFJZFPQXERNO-QFIPXVFZSA-N 2 0 353.510 4.043 20 0 FIADRP FC(F)Oc1ccccc1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000188722090 1102746370 /nfs/dbraw/zinc/74/63/70/1102746370.db2.gz JJYRFZIXVFWAFT-UHFFFAOYSA-N 2 0 352.469 4.217 20 0 FIADRP CCCC(=O)Nc1ccc(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551007037 1102758582 /nfs/dbraw/zinc/75/85/82/1102758582.db2.gz CJCMUSGMYRALRJ-VXKWHMMOSA-N 2 0 365.521 4.350 20 0 FIADRP Cc1cccc2ncc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)n21 ZINC000537659570 1102763126 /nfs/dbraw/zinc/76/31/26/1102763126.db2.gz LMKUGNTVNHGILO-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(NC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459336518 1102846699 /nfs/dbraw/zinc/84/66/99/1102846699.db2.gz BZNBRVYYMLPWAH-UHFFFAOYSA-N 2 0 350.510 4.148 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@H]1CN1CCC(C[NH+](C)Cc2ccccc2)CC1 ZINC000551092534 1102911339 /nfs/dbraw/zinc/91/13/39/1102911339.db2.gz IEXXUYGNSWDLIT-QHCPKHFHSA-N 2 0 357.586 4.093 20 0 FIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000459358598 1102913008 /nfs/dbraw/zinc/91/30/08/1102913008.db2.gz BKTSKKLISONWFQ-VWTGBZJHSA-N 2 0 362.517 4.353 20 0 FIADRP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)o1 ZINC000551221253 1102989629 /nfs/dbraw/zinc/98/96/29/1102989629.db2.gz MGVDBCXKGFWDEU-IERDGZPVSA-N 2 0 354.494 4.166 20 0 FIADRP CCCC(CCC)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265659 1103025566 /nfs/dbraw/zinc/02/55/66/1103025566.db2.gz YCIGFRMVHZYGKI-NRFANRHFSA-N 2 0 358.570 4.474 20 0 FIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000729682733 1103050872 /nfs/dbraw/zinc/05/08/72/1103050872.db2.gz BVWNHARXRVECLM-UHFFFAOYSA-N 2 0 374.960 4.471 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](CO)CC2CCCC2)CC1 ZINC000551302730 1103059638 /nfs/dbraw/zinc/05/96/38/1103059638.db2.gz YBYIGTPJVUZVTH-DDRJZQQSSA-N 2 0 358.570 4.208 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)C1 ZINC000551308030 1103082950 /nfs/dbraw/zinc/08/29/50/1103082950.db2.gz IXAYOYLBMIRMCB-BOMBAVFCSA-N 3 0 371.613 4.387 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CS[C@@H](C(C)(C)C)C3)cc2)CC1 ZINC000551567395 1103369789 /nfs/dbraw/zinc/36/97/89/1103369789.db2.gz SLRNMADZZDIFEG-YLJYHZDGSA-N 2 0 362.583 4.169 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)[C@H]1COc2ccccc21 ZINC000507485311 1103433694 /nfs/dbraw/zinc/43/36/94/1103433694.db2.gz LKOTXXATFBUPDU-CPWLSYGHSA-N 2 0 362.517 4.051 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]CC2(c3ccc(Cl)cc3)CC2)CC1 ZINC000507509293 1103451621 /nfs/dbraw/zinc/45/16/21/1103451621.db2.gz KZGGENMMHKWDED-UHFFFAOYSA-N 2 0 360.851 4.378 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000551749671 1103604008 /nfs/dbraw/zinc/60/40/08/1103604008.db2.gz GCTPSFDARJORMT-INIZCTEOSA-N 2 0 365.949 4.028 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000537767464 1103925595 /nfs/dbraw/zinc/92/55/95/1103925595.db2.gz LLGKFQUJRQDHST-GOSISDBHSA-N 2 0 351.332 4.291 20 0 FIADRP c1ccc(OCCCCC[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000188217191 1104074384 /nfs/dbraw/zinc/07/43/84/1104074384.db2.gz SMKQEPSEABLUQZ-UHFFFAOYSA-N 2 0 353.510 4.137 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000520203314 1104171348 /nfs/dbraw/zinc/17/13/48/1104171348.db2.gz XCSBFXJNZTXZOZ-QZTJIDSGSA-N 2 0 362.521 4.331 20 0 FIADRP COC(=O)c1oc([C@@H](C)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1C ZINC000441319378 1104274810 /nfs/dbraw/zinc/27/48/10/1104274810.db2.gz UUMNAZTZAJNGGW-MSOLQXFVSA-N 2 0 362.514 4.024 20 0 FIADRP CCOc1ccccc1OCCN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000441386497 1104322685 /nfs/dbraw/zinc/32/26/85/1104322685.db2.gz FGROTJJZRJWSMW-UXHICEINSA-N 2 0 360.542 4.051 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc4ccccc4c3)cn2)CC1 ZINC000112529235 1104375156 /nfs/dbraw/zinc/37/51/56/1104375156.db2.gz FYKQARLWNMTWBP-LJQANCHMSA-N 2 0 374.532 4.228 20 0 FIADRP Clc1ccc(-c2cnc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)o2)cc1 ZINC000647976682 1104484343 /nfs/dbraw/zinc/48/43/43/1104484343.db2.gz RZXJLUBFSBBHOK-IRXDYDNUSA-N 2 0 359.901 4.207 20 0 FIADRP Fc1ccc(C[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995145 1104486092 /nfs/dbraw/zinc/48/60/92/1104486092.db2.gz XSKBWDRWZOAJHQ-ATNRPFFGSA-N 2 0 356.529 4.486 20 0 FIADRP Fc1ccccc1COC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167995636 1104531451 /nfs/dbraw/zinc/53/14/51/1104531451.db2.gz MBWITNPBBFVXFY-WCRBZPEASA-N 2 0 372.528 4.212 20 0 FIADRP COc1ccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1OC ZINC001167995874 1104574551 /nfs/dbraw/zinc/57/45/51/1104574551.db2.gz UASFGZVAZCTOSG-JGUMPVPUSA-N 2 0 370.537 4.246 20 0 FIADRP FC(F)(F)c1cccc(OCCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000441438405 1104704016 /nfs/dbraw/zinc/70/40/16/1104704016.db2.gz MBHUEFICDALGSI-QGZVFWFLSA-N 2 0 370.459 4.282 20 0 FIADRP COC(=O)c1ccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168001668 1104935880 /nfs/dbraw/zinc/93/58/80/1104935880.db2.gz FXPGPBMVLMMDKH-PJEZACDQSA-N 2 0 368.521 4.016 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000190591961 1104944190 /nfs/dbraw/zinc/94/41/90/1104944190.db2.gz COAPLIBVVAIELN-BLLLJJGKSA-N 2 0 357.361 4.283 20 0 FIADRP Cc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc(C)c1OCc1ccccn1 ZINC000237186018 1104979867 /nfs/dbraw/zinc/97/98/67/1104979867.db2.gz DVYQCSDJTPJQBM-IFMALSPDSA-N 2 0 367.537 4.240 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ncc(Br)cc1F ZINC000427604218 1105044916 /nfs/dbraw/zinc/04/49/16/1105044916.db2.gz OEVCOYGXUQZREK-KBPBESRZSA-N 2 0 372.326 4.288 20 0 FIADRP C[N@H+](CCOc1cccc(Cl)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000441629604 1105047804 /nfs/dbraw/zinc/04/78/04/1105047804.db2.gz XFWRRQOHGGAHNO-IBGZPJMESA-N 2 0 358.913 4.173 20 0 FIADRP c1cn(-c2ccccc2-c2noc([C@@H]3[NH2+]CCC[C@H]3c3ccccc3)n2)cn1 ZINC001211870869 1105051674 /nfs/dbraw/zinc/05/16/74/1105051674.db2.gz XMEQRGYTBGHMDJ-FXAWDEMLSA-N 2 0 371.444 4.131 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000152375816 1105062893 /nfs/dbraw/zinc/06/28/93/1105062893.db2.gz PYOHKYIQFNZOEA-ZIAGYGMSSA-N 2 0 358.473 4.476 20 0 FIADRP C[C@@H]1CC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C[C@@H](C)O1 ZINC000579545943 1105075904 /nfs/dbraw/zinc/07/59/04/1105075904.db2.gz KJYMRRHKUYUDRM-HMKPXIOTSA-N 2 0 356.554 4.223 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152415390 1105104903 /nfs/dbraw/zinc/10/49/03/1105104903.db2.gz UUNSJICMJIERPT-BLLLJJGKSA-N 2 0 355.309 4.281 20 0 FIADRP Cc1cccnc1CCC[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006570 1105112409 /nfs/dbraw/zinc/11/24/09/1105112409.db2.gz NQEQHMNVJHTFME-VTYHHJSWSA-N 2 0 351.538 4.354 20 0 FIADRP CCN(C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1)[C@@H]1CC[N@H+](C)C1 ZINC000665193459 1105197844 /nfs/dbraw/zinc/19/78/44/1105197844.db2.gz YIVJENNLQJZCLH-HXUWFJFHSA-N 2 0 372.557 4.009 20 0 FIADRP C[C@@H]1CC([NH2+]CCOCc2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168010064 1105231734 /nfs/dbraw/zinc/23/17/34/1105231734.db2.gz IZZJFTKMKVWJGB-WOJBJXKFSA-N 2 0 352.522 4.234 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427670396 1105238170 /nfs/dbraw/zinc/23/81/70/1105238170.db2.gz DXOWZCVLJYMPSN-CRAIPNDOSA-N 2 0 369.475 4.435 20 0 FIADRP Cn1nccc1-c1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000508189228 1105346981 /nfs/dbraw/zinc/34/69/81/1105346981.db2.gz COJNAEFJFSOEGX-HXUWFJFHSA-N 2 0 366.553 4.175 20 0 FIADRP CCOC(CCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)OCC ZINC001168011613 1105373433 /nfs/dbraw/zinc/37/34/33/1105373433.db2.gz QEIGLZWDYRPSGM-CEQLMSFQSA-N 2 0 362.558 4.197 20 0 FIADRP CCOC(CCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)OCC ZINC001168011614 1105376838 /nfs/dbraw/zinc/37/68/38/1105376838.db2.gz QEIGLZWDYRPSGM-OALUTQOASA-N 2 0 362.558 4.197 20 0 FIADRP CCOC(=O)[C@H]1CCCC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168064979 1106885453 /nfs/dbraw/zinc/88/54/53/1106885453.db2.gz TWJZFLFPKJVHDT-MXNKGDRCSA-N 2 0 372.553 4.093 20 0 FIADRP Brc1csc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192931618 1106905838 /nfs/dbraw/zinc/90/58/38/1106905838.db2.gz PLQAVYFXFSVDQH-OAHLLOKOSA-N 2 0 365.340 4.122 20 0 FIADRP C[NH+](C)C[C@H](N[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000530227497 1106916511 /nfs/dbraw/zinc/91/65/11/1106916511.db2.gz YIIOKMROTDVRQC-QRVBRYPASA-N 2 0 364.320 4.331 20 0 FIADRP Fc1ccc2c(c1)[nH+]ccc2N1CCC([NH2+]CCOc2ccccc2)CC1 ZINC000301517934 1107055414 /nfs/dbraw/zinc/05/54/14/1107055414.db2.gz DGLSHERDTKVTLI-UHFFFAOYSA-N 2 0 365.452 4.011 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000475577524 1107788781 /nfs/dbraw/zinc/78/87/81/1107788781.db2.gz ZBEIYJCPGCQEJR-XLIONFOSSA-N 2 0 350.441 4.141 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1OCc1ccccc1 ZINC000531389921 1107841499 /nfs/dbraw/zinc/84/14/99/1107841499.db2.gz XTHAOBUTPZRSHP-NHCUHLMSSA-N 2 0 368.521 4.237 20 0 FIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(Br)c3ccccc23)CC1 ZINC001142054303 1107851391 /nfs/dbraw/zinc/85/13/91/1107851391.db2.gz UPVYEKGUQLCYIT-UHFFFAOYSA-N 2 0 361.327 4.376 20 0 FIADRP CN(c1ccccc1C[NH2+]CC1(c2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000531528660 1107951867 /nfs/dbraw/zinc/95/18/67/1107951867.db2.gz DZAPJHIYIAUZGI-UHFFFAOYSA-N 2 0 363.549 4.038 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1C ZINC000531710492 1108089087 /nfs/dbraw/zinc/08/90/87/1108089087.db2.gz SHZNBABAHPUCFR-XUZZJYLKSA-N 2 0 365.565 4.251 20 0 FIADRP Cc1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)cs1 ZINC000453071150 1108121717 /nfs/dbraw/zinc/12/17/17/1108121717.db2.gz CVARKYKNBJJPMX-NJYVYQBISA-N 2 0 355.551 4.027 20 0 FIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](CC)CC1)c1ccncc1 ZINC000453102855 1108171476 /nfs/dbraw/zinc/17/14/76/1108171476.db2.gz QNQCGWBGSHIAGL-UTKZUKDTSA-N 2 0 370.516 4.165 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cnc3ccccc3c2)CC1 ZINC000531784809 1108176115 /nfs/dbraw/zinc/17/61/15/1108176115.db2.gz QGCBCMVEXLTVGJ-UHFFFAOYSA-N 2 0 374.532 4.057 20 0 FIADRP c1csc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)n1 ZINC000453144440 1108194676 /nfs/dbraw/zinc/19/46/76/1108194676.db2.gz MNIXZEQBXUHGPH-AABGKKOBSA-N 2 0 355.551 4.109 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(-c2ccccc2)nn1C ZINC000453208582 1108277613 /nfs/dbraw/zinc/27/76/13/1108277613.db2.gz CHGGIICGGLSGCJ-CTNGQTDRSA-N 2 0 374.532 4.260 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000453214356 1108284343 /nfs/dbraw/zinc/28/43/43/1108284343.db2.gz QYWPZDHNLHKCOT-LJQANCHMSA-N 2 0 367.537 4.056 20 0 FIADRP Cc1ccc(C2(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@@H]3C)CC2)c(C)c1 ZINC000453238696 1108316104 /nfs/dbraw/zinc/31/61/04/1108316104.db2.gz AGCHDRNOALSXDQ-REWPJTCUSA-N 2 0 363.549 4.230 20 0 FIADRP CC[C@H](COCC(F)(F)F)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000453249750 1108323815 /nfs/dbraw/zinc/32/38/15/1108323815.db2.gz DDADPVVIIXNTAG-LMDPOFIKSA-N 2 0 372.475 4.377 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000531944050 1108388205 /nfs/dbraw/zinc/38/82/05/1108388205.db2.gz VOMRXFFPPBIJQW-SFHVURJKSA-N 2 0 374.573 4.331 20 0 FIADRP Cc1noc(C2CCC([NH2+]CC3(N(C)Cc4ccccc4)CCC3)CC2)n1 ZINC000453303692 1108389478 /nfs/dbraw/zinc/38/94/78/1108389478.db2.gz NPECHZLLJKEPKJ-UHFFFAOYSA-N 2 0 368.525 4.049 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc2c(c1)OCCO2 ZINC000531945644 1108389594 /nfs/dbraw/zinc/38/95/94/1108389594.db2.gz MTTZWOGDRRUJPU-SFHVURJKSA-N 2 0 366.505 4.295 20 0 FIADRP CCc1ccc([C@H](C)[NH2+]C[C@@H](c2cccs2)N2CCN(C)CC2)s1 ZINC000531932426 1108402527 /nfs/dbraw/zinc/40/25/27/1108402527.db2.gz GSLYYZYKURPXML-RDJZCZTQSA-N 2 0 363.596 4.011 20 0 FIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2cccnc21 ZINC000531941918 1108420310 /nfs/dbraw/zinc/42/03/10/1108420310.db2.gz UDABSPUSPICMEQ-WMZHIEFXSA-N 2 0 359.517 4.278 20 0 FIADRP C[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc2ccccc21 ZINC000531965232 1108461373 /nfs/dbraw/zinc/46/13/73/1108461373.db2.gz ASLPAPCLUWEXFR-NLFFAJNJSA-N 2 0 373.544 4.479 20 0 FIADRP C[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc2ccccc21 ZINC000531965231 1108461662 /nfs/dbraw/zinc/46/16/62/1108461662.db2.gz ASLPAPCLUWEXFR-NBGIEHNGSA-N 2 0 373.544 4.479 20 0 FIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000531971168 1108480355 /nfs/dbraw/zinc/48/03/55/1108480355.db2.gz BOLJYRRHCXNJMN-GAJHUEQPSA-N 2 0 368.496 4.323 20 0 FIADRP CC(C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1(O)CCCC1 ZINC000453376410 1108495748 /nfs/dbraw/zinc/49/57/48/1108495748.db2.gz IFGHOKAOXNUKIL-WKCHPHFGSA-N 2 0 356.554 4.103 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2ccc(F)c3Br)CC1 ZINC000453378007 1108498454 /nfs/dbraw/zinc/49/84/54/1108498454.db2.gz YJQUADCMJHXJFQ-ZEPSKSRBSA-N 2 0 355.295 4.038 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCCOc2c(Br)cccc21)C1CC1 ZINC000453399848 1108502752 /nfs/dbraw/zinc/50/27/52/1108502752.db2.gz LSONMFYMCOMEDQ-KRWDZBQOSA-N 2 0 367.331 4.127 20 0 FIADRP C[N@H+](CCCC[NH2+]C1CC(c2cccc(Br)c2)C1)C1CC1 ZINC000453405361 1108506012 /nfs/dbraw/zinc/50/60/12/1108506012.db2.gz QJRJXXJJWWTMGZ-UHFFFAOYSA-N 2 0 351.332 4.159 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000523862376 1108613034 /nfs/dbraw/zinc/61/30/34/1108613034.db2.gz QJYUEXPZSLRERB-KRWDZBQOSA-N 2 0 356.938 4.203 20 0 FIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000532193184 1108701190 /nfs/dbraw/zinc/70/11/90/1108701190.db2.gz POZQRNXCZVCVGI-RTBURBONSA-N 3 0 354.542 4.343 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 ZINC000532200996 1108706648 /nfs/dbraw/zinc/70/66/48/1108706648.db2.gz UILQUCKBGNOSRF-QGZVFWFLSA-N 2 0 365.521 4.264 20 0 FIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)o2)cc1C ZINC000532344234 1108772638 /nfs/dbraw/zinc/77/26/38/1108772638.db2.gz RJKXLYFICWPBSS-GOSISDBHSA-N 2 0 370.541 4.467 20 0 FIADRP CCOc1cc2[nH+]ccc(N3CCC4(CCC[N@@H+]4C)CC3)c2cc1OCC ZINC000445598494 1108911036 /nfs/dbraw/zinc/91/10/36/1108911036.db2.gz BAQACNMVGOERLJ-UHFFFAOYSA-N 2 0 369.509 4.097 20 0 FIADRP FC(F)(F)c1cccc(OCCCC[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000524609608 1109096243 /nfs/dbraw/zinc/09/62/43/1109096243.db2.gz HGBPDISHTXRMLB-QGZVFWFLSA-N 2 0 370.459 4.282 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000525708987 1109488433 /nfs/dbraw/zinc/48/84/33/1109488433.db2.gz APKHJHHBYBCRQT-APWZRJJASA-N 2 0 364.493 4.013 20 0 FIADRP C[C@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1cccc(Cl)c1 ZINC000525875038 1109542320 /nfs/dbraw/zinc/54/23/20/1109542320.db2.gz IVJSEPPIRICUNR-QGZVFWFLSA-N 2 0 350.934 4.020 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c(C)o1 ZINC000447543371 1109573829 /nfs/dbraw/zinc/57/38/29/1109573829.db2.gz RXSGRZYEZGNEMS-BZSNNMDCSA-N 2 0 356.510 4.356 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1OC(F)F ZINC000447570784 1109577032 /nfs/dbraw/zinc/57/70/32/1109577032.db2.gz VORODBBOLPJCSR-LBPRGKRZSA-N 2 0 358.860 4.466 20 0 FIADRP Fc1cc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc(F)c1F ZINC000447591914 1109589500 /nfs/dbraw/zinc/58/95/00/1109589500.db2.gz JIHRUIYEFOTGKG-LDLYASANSA-N 2 0 374.450 4.432 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCSc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000527298596 1109735144 /nfs/dbraw/zinc/73/51/44/1109735144.db2.gz PIMPSLYCXXGGES-FPOVZHCZSA-N 2 0 364.599 4.122 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCSc2ccc(C)c(C)c2)[C@H](C)C1 ZINC000527298598 1109735162 /nfs/dbraw/zinc/73/51/62/1109735162.db2.gz PIMPSLYCXXGGES-TZIWHRDSSA-N 2 0 364.599 4.122 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc4cc[nH]c4c3)cc2)C[C@@H](C)O1 ZINC000527634052 1109790945 /nfs/dbraw/zinc/79/09/45/1109790945.db2.gz JAXTWIHBFBALOM-QZTJIDSGSA-N 2 0 363.505 4.067 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527640620 1109792165 /nfs/dbraw/zinc/79/21/65/1109792165.db2.gz NFRMZBWEYVBEBW-XZOQPEGZSA-N 2 0 357.586 4.110 20 0 FIADRP c1ccc([C@@H]2CCC[C@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)CC2)cc1 ZINC000527662123 1109797155 /nfs/dbraw/zinc/79/71/55/1109797155.db2.gz MVXXFNZMVJASSO-FCEUIQTBSA-N 2 0 356.554 4.193 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)c1 ZINC000527854873 1109839666 /nfs/dbraw/zinc/83/96/66/1109839666.db2.gz WLVMJOWDASDDET-HXUWFJFHSA-N 2 0 362.876 4.197 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000527948465 1109866896 /nfs/dbraw/zinc/86/68/96/1109866896.db2.gz LOSPRMZETFXKHA-HRAATJIYSA-N 2 0 370.541 4.028 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000527971028 1109871378 /nfs/dbraw/zinc/87/13/78/1109871378.db2.gz UNILYUHNZJEKBO-HTAPYJJXSA-N 2 0 353.510 4.214 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000528011604 1109885473 /nfs/dbraw/zinc/88/54/73/1109885473.db2.gz VTFYAFXQLULOAS-SFHVURJKSA-N 2 0 358.357 4.059 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccnc2C)cc1C[NH+]1CCCCC1 ZINC000527984855 1109886805 /nfs/dbraw/zinc/88/68/05/1109886805.db2.gz DUALDDPXSCVGDV-KRWDZBQOSA-N 2 0 353.510 4.235 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(-n3ccnc3)c2)CC1 ZINC000449059563 1109965128 /nfs/dbraw/zinc/96/51/28/1109965128.db2.gz QFVHDKMAOZGRBE-HXUWFJFHSA-N 2 0 374.532 4.058 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC(Nc2ccc(C[NH+](C)C)cc2)CC1 ZINC000449042736 1109966556 /nfs/dbraw/zinc/96/65/56/1109966556.db2.gz UIVWYVZROCLEAB-IBGZPJMESA-N 2 0 351.538 4.256 20 0 FIADRP c1c2cccnc2oc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000449049224 1109967838 /nfs/dbraw/zinc/96/78/38/1109967838.db2.gz RGZIZRMOFDSENN-UNMCSNQZSA-N 2 0 361.489 4.314 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449148529 1109985367 /nfs/dbraw/zinc/98/53/67/1109985367.db2.gz KJCVAKFGOKYGBP-RTWAWAEBSA-N 2 0 362.945 4.102 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)[C@@H](C)O1 ZINC000449153942 1109986407 /nfs/dbraw/zinc/98/64/07/1109986407.db2.gz GNMOJBLVZCLFOX-AFTVQHQSSA-N 2 0 370.459 4.244 20 0 FIADRP COc1cccc2c(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)cccc12 ZINC000449154569 1109986548 /nfs/dbraw/zinc/98/65/48/1109986548.db2.gz NOYIGRGFVYKGCQ-UHFFFAOYSA-N 2 0 352.453 4.339 20 0 FIADRP Cc1nn(C)c(C)c1C[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449170215 1109988105 /nfs/dbraw/zinc/98/81/05/1109988105.db2.gz FQSZCXMAIKTIPZ-MRXNPFEDSA-N 2 0 362.606 4.237 20 0 FIADRP Cc1cn2c(n1)[C@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)CCC2 ZINC000449171743 1109988648 /nfs/dbraw/zinc/98/86/48/1109988648.db2.gz UMFZZHXTBNHBKJ-SFHVURJKSA-N 2 0 360.590 4.338 20 0 FIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)C2)cc1 ZINC000449164149 1109990336 /nfs/dbraw/zinc/99/03/36/1109990336.db2.gz YEADQSMEPRICCS-HGHGUNKESA-N 2 0 362.945 4.067 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000449184201 1109994097 /nfs/dbraw/zinc/99/40/97/1109994097.db2.gz DLBDBQIDDYIDGK-RPWUZVMVSA-N 2 0 364.533 4.129 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@H]2COc3ccccc32)CC1 ZINC000449204385 1109994885 /nfs/dbraw/zinc/99/48/85/1109994885.db2.gz JACAFEWVUXJAFG-SELNLUPBSA-N 2 0 364.533 4.236 20 0 FIADRP CCC1(C[NH2+][C@H]2CCOC3(CCC3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000449208281 1109996087 /nfs/dbraw/zinc/99/60/87/1109996087.db2.gz CZJQTVWTCYDXAJ-NRFANRHFSA-N 2 0 356.554 4.370 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCc2cn3ccccc3n2)CC1 ZINC000449217863 1109999776 /nfs/dbraw/zinc/99/97/76/1109999776.db2.gz CJVJIJWEHATHOQ-UHFFFAOYSA-N 2 0 356.558 4.146 20 0 FIADRP COc1cc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc2ccccc21 ZINC000449254866 1110007590 /nfs/dbraw/zinc/00/75/90/1110007590.db2.gz YZLIDBYQUCLQMV-UHFFFAOYSA-N 2 0 361.489 4.250 20 0 FIADRP Clc1cc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)s1 ZINC000449245852 1110011503 /nfs/dbraw/zinc/01/15/03/1110011503.db2.gz CGKZCAIBRLUKIY-UHFFFAOYSA-N 2 0 356.322 4.456 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000449295308 1110019945 /nfs/dbraw/zinc/01/99/45/1110019945.db2.gz RHMMWQMZZSAMTP-LJQANCHMSA-N 2 0 359.517 4.420 20 0 FIADRP CC(C)N1CCc2nc(C[NH2+]CC[C@H]3CCc4ccccc43)sc2C1 ZINC000449375873 1110043511 /nfs/dbraw/zinc/04/35/11/1110043511.db2.gz JQSQVWBYJPIXGN-QGZVFWFLSA-N 2 0 355.551 4.119 20 0 FIADRP CC[C@@H](COCC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449377442 1110051411 /nfs/dbraw/zinc/05/14/11/1110051411.db2.gz AEDRFJZXTJOIKY-WMZOPIPTSA-N 2 0 372.475 4.029 20 0 FIADRP CC1(C)C[N@H+](CC2CCOCC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413037 1110055242 /nfs/dbraw/zinc/05/52/42/1110055242.db2.gz HGWBWLXVAZHCOQ-JOCHJYFZSA-N 2 0 356.554 4.036 20 0 FIADRP CC(C)[C@@H]1C[C@@H](C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCO1 ZINC000449490110 1110091499 /nfs/dbraw/zinc/09/14/99/1110091499.db2.gz BNPAOOJFBOTPNI-NWSQWKLXSA-N 2 0 358.570 4.123 20 0 FIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000538396376 1111122968 /nfs/dbraw/zinc/12/29/68/1111122968.db2.gz RCUJQYSXDUVERK-QFBILLFUSA-N 2 0 351.966 4.043 20 0 FIADRP Cc1ccccc1COc1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000538407620 1111129038 /nfs/dbraw/zinc/12/90/38/1111129038.db2.gz HTBIJJKAXYZBRU-LJQANCHMSA-N 2 0 350.506 4.487 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccc(Cl)s3)CC2)C[C@H](C)O1 ZINC000538721580 1111262250 /nfs/dbraw/zinc/26/22/50/1111262250.db2.gz RTMVHTDAPHJZAL-GJZGRUSLSA-N 2 0 356.963 4.113 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000538725394 1111274680 /nfs/dbraw/zinc/27/46/80/1111274680.db2.gz SFQOTGQOYZYTPN-UHFFFAOYSA-N 2 0 368.521 4.332 20 0 FIADRP c1nc([C@H]2CCCO2)sc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000538752916 1111283188 /nfs/dbraw/zinc/28/31/88/1111283188.db2.gz WTYPBRYYASANCH-LJQANCHMSA-N 2 0 363.571 4.083 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2Cc1ccc(F)c(-c2cccs2)c1 ZINC000538799089 1111295814 /nfs/dbraw/zinc/29/58/14/1111295814.db2.gz MMWQXXMXTUHTMH-LSTHTHJFSA-N 2 0 374.525 4.238 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(NC(=O)N(CC)CC)cc2)CC1 ZINC000461798393 1111360826 /nfs/dbraw/zinc/36/08/26/1111360826.db2.gz UCWCIERGHDGTOG-QGZVFWFLSA-N 2 0 360.546 4.085 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Br)c2)CCCC1 ZINC000539062132 1111407981 /nfs/dbraw/zinc/40/79/81/1111407981.db2.gz SXRXXFPVHANDKL-YJBOKZPZSA-N 2 0 365.359 4.191 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1cccc(-c2ccccc2)c1 ZINC000539062265 1111408225 /nfs/dbraw/zinc/40/82/25/1111408225.db2.gz VQBMQUPHQBNXLY-NWVWQQAFSA-N 2 0 364.533 4.382 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Br)c2)CCCC1 ZINC000539062129 1111408253 /nfs/dbraw/zinc/40/82/53/1111408253.db2.gz SXRXXFPVHANDKL-CRAIPNDOSA-N 2 0 365.359 4.191 20 0 FIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000539062215 1111408298 /nfs/dbraw/zinc/40/82/98/1111408298.db2.gz UGNXNVWVANXOIX-VABKMULXSA-N 2 0 374.569 4.140 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)Nc2cccc(F)c2)c1 ZINC000539071969 1111418667 /nfs/dbraw/zinc/41/86/67/1111418667.db2.gz ZITRIMKRTCJZLH-KRWDZBQOSA-N 2 0 371.500 4.173 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000539218636 1111480421 /nfs/dbraw/zinc/48/04/21/1111480421.db2.gz XMPNSUFRAYNJDA-ZLNRFVROSA-N 2 0 374.544 4.415 20 0 FIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000462115731 1111503259 /nfs/dbraw/zinc/50/32/59/1111503259.db2.gz ITNIOULLCDHATL-KRWDZBQOSA-N 2 0 373.368 4.139 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCOC1CCCCCC1)c1ccccc1O2 ZINC000539396075 1111541857 /nfs/dbraw/zinc/54/18/57/1111541857.db2.gz SJPRQYSKYPUGLL-OAQYLSRUSA-N 2 0 372.553 4.304 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(-n3ccnc3)c2)CC1 ZINC000552048320 1111557607 /nfs/dbraw/zinc/55/76/07/1111557607.db2.gz OKTQXNIHPBDHTG-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477857904 1111579996 /nfs/dbraw/zinc/57/99/96/1111579996.db2.gz RRLPBZKXROPFHE-RXVVDRJESA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000477869546 1111591359 /nfs/dbraw/zinc/59/13/59/1111591359.db2.gz XUSZAONIWSWPDE-BFQNTYOBSA-N 2 0 354.325 4.336 20 0 FIADRP CN(Cc1ccccc1)CC(C)(C)C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000552129160 1111594146 /nfs/dbraw/zinc/59/41/46/1111594146.db2.gz CLHRQRLWBFZJPC-NRFANRHFSA-N 2 0 356.554 4.036 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC000477950938 1111611643 /nfs/dbraw/zinc/61/16/43/1111611643.db2.gz VBDXZJTYVXSOGN-SFHVURJKSA-N 2 0 374.573 4.333 20 0 FIADRP C[NH+](C)CC1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCCC1 ZINC000552283346 1111648529 /nfs/dbraw/zinc/64/85/29/1111648529.db2.gz AFOGPOITMQBUKM-UHFFFAOYSA-N 3 0 357.586 4.141 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@@H](OCC2CC2)c2ccc(Cl)cc2)CC1 ZINC000552323976 1111669141 /nfs/dbraw/zinc/66/91/41/1111669141.db2.gz XHSRVAZPXQTEGX-HXUWFJFHSA-N 2 0 350.934 4.272 20 0 FIADRP FC(F)(F)C1(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000552338232 1111678896 /nfs/dbraw/zinc/67/88/96/1111678896.db2.gz BSSSJJRBSPYJSX-KZNAEPCWSA-N 2 0 352.444 4.219 20 0 FIADRP CSCc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000552338420 1111680060 /nfs/dbraw/zinc/68/00/60/1111680060.db2.gz FEDRTNBEAJOXPH-KRWDZBQOSA-N 2 0 358.551 4.341 20 0 FIADRP CCC(CC)(CN[C@@H]1CCCc2nn(C)cc21)[NH2+][C@H](C)c1ccccc1 ZINC000479057301 1111938439 /nfs/dbraw/zinc/93/84/39/1111938439.db2.gz HUSJKUJEQAKIGJ-YLJYHZDGSA-N 2 0 354.542 4.297 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479332034 1111994361 /nfs/dbraw/zinc/99/43/61/1111994361.db2.gz SFMRNBJMCPLHRW-SIKLNZKXSA-N 2 0 366.553 4.494 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)C1 ZINC000479358116 1111998277 /nfs/dbraw/zinc/99/82/77/1111998277.db2.gz ITJOBOOUQXSMCA-GUYCJALGSA-N 2 0 351.332 4.103 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000479368077 1112001800 /nfs/dbraw/zinc/00/18/00/1112001800.db2.gz XSPXOXKUZUCUEO-KPZWWZAWSA-N 2 0 367.306 4.113 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000479441352 1112024317 /nfs/dbraw/zinc/02/43/17/1112024317.db2.gz BFFLLMVLAPRKMJ-URXFXBBRSA-N 2 0 364.533 4.128 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(-c2ccncc2)s1 ZINC000553875969 1112118339 /nfs/dbraw/zinc/11/83/39/1112118339.db2.gz HPGXWOFIGSWRBY-HKUYNNGSSA-N 2 0 358.555 4.195 20 0 FIADRP Fc1ccc(C(CCC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c2ccc(F)cc2)cc1 ZINC000479783896 1112140874 /nfs/dbraw/zinc/14/08/74/1112140874.db2.gz QWAOARZQMFFLBR-KDURUIRLSA-N 2 0 356.460 4.028 20 0 FIADRP COc1ccc(-c2ccncc2)cc1CN(CCC[NH3+])Cc1ccccc1 ZINC000479945512 1112210499 /nfs/dbraw/zinc/21/04/99/1112210499.db2.gz ZNXUXXZHVATOIL-UHFFFAOYSA-N 2 0 361.489 4.108 20 0 FIADRP CC(C)c1nnc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)s1 ZINC000898517547 1112289032 /nfs/dbraw/zinc/28/90/32/1112289032.db2.gz PSPPSVOFHJYOQW-CEXWTWQISA-N 2 0 370.566 4.052 20 0 FIADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480252517 1112350644 /nfs/dbraw/zinc/35/06/44/1112350644.db2.gz USQBPFAIKWSZNE-RGKFVRLKSA-N 2 0 364.533 4.319 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000480252516 1112350923 /nfs/dbraw/zinc/35/09/23/1112350923.db2.gz USQBPFAIKWSZNE-PLOUGOBLSA-N 2 0 364.533 4.319 20 0 FIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000480252437 1112350962 /nfs/dbraw/zinc/35/09/62/1112350962.db2.gz UWUIBEWPSDQYEC-PKOBYXMFSA-N 2 0 371.491 4.076 20 0 FIADRP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480252292 1112351271 /nfs/dbraw/zinc/35/12/71/1112351271.db2.gz JZRZNVYOBBYSEX-INIZCTEOSA-N 2 0 357.542 4.222 20 0 FIADRP CC(C)n1ncc2c1C[C@@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)CC2 ZINC000480461090 1112438727 /nfs/dbraw/zinc/43/87/27/1112438727.db2.gz NEIDFMBXESENMW-NRFANRHFSA-N 2 0 368.569 4.069 20 0 FIADRP CC(C)([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(Br)c1 ZINC001168363092 1112450768 /nfs/dbraw/zinc/45/07/68/1112450768.db2.gz SKKQFEGYYVMKQL-UHFFFAOYSA-N 2 0 351.332 4.148 20 0 FIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]Cc1ccc(-n2ccnc2C)c(F)c1 ZINC000554734812 1112464028 /nfs/dbraw/zinc/46/40/28/1112464028.db2.gz QPYYNQVWQZHLIC-GOSISDBHSA-N 2 0 369.415 4.245 20 0 FIADRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(-c2cccs2)cc1)N1CC[NH+](C)CC1 ZINC000480548516 1112470513 /nfs/dbraw/zinc/47/05/13/1112470513.db2.gz JONLSYPHQSIMBI-NQIIRXRSSA-N 2 0 371.594 4.338 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000480610034 1112500282 /nfs/dbraw/zinc/50/02/82/1112500282.db2.gz NFSXGSVCKLNXTF-AQNXPRMDSA-N 2 0 354.542 4.281 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000480610238 1112500575 /nfs/dbraw/zinc/50/05/75/1112500575.db2.gz NBFNZZLQBIIIBR-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)nnn1-c1ccc(C)cc1 ZINC000480612898 1112500894 /nfs/dbraw/zinc/50/08/94/1112500894.db2.gz ODDCVVXQHBKVJU-OALUTQOASA-N 2 0 369.557 4.189 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cccc(N2CCCC2=O)c1 ZINC000480613862 1112501701 /nfs/dbraw/zinc/50/17/01/1112501701.db2.gz TZDRISUJPLPEOY-VAMGGRTRSA-N 2 0 371.569 4.222 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cccc(N2CCCC2=O)c1 ZINC000480613865 1112501740 /nfs/dbraw/zinc/50/17/40/1112501740.db2.gz TZDRISUJPLPEOY-ZCNNSNEGSA-N 2 0 371.569 4.222 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000480630551 1112510401 /nfs/dbraw/zinc/51/04/01/1112510401.db2.gz JZGFTFADSQPVNL-JKSUJKDBSA-N 2 0 352.494 4.006 20 0 FIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(-c4ccncc4)cc3F)C2)CC1 ZINC000554879021 1112550205 /nfs/dbraw/zinc/55/02/05/1112550205.db2.gz KKBAFBGHRFXDEQ-HXUWFJFHSA-N 2 0 353.485 4.051 20 0 FIADRP CCCCc1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000480697397 1112560174 /nfs/dbraw/zinc/56/01/74/1112560174.db2.gz KONBIHRMNKJCDP-IBGZPJMESA-N 2 0 366.553 4.027 20 0 FIADRP CC(C)N1CC[NH+](C2CCN([C@@H](C)c3cccc(Cl)c3F)CC2)CC1 ZINC000480872852 1112643572 /nfs/dbraw/zinc/64/35/72/1112643572.db2.gz UWPBONTZGMHYCO-INIZCTEOSA-N 2 0 367.940 4.031 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccs1 ZINC000480908248 1112672550 /nfs/dbraw/zinc/67/25/50/1112672550.db2.gz HPMVRVDPZVYMHN-OAQYLSRUSA-N 2 0 371.594 4.373 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](C)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000481418477 1112936782 /nfs/dbraw/zinc/93/67/82/1112936782.db2.gz LDSPMBVWEXLIOA-AYOQOUSVSA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)cc1Br ZINC000481446523 1112945665 /nfs/dbraw/zinc/94/56/65/1112945665.db2.gz QYLWKSLGYKFOSP-ZDUSSCGKSA-N 2 0 367.331 4.125 20 0 FIADRP COCCc1ccc(OC[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000667891134 1112959830 /nfs/dbraw/zinc/95/98/30/1112959830.db2.gz BIUKBLUGGBQNTK-LJQANCHMSA-N 2 0 374.569 4.030 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCC1 ZINC000481556795 1112980287 /nfs/dbraw/zinc/98/02/87/1112980287.db2.gz KJMHXPAYXRAOOF-YJBOKZPZSA-N 2 0 354.460 4.447 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCC1 ZINC000481556794 1112980541 /nfs/dbraw/zinc/98/05/41/1112980541.db2.gz KJMHXPAYXRAOOF-QAPCUYQASA-N 2 0 354.460 4.447 20 0 FIADRP C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1cc[nH+]c2cc(OC(F)(F)F)ccc21 ZINC000899877859 1113041318 /nfs/dbraw/zinc/04/13/18/1113041318.db2.gz JXZQXCSZNDSYBO-KGLIPLIRSA-N 2 0 365.399 4.196 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccc(F)c3)CC2)cc1 ZINC000481721428 1113054495 /nfs/dbraw/zinc/05/44/95/1113054495.db2.gz XFIKEUYUMNHAOW-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2c(s1)CCCC2 ZINC000481734127 1113059737 /nfs/dbraw/zinc/05/97/37/1113059737.db2.gz GOIWIKUDAUFXSN-INIZCTEOSA-N 2 0 358.551 4.418 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000481943042 1113135830 /nfs/dbraw/zinc/13/58/30/1113135830.db2.gz DYASQBIGVUHUCK-KSEOMHKRSA-N 2 0 369.553 4.163 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000481989375 1113145701 /nfs/dbraw/zinc/14/57/01/1113145701.db2.gz ANZJRWQMIXAGDY-INIZCTEOSA-N 2 0 369.484 4.141 20 0 FIADRP CC1(C)CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc21 ZINC000481996045 1113151438 /nfs/dbraw/zinc/15/14/38/1113151438.db2.gz ZOLANJMSVSNUCR-NFBKMPQASA-N 2 0 364.533 4.156 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(C(=O)OC)ccc2Cl)cc1 ZINC000482164037 1113190261 /nfs/dbraw/zinc/19/02/61/1113190261.db2.gz NSFOXJYEDBSYHY-UHFFFAOYSA-N 2 0 374.912 4.258 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)[C@@H](C)C1 ZINC000482334314 1113228107 /nfs/dbraw/zinc/22/81/07/1113228107.db2.gz NSAZRZFUJIJXDC-JTSKRJEESA-N 2 0 371.569 4.320 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCSc3ccc(Br)cc32)CC1 ZINC000482351464 1113229510 /nfs/dbraw/zinc/22/95/10/1113229510.db2.gz YEIBVFXDDCHITD-MRXNPFEDSA-N 2 0 369.372 4.308 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(OC)c1 ZINC000162934285 1113259180 /nfs/dbraw/zinc/25/91/80/1113259180.db2.gz PQQUEIYEBNHNDN-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OC)cc1 ZINC000482451278 1113263571 /nfs/dbraw/zinc/26/35/71/1113263571.db2.gz RXCFWQDHBBSMNC-REWPJTCUSA-N 2 0 352.522 4.301 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000482494236 1113278068 /nfs/dbraw/zinc/27/80/68/1113278068.db2.gz CQPOAMJNMXIYHO-LEWJYISDSA-N 2 0 365.565 4.278 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000482549814 1113291430 /nfs/dbraw/zinc/29/14/30/1113291430.db2.gz DYCJRWGYKPLHIH-WMZHIEFXSA-N 2 0 367.537 4.156 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCC1 ZINC000482553720 1113292465 /nfs/dbraw/zinc/29/24/65/1113292465.db2.gz KBOBUVGSRBMPOU-QHCPKHFHSA-N 2 0 358.570 4.482 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1cccc(C(F)(F)F)c1 ZINC000482543622 1113292829 /nfs/dbraw/zinc/29/28/29/1113292829.db2.gz NJBJZHHITKMTPT-IBGZPJMESA-N 2 0 372.475 4.087 20 0 FIADRP C[C@H]([NH2+]CCCc1c[nH]c2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000482640866 1113317903 /nfs/dbraw/zinc/31/79/03/1113317903.db2.gz WUAPIBHCVGTJCR-SFHVURJKSA-N 2 0 365.521 4.392 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1cccc(OCCCc2ccccc2)c1 ZINC000482906549 1113396684 /nfs/dbraw/zinc/39/66/84/1113396684.db2.gz WPMKRSDLBDXZNQ-HYBUGGRVSA-N 2 0 366.549 4.171 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)nnn1-c1ccc(F)cc1 ZINC000482949555 1113403507 /nfs/dbraw/zinc/40/35/07/1113403507.db2.gz PEVVYGRKXHAVJP-KRWDZBQOSA-N 2 0 373.520 4.022 20 0 FIADRP Cc1nn(-c2ccccc2)cc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486376489 1113556770 /nfs/dbraw/zinc/55/67/70/1113556770.db2.gz OYSGEFHMBCYIHN-KNQAVFIVSA-N 2 0 374.532 4.181 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2sccc2Cl)cc1 ZINC000486963201 1113688261 /nfs/dbraw/zinc/68/82/61/1113688261.db2.gz FYFGZJNWARDMRF-UHFFFAOYSA-N 2 0 352.931 4.412 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000488117323 1113859274 /nfs/dbraw/zinc/85/92/74/1113859274.db2.gz YEJCEYWWTCUQKI-BRKWEVRTSA-N 2 0 354.538 4.108 20 0 FIADRP C[C@@H]1CSCC[NH+](Cc2cccc(C[N@H+]3CCSC[C@@H](C)C3)c2)C1 ZINC000488198907 1113876431 /nfs/dbraw/zinc/87/64/31/1113876431.db2.gz KPOSVDUOONUWSL-ROUUACIJSA-N 2 0 364.624 4.056 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)cc1 ZINC000488422970 1113925549 /nfs/dbraw/zinc/92/55/49/1113925549.db2.gz AMALYJZDOHFKID-IEBWSBKVSA-N 2 0 350.572 4.027 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CS[C@H](C(C)C)C3)CC2)cc1 ZINC000488415344 1113927220 /nfs/dbraw/zinc/92/72/20/1113927220.db2.gz AKJVBBFSWFQFQV-CTNGQTDRSA-N 2 0 362.583 4.027 20 0 FIADRP Clc1ccc(Cl)c(CC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000488448335 1113933702 /nfs/dbraw/zinc/93/37/02/1113933702.db2.gz ZPDAMBHPWRFAPM-UHFFFAOYSA-N 2 0 371.352 4.113 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Br)c(F)c2)C1 ZINC000489524641 1114124379 /nfs/dbraw/zinc/12/43/79/1114124379.db2.gz VCLGGPAQBCGLGD-ZIAGYGMSSA-N 2 0 357.311 4.359 20 0 FIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000490126971 1114221264 /nfs/dbraw/zinc/22/12/64/1114221264.db2.gz ZDLITESZQZTMJA-QFIPXVFZSA-N 2 0 371.956 4.045 20 0 FIADRP CC(C)(C)CCOc1cnccc1C[NH2+]C1CCN(c2ccccn2)CC1 ZINC000490406283 1114288957 /nfs/dbraw/zinc/28/89/57/1114288957.db2.gz ZDSAAOSETSVKHL-UHFFFAOYSA-N 2 0 368.525 4.050 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000570997636 1114427185 /nfs/dbraw/zinc/42/71/85/1114427185.db2.gz TXPXMSSQALURHQ-UHFFFAOYSA-N 2 0 370.541 4.379 20 0 FIADRP CCOC(=O)CC(C)(C)CC[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000588204762 1114555449 /nfs/dbraw/zinc/55/54/49/1114555449.db2.gz JFZOWBDTEBTYQO-RTBURBONSA-N 2 0 374.569 4.102 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641846 1114820521 /nfs/dbraw/zinc/82/05/21/1114820521.db2.gz QKRNCHBBTYRXJQ-ROUUACIJSA-N 2 0 362.521 4.331 20 0 FIADRP CCn1ccnc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000589832678 1114846390 /nfs/dbraw/zinc/84/63/90/1114846390.db2.gz ZSYSBVWKAZTCOR-UHFFFAOYSA-N 2 0 374.532 4.456 20 0 FIADRP CC[N@H+](CCC(=O)Nc1ccccc1Cl)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999352 1114873074 /nfs/dbraw/zinc/87/30/74/1114873074.db2.gz BEJCNWDHYJGMKU-UHFFFAOYSA-N 2 0 373.928 4.252 20 0 FIADRP CCC[C@H](NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1)c1ccccc1 ZINC000590786825 1114974407 /nfs/dbraw/zinc/97/44/07/1114974407.db2.gz NZXAPCYYLLWVOK-KNQAVFIVSA-N 2 0 373.585 4.085 20 0 FIADRP FC(F)(F)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000573034442 1115002435 /nfs/dbraw/zinc/00/24/35/1115002435.db2.gz WJJGRLVCUCEBCE-OALUTQOASA-N 2 0 370.459 4.262 20 0 FIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC1 ZINC000573315590 1115094340 /nfs/dbraw/zinc/09/43/40/1115094340.db2.gz GTIIXLHFIBMOST-QWQCLYJRSA-N 2 0 362.315 4.167 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000573444644 1115103117 /nfs/dbraw/zinc/10/31/17/1115103117.db2.gz HKUFGHOLGBBLKM-CYBMUJFWSA-N 2 0 374.941 4.275 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccccc2OCc2ccccc2)CC1 ZINC000591707740 1115125923 /nfs/dbraw/zinc/12/59/23/1115125923.db2.gz OMTPMLYFJYEMLH-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(O)(c3ccccc3)CC2)CC1 ZINC000760909927 1115171502 /nfs/dbraw/zinc/17/15/02/1115171502.db2.gz TWPMYSOORWFSMM-BXDDPRONSA-N 2 0 370.581 4.450 20 0 FIADRP COCc1cc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1OC ZINC000157542587 1115176098 /nfs/dbraw/zinc/17/60/98/1115176098.db2.gz JDEUKVUBOVEMSI-QGZVFWFLSA-N 2 0 360.542 4.289 20 0 FIADRP CC(C)[NH+]1CCC(N[C@@H]2C[C@H](C(=O)OC(C)(C)C)c3ccccc32)CC1 ZINC000593689355 1115342101 /nfs/dbraw/zinc/34/21/01/1115342101.db2.gz HVKNVIYGIWOJJL-VQTJNVASSA-N 2 0 358.526 4.019 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)ccc1OC ZINC000157829635 1115345235 /nfs/dbraw/zinc/34/52/35/1115345235.db2.gz NTJCSGYYZFJXKY-AQKFKSFVSA-N 2 0 360.542 4.145 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000574561333 1115422429 /nfs/dbraw/zinc/42/24/29/1115422429.db2.gz CJRMCZYZPODJSA-DEOSSOPVSA-N 2 0 364.533 4.443 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c1F ZINC000669679286 1115769415 /nfs/dbraw/zinc/76/94/15/1115769415.db2.gz HLGPZZVYSSQIPW-UHFFFAOYSA-N 2 0 356.485 4.356 20 0 FIADRP Oc1ccc([C@H]2CCC[N@@H+]2CCC[NH+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000607151094 1116003479 /nfs/dbraw/zinc/00/34/79/1116003479.db2.gz WRPCOOIFTQVOEI-ZRZAMGCNSA-N 2 0 366.505 4.462 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000534238069 1116174293 /nfs/dbraw/zinc/17/42/93/1116174293.db2.gz CCJCXQXJDRMYIV-HXUWFJFHSA-N 2 0 358.913 4.448 20 0 FIADRP C[C@@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)c1ccc([S@](C)=O)cc1 ZINC000534452298 1116200290 /nfs/dbraw/zinc/20/02/90/1116200290.db2.gz JKUFZCPOBWGPKI-DWXRJYCRSA-N 2 0 372.578 4.233 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000534793793 1116237372 /nfs/dbraw/zinc/23/73/72/1116237372.db2.gz PRHPDXBFRUDQNU-MEDUHNTESA-N 2 0 357.723 4.021 20 0 FIADRP Cc1ccc2nc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)cn2c1 ZINC000534965084 1116256091 /nfs/dbraw/zinc/25/60/91/1116256091.db2.gz KZTJXPCJOVHVPH-UHFFFAOYSA-N 2 0 374.532 4.131 20 0 FIADRP CN(Cc1cccc(C(F)(F)F)c1)C1CC[NH+](C[C@@H]2CCCOC2)CC1 ZINC000535405766 1116303128 /nfs/dbraw/zinc/30/31/28/1116303128.db2.gz JCUJGFHWQSKASM-KRWDZBQOSA-N 2 0 370.459 4.028 20 0 FIADRP C[C@H](Nc1ccc(N2CCCCC2)cn1)c1cccc(OCC[NH+](C)C)c1 ZINC000539626887 1116356004 /nfs/dbraw/zinc/35/60/04/1116356004.db2.gz FUULEAGDEOYTFL-SFHVURJKSA-N 2 0 368.525 4.185 20 0 FIADRP Cc1ccccc1-c1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)c1 ZINC000539895231 1117739088 /nfs/dbraw/zinc/73/90/88/1117739088.db2.gz AJLGOOCYDNTMRS-OEMFJLHTSA-N 2 0 364.533 4.346 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000462796885 1117779436 /nfs/dbraw/zinc/77/94/36/1117779436.db2.gz YLFHWOSAJINJAJ-WTIAFYNJSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462804157 1117786112 /nfs/dbraw/zinc/78/61/12/1117786112.db2.gz CVGQDNJELSZTOW-VVMVDLBUSA-N 2 0 351.332 4.013 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCC2 ZINC000539968625 1117786550 /nfs/dbraw/zinc/78/65/50/1117786550.db2.gz XCAOYIWKLBSTKP-LJQANCHMSA-N 2 0 363.343 4.291 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3csc(C)n3)CC2)cc1 ZINC000462898428 1117847543 /nfs/dbraw/zinc/84/75/43/1117847543.db2.gz UEHNPIXAASGDQO-OAHLLOKOSA-N 2 0 359.539 4.023 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3csc(C)n3)CC2)cc1 ZINC000462898427 1117848195 /nfs/dbraw/zinc/84/81/95/1117848195.db2.gz UEHNPIXAASGDQO-HNNXBMFYSA-N 2 0 359.539 4.023 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(C(C)(C)C)cc1 ZINC000540142637 1117895170 /nfs/dbraw/zinc/89/51/70/1117895170.db2.gz CNJBIYHYIAAZBH-QGZVFWFLSA-N 2 0 355.526 4.170 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cc2c(s1)CCCC2 ZINC000540158251 1117903112 /nfs/dbraw/zinc/90/31/12/1117903112.db2.gz TVMCKYYQLQICLK-KFKAGJAMSA-N 2 0 362.583 4.045 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CCC2)[C@H](C)C1 ZINC000540159629 1117903901 /nfs/dbraw/zinc/90/39/01/1117903901.db2.gz BFEDEZYJKKXGHY-IRLDBZIGSA-N 2 0 358.570 4.126 20 0 FIADRP COc1ccc2cc([C@@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)ccc2c1 ZINC000540171552 1117912678 /nfs/dbraw/zinc/91/26/78/1117912678.db2.gz RJOFTMNOKVAVGV-CEXWTWQISA-N 2 0 370.537 4.388 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1C(F)(F)F ZINC000540170500 1117912846 /nfs/dbraw/zinc/91/28/46/1117912846.db2.gz ITRZJMXBZFVSLQ-XHSDSOJGSA-N 2 0 358.448 4.245 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCCOc3ccc(Cl)cc32)C[C@@H](C)O1 ZINC000540171649 1117913470 /nfs/dbraw/zinc/91/34/70/1117913470.db2.gz UOGGBEZLSQYOSU-MDZRGWNJSA-N 2 0 366.933 4.033 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)C[C@H](C)O1 ZINC000540171648 1117913583 /nfs/dbraw/zinc/91/35/83/1117913583.db2.gz UOGGBEZLSQYOSU-JTDSTZFVSA-N 2 0 366.933 4.033 20 0 FIADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540178858 1117923212 /nfs/dbraw/zinc/92/32/12/1117923212.db2.gz HQZIPQCHYAWGRM-UWJYYQICSA-N 2 0 354.494 4.028 20 0 FIADRP CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540178728 1117923435 /nfs/dbraw/zinc/92/34/35/1117923435.db2.gz FCXFGJUNQSGZQH-VGOFRKELSA-N 2 0 368.521 4.364 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccccc1F ZINC000540192766 1117933830 /nfs/dbraw/zinc/93/38/30/1117933830.db2.gz QSYVXJZMIHNPFI-LJQANCHMSA-N 2 0 355.501 4.079 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CCc2nc3ccccc3n2C)CC1)CC(C)C ZINC000540197360 1117938832 /nfs/dbraw/zinc/93/88/32/1117938832.db2.gz MANUXNFDMUXQNY-UHFFFAOYSA-N 2 0 370.585 4.196 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccnc1 ZINC000540262370 1117962976 /nfs/dbraw/zinc/96/29/76/1117962976.db2.gz KAHSHLYBPHXVAN-YYDVJCTNSA-N 2 0 367.537 4.178 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000540262758 1117963148 /nfs/dbraw/zinc/96/31/48/1117963148.db2.gz HTPBALLKZWMMTA-DEOSSOPVSA-N 2 0 363.549 4.065 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540300115 1117975481 /nfs/dbraw/zinc/97/54/81/1117975481.db2.gz YVFZQUKKKIPHGH-FQEVSTJZSA-N 2 0 371.456 4.221 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C2CCN(c3ccccc3)CC2)c1 ZINC000463144015 1117982416 /nfs/dbraw/zinc/98/24/16/1117982416.db2.gz JBDHEWXGHWRRGL-UHFFFAOYSA-N 2 0 351.538 4.287 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463136515 1117984765 /nfs/dbraw/zinc/98/47/65/1117984765.db2.gz KKLSOFYAZZKSBP-HYVLGVRCSA-N 2 0 371.613 4.387 20 0 FIADRP CC[C@H](Cc1ccccc1Br)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000540394706 1118028678 /nfs/dbraw/zinc/02/86/78/1118028678.db2.gz FKSVGJLTLVPDDG-QGZVFWFLSA-N 2 0 365.359 4.234 20 0 FIADRP C[C@@H]1C[C@H](N[C@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463279884 1118067746 /nfs/dbraw/zinc/06/77/46/1118067746.db2.gz KIIMKFKCLGHTJJ-JFTIXFDTSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCCNc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463288281 1118084665 /nfs/dbraw/zinc/08/46/65/1118084665.db2.gz ZZCLWWUFOSUNBD-PGRDOPGGSA-N 2 0 355.501 4.270 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCc3ccc(F)cc31)c1ccccc1O2 ZINC000540494730 1118092524 /nfs/dbraw/zinc/09/25/24/1118092524.db2.gz ISXDTFSKBMWCTP-SFTDATJTSA-N 2 0 366.480 4.391 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000540992649 1118342265 /nfs/dbraw/zinc/34/22/65/1118342265.db2.gz YIULYTOEUVHGRV-FXAWDEMLSA-N 2 0 370.562 4.216 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2cnccn2)CC1 ZINC000541543208 1118548488 /nfs/dbraw/zinc/54/84/88/1118548488.db2.gz XNEGZGJOUKOQQY-JOCHJYFZSA-N 2 0 370.516 4.053 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312366420 1118591108 /nfs/dbraw/zinc/59/11/08/1118591108.db2.gz ADSRSPXZJDBOSG-FDDCHVKYSA-N 2 0 368.521 4.267 20 0 FIADRP CC(C)c1ccc([C@@H](C)[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000541663171 1118596505 /nfs/dbraw/zinc/59/65/05/1118596505.db2.gz YJTOGSRGKKASSZ-HXUWFJFHSA-N 2 0 357.586 4.221 20 0 FIADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCCOc2cccc(C(F)(F)F)c2)C1 ZINC000464791400 1118699570 /nfs/dbraw/zinc/69/95/70/1118699570.db2.gz SSEHWKSZHYYQHN-INIZCTEOSA-N 2 0 358.448 4.138 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000541916100 1118706996 /nfs/dbraw/zinc/70/69/96/1118706996.db2.gz AKVPBNAXBWKNDX-RPWUZVMVSA-N 2 0 366.549 4.000 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCc3c(Br)cccc32)CC1 ZINC000542156461 1118816707 /nfs/dbraw/zinc/81/67/07/1118816707.db2.gz ZBSYIWZYMNXBLY-SFHVURJKSA-N 2 0 351.332 4.291 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(C)cc1OC(C)(C)C ZINC000542313120 1118897736 /nfs/dbraw/zinc/89/77/36/1118897736.db2.gz LFWHPKWHBAYZIX-UHFFFAOYSA-N 2 0 364.493 4.351 20 0 FIADRP Cc1ccc(C[C@H](C)[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)s1 ZINC000151889551 1118997984 /nfs/dbraw/zinc/99/79/84/1118997984.db2.gz VUZPPJCNOMNWAK-INIZCTEOSA-N 2 0 357.567 4.312 20 0 FIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc1 ZINC000173335228 1119034010 /nfs/dbraw/zinc/03/40/10/1119034010.db2.gz PCALBCSSHJNPGJ-SFHVURJKSA-N 2 0 369.578 4.007 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000492251449 1119057889 /nfs/dbraw/zinc/05/78/89/1119057889.db2.gz HVSLCUCRPCWUDC-FGZHOGPDSA-N 2 0 372.940 4.256 20 0 FIADRP C[C@H]([NH2+]CCCCOc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492404600 1119087805 /nfs/dbraw/zinc/08/78/05/1119087805.db2.gz ZNKKENJBTDWIKQ-UNMCSNQZSA-N 2 0 352.522 4.346 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000542465097 1119287761 /nfs/dbraw/zinc/28/77/61/1119287761.db2.gz SRAQIXGOTTZZLL-YCRPNKLZSA-N 2 0 350.441 4.298 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cc(-n3ccnc3)cs2)CC1)CC1CC1 ZINC000542464791 1119326364 /nfs/dbraw/zinc/32/63/64/1119326364.db2.gz JYIRYKJEVQZNQY-UHFFFAOYSA-N 2 0 372.582 4.268 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c(-c2cnn(C)c2)c1 ZINC000669988635 1119327248 /nfs/dbraw/zinc/32/72/48/1119327248.db2.gz LLZHGZQGWGNCHD-PMACEKPBSA-N 2 0 368.569 4.243 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000311771339 1119389178 /nfs/dbraw/zinc/38/91/78/1119389178.db2.gz GOFACDYYTCHQQF-XTQVGHSUSA-N 2 0 350.506 4.183 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311859760 1119392643 /nfs/dbraw/zinc/39/26/43/1119392643.db2.gz UXICNPXCASZHOC-NNMXDRDESA-N 2 0 352.522 4.126 20 0 FIADRP COc1ccc(C[C@H](C)C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1F ZINC000761528069 1119409562 /nfs/dbraw/zinc/40/95/62/1119409562.db2.gz YJFJDPUYLUZZMM-KKXNLOMOSA-N 2 0 362.533 4.400 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000186283502 1119718623 /nfs/dbraw/zinc/71/86/23/1119718623.db2.gz WEGMYFODEBMBJZ-JTHBVZDNSA-N 2 0 364.533 4.037 20 0 FIADRP Brc1cncc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000186581187 1119737678 /nfs/dbraw/zinc/73/76/78/1119737678.db2.gz ADOUWCZVUOAXHO-UHFFFAOYSA-N 2 0 374.326 4.120 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000186599186 1119739078 /nfs/dbraw/zinc/73/90/78/1119739078.db2.gz QCEKZWNDNSWLNW-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP COCCC1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCCCC1 ZINC000186883643 1119754646 /nfs/dbraw/zinc/75/46/46/1119754646.db2.gz WXVLOSGPRKNUAM-UHFFFAOYSA-N 2 0 358.570 4.270 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)C3CCSCC3)CC2)cc1 ZINC000187113667 1119767620 /nfs/dbraw/zinc/76/76/20/1119767620.db2.gz NWFFMAYYBGUATF-KRWDZBQOSA-N 2 0 362.583 4.029 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000494481469 1119876582 /nfs/dbraw/zinc/87/65/82/1119876582.db2.gz AIJQKRHIJASPAB-RTWAWAEBSA-N 2 0 367.880 4.454 20 0 FIADRP Cc1cc(-n2ccnc2)ccc1C[NH2+][C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000494481470 1119876648 /nfs/dbraw/zinc/87/66/48/1119876648.db2.gz AIJQKRHIJASPAB-SFTDATJTSA-N 2 0 367.880 4.454 20 0 FIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000494530342 1119895989 /nfs/dbraw/zinc/89/59/89/1119895989.db2.gz XGXZCHQBNMDVMR-GOSISDBHSA-N 2 0 363.343 4.209 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2ccc(Br)cc2)CC1 ZINC000222842696 1119921402 /nfs/dbraw/zinc/92/14/02/1119921402.db2.gz PWXABDIXPGTWCO-OAHLLOKOSA-N 2 0 353.348 4.090 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)cn1 ZINC000190770946 1119948389 /nfs/dbraw/zinc/94/83/89/1119948389.db2.gz DOERPFFXKBJUNF-IBGZPJMESA-N 2 0 366.553 4.059 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cnn1C(C)(C)C ZINC000191144853 1119962917 /nfs/dbraw/zinc/96/29/17/1119962917.db2.gz PVYCEVBEIFOCLA-QGZVFWFLSA-N 2 0 354.542 4.393 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)C[N@@H+]1Cc1ccccc1 ZINC000494612396 1119996163 /nfs/dbraw/zinc/99/61/63/1119996163.db2.gz NCIDTDILVVJBHU-OOWPADAASA-N 2 0 368.565 4.224 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(Br)c(Cl)c2)c1 ZINC000192165517 1120034062 /nfs/dbraw/zinc/03/40/62/1120034062.db2.gz TVTGIFYPEHYUHZ-UHFFFAOYSA-N 2 0 367.718 4.454 20 0 FIADRP C[C@@H]1COCC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000192542784 1120066411 /nfs/dbraw/zinc/06/64/11/1120066411.db2.gz XYBQQVPHHVOUTH-WZONZLPQSA-N 2 0 361.489 4.113 20 0 FIADRP C[N@H+](CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Cc1ccccc1 ZINC000494882553 1120356061 /nfs/dbraw/zinc/35/60/61/1120356061.db2.gz ZVHNQTKTABTBJB-NZQKXSOJSA-N 2 0 370.512 4.405 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2cccc(Cl)c2)CC1 ZINC001168475346 1120434958 /nfs/dbraw/zinc/43/49/58/1120434958.db2.gz XRYOOQRGALLRMC-INIZCTEOSA-N 2 0 360.904 4.446 20 0 FIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495078427 1120462231 /nfs/dbraw/zinc/46/22/31/1120462231.db2.gz JMZBTEOXUNTOKI-XXBNENTESA-N 2 0 357.586 4.090 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000495261132 1120595552 /nfs/dbraw/zinc/59/55/52/1120595552.db2.gz UTUTXEBEDHZOEY-UWJYYQICSA-N 2 0 355.913 4.093 20 0 FIADRP COC[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000670160977 1120763472 /nfs/dbraw/zinc/76/34/72/1120763472.db2.gz ITWZZECWBUEZBN-KEAPPQJHSA-N 2 0 362.945 4.269 20 0 FIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495410136 1120787550 /nfs/dbraw/zinc/78/75/50/1120787550.db2.gz TYPRIYGSCDIKHJ-IFMALSPDSA-N 3 0 369.597 4.284 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(Br)cc2)CC1 ZINC000232969848 1120795564 /nfs/dbraw/zinc/79/55/64/1120795564.db2.gz ZKMMTVZCUHTNHR-OAHLLOKOSA-N 2 0 353.348 4.234 20 0 FIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001168488681 1120859077 /nfs/dbraw/zinc/85/90/77/1120859077.db2.gz SAMXSECKSBYZPL-SFHVURJKSA-N 2 0 356.485 4.338 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(F)cc3)CC2)cc1 ZINC000495788364 1120957759 /nfs/dbraw/zinc/95/77/59/1120957759.db2.gz PILWJVTWROLLHN-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)CC1 ZINC000236980991 1120972099 /nfs/dbraw/zinc/97/20/99/1120972099.db2.gz JXJXMZYMRCCRGP-QGZVFWFLSA-N 2 0 373.491 4.266 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2Cl)C[C@H](C)O1 ZINC000237623692 1120980377 /nfs/dbraw/zinc/98/03/77/1120980377.db2.gz UJULBFIMMGEXOV-IRXDYDNUSA-N 2 0 358.913 4.239 20 0 FIADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000155083856 1121178898 /nfs/dbraw/zinc/17/88/98/1121178898.db2.gz NSLMHZIZAIDTDU-QZTJIDSGSA-N 2 0 365.521 4.320 20 0 FIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000397543412 1121214799 /nfs/dbraw/zinc/21/47/99/1121214799.db2.gz CLYQXUONXGWQKT-QGZVFWFLSA-N 2 0 358.913 4.018 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000397602085 1121240654 /nfs/dbraw/zinc/24/06/54/1121240654.db2.gz UVOVISVIBBQHNZ-QHCPKHFHSA-N 2 0 350.506 4.184 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1OC(F)F ZINC000397998019 1121331668 /nfs/dbraw/zinc/33/16/68/1121331668.db2.gz UKFHSTLNTUHOGH-APWZRJJASA-N 2 0 360.448 4.288 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CSc2ccccc21 ZINC000398014186 1121333777 /nfs/dbraw/zinc/33/37/77/1121333777.db2.gz FKSMNHSAZSLHGV-SLYNCCJLSA-N 2 0 352.547 4.376 20 0 FIADRP Cc1cc(-c2noc([C@@H](C)[NH+]3CCC(CCC[NH+](C)C)CC3)n2)ccc1F ZINC000123627238 1121619787 /nfs/dbraw/zinc/61/97/87/1121619787.db2.gz JLDNTBDYHYWPBE-MRXNPFEDSA-N 2 0 374.504 4.299 20 0 FIADRP COC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000123672755 1121623898 /nfs/dbraw/zinc/62/38/98/1121623898.db2.gz NADIWMWMCQWPDI-LJQANCHMSA-N 2 0 366.427 4.244 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000671739770 1121636953 /nfs/dbraw/zinc/63/69/53/1121636953.db2.gz OVVUQFDFUBPIHL-OAHLLOKOSA-N 2 0 353.466 4.226 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000671744582 1121649583 /nfs/dbraw/zinc/64/95/83/1121649583.db2.gz NMBVCNQCXCYIOX-AEFFLSMTSA-N 2 0 365.477 4.096 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000124642758 1121710410 /nfs/dbraw/zinc/71/04/10/1121710410.db2.gz KKBKRAMKAHPFGL-OTWHNJEPSA-N 2 0 368.521 4.155 20 0 FIADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000671754084 1121753862 /nfs/dbraw/zinc/75/38/62/1121753862.db2.gz QLGLYCARKRWYNY-WXFUMESZSA-N 2 0 363.549 4.213 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 ZINC000125376125 1121773529 /nfs/dbraw/zinc/77/35/29/1121773529.db2.gz QAHYTSNZBSHVFY-MRXNPFEDSA-N 2 0 371.352 4.459 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CC2 ZINC000125464522 1121781483 /nfs/dbraw/zinc/78/14/83/1121781483.db2.gz ZYPIGTPBPCNMLM-NRFANRHFSA-N 2 0 356.535 4.246 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C[C@@H]4CC45CCOCC5)[C@@H]3C2)cc1 ZINC000671761459 1121790103 /nfs/dbraw/zinc/79/01/03/1121790103.db2.gz VDZKCPJRRYHFBK-GPJHCHHRSA-N 2 0 368.565 4.084 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1 ZINC000125567171 1121792357 /nfs/dbraw/zinc/79/23/57/1121792357.db2.gz QGMPWNFSJNRXBP-MOPGFXCFSA-N 2 0 374.573 4.333 20 0 FIADRP C[C@H]([NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC000671764617 1121796995 /nfs/dbraw/zinc/79/69/95/1121796995.db2.gz KLSXMBDLIZOTEY-MGPUTAFESA-N 2 0 350.934 4.128 20 0 FIADRP CCc1ccc(-c2ccc(C[NH2+]CCCCN3CC[NH+](CC)CC3)o2)cc1 ZINC000072921917 1121909641 /nfs/dbraw/zinc/90/96/41/1121909641.db2.gz BLZGPHXCBVYDBI-UHFFFAOYSA-N 2 0 369.553 4.016 20 0 FIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608272 1121970389 /nfs/dbraw/zinc/97/03/89/1121970389.db2.gz CRNDTMNGIZNDQI-DENIHFKCSA-N 2 0 360.542 4.158 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)c(F)c3)cc2)CC1 ZINC000916999254 1121996476 /nfs/dbraw/zinc/99/64/76/1121996476.db2.gz ISDNLAADNBTGLM-JOCHJYFZSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3c(F)cccc3F)cc2)C1 ZINC000917008899 1121997256 /nfs/dbraw/zinc/99/72/56/1121997256.db2.gz USPYFVWZCSGBGR-IIBYNOLFSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc(OC(F)F)c(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000497291864 1122005208 /nfs/dbraw/zinc/00/52/08/1122005208.db2.gz FLWWNOPHNREKOP-HOTGVXAUSA-N 2 0 370.484 4.144 20 0 FIADRP c1ccc2c(c1)oc1ccc(C[NH+]3CCC(C[NH+]4CCOCC4)CC3)cc12 ZINC000917061169 1122042080 /nfs/dbraw/zinc/04/20/80/1122042080.db2.gz UKPQVDAMDLZGRY-UHFFFAOYSA-N 2 0 364.489 4.130 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+](Cc3ccccc3)C[C@@H](C)C[NH3+])CCO2)cc1 ZINC001168615491 1122069088 /nfs/dbraw/zinc/06/90/88/1122069088.db2.gz OFDINLDFYPIIFB-HARLFGEKSA-N 2 0 368.521 4.012 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC001168619659 1122167416 /nfs/dbraw/zinc/16/74/16/1122167416.db2.gz ZLUHQBNBAOWUMR-NZQKXSOJSA-N 2 0 372.553 4.302 20 0 FIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542693571 1122289034 /nfs/dbraw/zinc/28/90/34/1122289034.db2.gz JVPIFISCNOFNHN-ZGYCNENWSA-N 2 0 356.460 4.478 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H](c3ccccc3)c3cncnc3)CC2)CC1 ZINC000542704440 1122299559 /nfs/dbraw/zinc/29/95/59/1122299559.db2.gz JCFKDYNQNVEVSO-VNXZQDSDSA-N 2 0 364.537 4.199 20 0 FIADRP Cc1cc2ncn(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)c2cc1C ZINC000917443107 1122315152 /nfs/dbraw/zinc/31/51/52/1122315152.db2.gz PNCOTCBHEHWPDL-UHFFFAOYSA-N 2 0 354.542 4.199 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1cccc(-n2ccnc2)c1 ZINC000556094866 1122648221 /nfs/dbraw/zinc/64/82/21/1122648221.db2.gz ZGQPJHHNVKJTNG-QTGUNEKASA-N 2 0 360.505 4.358 20 0 FIADRP Cn1ncc2c1CCC[C@@H]2[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000129872427 1122706034 /nfs/dbraw/zinc/70/60/34/1122706034.db2.gz FEDBLYWWWRSYLK-QFIPXVFZSA-N 2 0 366.553 4.352 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCCC1 ZINC000556233982 1122750847 /nfs/dbraw/zinc/75/08/47/1122750847.db2.gz UJYVMEQNCIFCKZ-KNQAVFIVSA-N 2 0 356.554 4.084 20 0 FIADRP COc1ccc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1F ZINC000556236613 1122753815 /nfs/dbraw/zinc/75/38/15/1122753815.db2.gz UMLWPJYZVVJNBK-UHFFFAOYSA-N 2 0 370.512 4.410 20 0 FIADRP Cc1ccc2nc(CNCc3ccccc3C[N@H+]3CCC[C@H](C)C3)cn2c1 ZINC000556405409 1122867901 /nfs/dbraw/zinc/86/79/01/1122867901.db2.gz YLKXZAMQMSLKSU-SFHVURJKSA-N 2 0 362.521 4.164 20 0 FIADRP COc1cc(OC)c([C@H](C)NC2CC[NH+](CC(C)C)CC2)cc1Cl ZINC000131224059 1123005518 /nfs/dbraw/zinc/00/55/18/1123005518.db2.gz UZOYFAXZNOKMKT-AWEZNQCLSA-N 2 0 354.922 4.128 20 0 FIADRP CC(C)(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cc2ccccc2o1 ZINC000498942656 1123093868 /nfs/dbraw/zinc/09/38/68/1123093868.db2.gz MWIDGRKIZOCQBH-GHTZIAJQSA-N 2 0 358.526 4.347 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@H]2CCC[C@@H]21 ZINC000556869709 1123150538 /nfs/dbraw/zinc/15/05/38/1123150538.db2.gz ANBHXMBKESMCKQ-GIWBLDEGSA-N 2 0 374.532 4.047 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)[C@@H]2CCC[C@@H]21 ZINC000556869908 1123153089 /nfs/dbraw/zinc/15/30/89/1123153089.db2.gz DAOWEFUOAKGFJA-RDGPPVDQSA-N 2 0 350.453 4.128 20 0 FIADRP CCn1nc(C)c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1C ZINC000556884155 1123160951 /nfs/dbraw/zinc/16/09/51/1123160951.db2.gz NDKJHORGTWETGD-UHFFFAOYSA-N 2 0 366.553 4.008 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000556890650 1123176577 /nfs/dbraw/zinc/17/65/77/1123176577.db2.gz UHIPXBWEDYWPHA-QGZVFWFLSA-N 2 0 356.432 4.358 20 0 FIADRP CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000556911922 1123210629 /nfs/dbraw/zinc/21/06/29/1123210629.db2.gz KTSDACYBODDJKA-HNNXBMFYSA-N 2 0 362.514 4.339 20 0 FIADRP C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@H]1CCC[NH2+]C1 ZINC000556951939 1123262313 /nfs/dbraw/zinc/26/23/13/1123262313.db2.gz FCCPJIXOKDKMIA-CABCVRRESA-N 2 0 371.352 4.019 20 0 FIADRP C[N@H+](CCN[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1)C1CCCCC1 ZINC000499141164 1123282995 /nfs/dbraw/zinc/28/29/95/1123282995.db2.gz ZIBUREWRPJOVML-UADZTWIMSA-N 2 0 355.570 4.036 20 0 FIADRP C[N@H+](CCCN[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1)C1CCCCC1 ZINC000499149208 1123292852 /nfs/dbraw/zinc/29/28/52/1123292852.db2.gz SKCNAQVXQFEZOV-ULPXVVAUSA-N 2 0 369.597 4.426 20 0 FIADRP C[C@@H]1CCC[C@@H](C)[NH+]1CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499152531 1123294858 /nfs/dbraw/zinc/29/48/58/1123294858.db2.gz OWMDJYOIAWOYHL-MRWXXAKJSA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H](COc1cccc(F)c1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499159599 1123299535 /nfs/dbraw/zinc/29/95/35/1123299535.db2.gz VRKNKJOJRZMVDW-MVWVFHAYSA-N 2 0 368.496 4.378 20 0 FIADRP COc1cc(C)cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499196957 1123316315 /nfs/dbraw/zinc/31/63/15/1123316315.db2.gz SUZWYTNSYUEREU-KOUNCHBCSA-N 2 0 350.506 4.289 20 0 FIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccc(F)cc1 ZINC000499250181 1123358270 /nfs/dbraw/zinc/35/82/70/1123358270.db2.gz LTXODGDYFUCAJX-CIQXWFTPSA-N 2 0 368.496 4.378 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000132872697 1123374199 /nfs/dbraw/zinc/37/41/99/1123374199.db2.gz CEILDLNGWMETFM-QGZVFWFLSA-N 2 0 355.448 4.189 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000132882418 1123376064 /nfs/dbraw/zinc/37/60/64/1123376064.db2.gz UMZPIJBVVYCSNL-WMLDXEAASA-N 2 0 355.448 4.188 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000133524586 1123496069 /nfs/dbraw/zinc/49/60/69/1123496069.db2.gz PGIAEJVMFWCENG-LAUBAEHRSA-N 2 0 354.494 4.192 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2C)C1 ZINC000236871055 1123580224 /nfs/dbraw/zinc/58/02/24/1123580224.db2.gz RNDZXKCMQJVWTR-HXUWFJFHSA-N 2 0 374.532 4.279 20 0 FIADRP CC[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C1 ZINC000236965877 1123586452 /nfs/dbraw/zinc/58/64/52/1123586452.db2.gz HTUVPGWDTOABBD-TZIWHRDSSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccc(OCCC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000078704697 1123800428 /nfs/dbraw/zinc/80/04/28/1123800428.db2.gz PDCRYLAKVAUYFM-VQTJNVASSA-N 2 0 360.542 4.051 20 0 FIADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc(C)c1OCc1ccccn1 ZINC000237572226 1123986999 /nfs/dbraw/zinc/98/69/99/1123986999.db2.gz ZGHDHYOVUNDBNY-GOSISDBHSA-N 2 0 367.537 4.099 20 0 FIADRP OCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000245637118 1124155296 /nfs/dbraw/zinc/15/52/96/1124155296.db2.gz ABHHSDSSSPMOLG-GPJHCHHRSA-N 2 0 356.554 4.103 20 0 FIADRP OCC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000245637122 1124156038 /nfs/dbraw/zinc/15/60/38/1124156038.db2.gz ABHHSDSSSPMOLG-KAOXLYBCSA-N 2 0 356.554 4.103 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)C1CCC(C(F)(F)F)CC1 ZINC000474477007 1124173724 /nfs/dbraw/zinc/17/37/24/1124173724.db2.gz YQDOABXZVCNCGW-FAEJEUNOSA-N 2 0 372.475 4.474 20 0 FIADRP Cc1nc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1C ZINC000245752884 1124240320 /nfs/dbraw/zinc/24/03/20/1124240320.db2.gz UINMQDREPVZTRT-ACDBMABISA-N 2 0 355.551 4.088 20 0 FIADRP COc1ccc([C@@H](NC[C@H]2CCC[N@H+](C)C2)c2ccccc2Cl)cc1 ZINC000245885416 1124272017 /nfs/dbraw/zinc/27/20/17/1124272017.db2.gz BPQJUGROGFRRJI-IIBYNOLFSA-N 2 0 358.913 4.369 20 0 FIADRP C[C@@H](C[C@@H]1CCOC1)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000765895172 1124338861 /nfs/dbraw/zinc/33/88/61/1124338861.db2.gz DEPHBIIWYIRHJG-REWPJTCUSA-N 2 0 358.570 4.126 20 0 FIADRP CC(C)COc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000246300981 1124439377 /nfs/dbraw/zinc/43/93/77/1124439377.db2.gz DAWHEUAAUNYBGT-CDNPAEQRSA-N 2 0 374.569 4.140 20 0 FIADRP CCCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1 ZINC000542846114 1124442981 /nfs/dbraw/zinc/44/29/81/1124442981.db2.gz JWAVGAPXJVDRGJ-XZOQPEGZSA-N 2 0 352.522 4.274 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc2ccccc21 ZINC000246364139 1124469653 /nfs/dbraw/zinc/46/96/53/1124469653.db2.gz ITQAJCZDAJYIBS-JJEOQYAHSA-N 2 0 352.522 4.258 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccnn1C1CCC1 ZINC000921775129 1124597381 /nfs/dbraw/zinc/59/73/81/1124597381.db2.gz QHUQFAPJLSIEMX-UHFFFAOYSA-N 2 0 364.493 4.123 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000248403795 1124762426 /nfs/dbraw/zinc/76/24/26/1124762426.db2.gz PDHLEFUGGIWOCK-SQNIBIBYSA-N 2 0 360.542 4.316 20 0 FIADRP Fc1cccc2c1OCC[C@@H]2N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248753995 1124810203 /nfs/dbraw/zinc/81/02/03/1124810203.db2.gz CLBLVHIHZKNWGO-WEMPKCCASA-N 2 0 366.480 4.435 20 0 FIADRP COc1cccc(-c2nc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000649417753 1124841737 /nfs/dbraw/zinc/84/17/37/1124841737.db2.gz DIRWBZARQDDIPJ-QZTJIDSGSA-N 2 0 371.550 4.030 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000249145005 1124846306 /nfs/dbraw/zinc/84/63/06/1124846306.db2.gz WQNGHFOKUFLRJR-LEHRLTEOSA-N 2 0 356.554 4.082 20 0 FIADRP COc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@H]4CCC[C@H](C)C4)CC3)c21 ZINC000181331805 1124862113 /nfs/dbraw/zinc/86/21/13/1124862113.db2.gz GCZGWFQZEAUQIE-PXNSSMCTSA-N 2 0 369.553 4.352 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000089695975 1124928483 /nfs/dbraw/zinc/92/84/83/1124928483.db2.gz MRZYOKLTNGDNGM-GTNSWQLSSA-N 2 0 369.734 4.164 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1 ZINC000090524997 1125001910 /nfs/dbraw/zinc/00/19/10/1125001910.db2.gz UPIIHTRZCIDING-JVPBZIDWSA-N 2 0 370.459 4.124 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285598 1125062010 /nfs/dbraw/zinc/06/20/10/1125062010.db2.gz ZIBDMCHFEGEQOX-VQIMIIECSA-N 2 0 371.491 4.018 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C(C)C)cc1 ZINC000091372377 1125069088 /nfs/dbraw/zinc/06/90/88/1125069088.db2.gz LEWGRALAGUMVNR-QFIPXVFZSA-N 2 0 353.510 4.294 20 0 FIADRP CCC[C@H](C[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1)c1ccccc1 ZINC000252733959 1125102570 /nfs/dbraw/zinc/10/25/70/1125102570.db2.gz XPRIWCKJRQTAIN-MQSCRBSSSA-N 2 0 357.586 4.061 20 0 FIADRP Cc1nc(F)ccc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000785459370 1125205143 /nfs/dbraw/zinc/20/51/43/1125205143.db2.gz DXSWBCKPHBBJBA-UHFFFAOYSA-N 2 0 369.528 4.354 20 0 FIADRP COCCc1nc(C)c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)s1 ZINC000092766905 1125241762 /nfs/dbraw/zinc/24/17/62/1125241762.db2.gz PIDAJOURXSRJFT-INIZCTEOSA-N 2 0 367.603 4.049 20 0 FIADRP Cc1cc(C)c(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1C ZINC000303288065 568264476 /nfs/dbraw/zinc/26/44/76/568264476.db2.gz NQBWGYKVLHDSBH-IBGZPJMESA-N 2 0 369.528 4.354 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1)C(C)C ZINC000604726811 568353416 /nfs/dbraw/zinc/35/34/16/568353416.db2.gz SCHMMOAHWSGUQK-FQEVSTJZSA-N 2 0 361.574 4.013 20 0 FIADRP CC(C)COC1CC[NH+](CC[C@@H](C)[NH+]2CCC(OCC(C)C)CC2)CC1 ZINC000431603376 568383011 /nfs/dbraw/zinc/38/30/11/568383011.db2.gz ITLLMRKWOHGKJO-HXUWFJFHSA-N 2 0 368.606 4.039 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1c(C)nc2sc(C)cn12 ZINC000236910467 568498999 /nfs/dbraw/zinc/49/89/99/568498999.db2.gz RKILRNZEEXJWDT-UHFFFAOYSA-N 2 0 356.539 4.144 20 0 FIADRP CN1CCC[C@@H](C[NH2+]Cc2ccncc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605165438 568593839 /nfs/dbraw/zinc/59/38/39/568593839.db2.gz BRFZNWCVWXGTGI-PKOBYXMFSA-N 2 0 363.427 4.273 20 0 FIADRP c1ccc2c(c1)SC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605165964 568594273 /nfs/dbraw/zinc/59/42/73/568594273.db2.gz JAWGPBUVQNIGGR-HXUWFJFHSA-N 2 0 354.519 4.098 20 0 FIADRP COc1cc[nH+]c(N2CCC3(CC2)CC[NH+](Cc2ccc(C)cc2)CC3)c1 ZINC001164767505 721041834 /nfs/dbraw/zinc/04/18/34/721041834.db2.gz SAGXFEFWHOFJPF-UHFFFAOYSA-N 2 0 365.521 4.281 20 0 FIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@H]2CC[NH+]2CCCC2)nc1 ZINC001165049186 721978321 /nfs/dbraw/zinc/97/83/21/721978321.db2.gz ICDNWORHQYDHTF-VXKWHMMOSA-N 2 0 370.585 4.473 20 0 FIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCC([NH+](CC)CC)CC2)nc1 ZINC001165054693 722007502 /nfs/dbraw/zinc/00/75/02/722007502.db2.gz YFIGXFDCYZJKLV-OAQYLSRUSA-N 2 0 358.574 4.329 20 0 FIADRP Cc1[nH+]c(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)cc2[nH]ccc21 ZINC001164995389 722206753 /nfs/dbraw/zinc/20/67/53/722206753.db2.gz NFEBGDUERRQHGM-JOCHJYFZSA-N 2 0 364.468 4.255 20 0 FIADRP Fc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000152765723 1125649186 /nfs/dbraw/zinc/64/91/86/1125649186.db2.gz QNWKHKQDYZTTGD-SFHVURJKSA-N 2 0 359.533 4.039 20 0 FIADRP CC[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1cccc(Br)c1 ZINC000152811900 1125659451 /nfs/dbraw/zinc/65/94/51/1125659451.db2.gz NCKNSJGBHANCAH-QGZVFWFLSA-N 2 0 362.315 4.265 20 0 FIADRP Cc1cccc(OC[C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000619766610 1125687974 /nfs/dbraw/zinc/68/79/74/1125687974.db2.gz JYCYHHHTFPLFGS-HXUWFJFHSA-N 2 0 368.521 4.027 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3cccc(F)c3)cc2)C1 ZINC000619772532 1125701163 /nfs/dbraw/zinc/70/11/63/1125701163.db2.gz MIKHQTPSFSRMMZ-HXUWFJFHSA-N 2 0 356.485 4.226 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000579744265 1079607395 /nfs/dbraw/zinc/60/73/95/1079607395.db2.gz YGCGUXVJAZVIFV-HZSPNIEDSA-N 2 0 371.388 4.251 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccccn1 ZINC000179465856 1080181471 /nfs/dbraw/zinc/18/14/71/1080181471.db2.gz AUNITNQZLSDJTR-KNKQGSTJSA-N 2 0 367.537 4.322 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000180109078 1080449134 /nfs/dbraw/zinc/44/91/34/1080449134.db2.gz YUYMYGKGEZRZOA-JOCHJYFZSA-N 2 0 371.956 4.047 20 0 FIADRP c1ccc([C@@H]2C[C@@H]2C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000236654530 1080885076 /nfs/dbraw/zinc/88/50/76/1080885076.db2.gz DGGPFUWEAJDUKC-GGAORHGYSA-N 2 0 350.506 4.055 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC2 ZINC000651959341 1080963174 /nfs/dbraw/zinc/96/31/74/1080963174.db2.gz ISXNVCUUHWVDPV-HSZRJFAPSA-N 2 0 363.549 4.303 20 0 FIADRP CCC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397492850 1081000257 /nfs/dbraw/zinc/00/02/57/1081000257.db2.gz MJDYJKAAQIRFQE-JOCHJYFZSA-N 2 0 352.522 4.145 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cn(C)nc1C1CCCC1 ZINC001648805467 1081001575 /nfs/dbraw/zinc/00/15/75/1081001575.db2.gz RYFSBJXHRDMKLQ-UHFFFAOYSA-N 2 0 354.542 4.208 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000655804374 1081213901 /nfs/dbraw/zinc/21/39/01/1081213901.db2.gz WUOYDRSBDTZFMB-BEVDRBHNSA-N 2 0 373.338 4.468 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]C3CCC(C(C)C)CC3)cc2)CC1 ZINC001648814446 1081219710 /nfs/dbraw/zinc/21/97/10/1081219710.db2.gz MOEWBVPJQPSQAQ-UHFFFAOYSA-N 2 0 357.586 4.129 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc2c(cnn2C(C)C)c1 ZINC000530952995 1081227203 /nfs/dbraw/zinc/22/72/03/1081227203.db2.gz LWVRSPIOYMVOOY-ICSRJNTNSA-N 2 0 357.546 4.002 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCc2ccc(F)c(F)c2)CC1 ZINC001167306912 1081244484 /nfs/dbraw/zinc/24/44/84/1081244484.db2.gz LWHSBWZTGKDJPB-UHFFFAOYSA-N 2 0 358.476 4.351 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc3c(c2)OCCCCO3)c1 ZINC001648826433 1081258859 /nfs/dbraw/zinc/25/88/59/1081258859.db2.gz GUFNGWGYJFSFIJ-UHFFFAOYSA-N 2 0 368.521 4.370 20 0 FIADRP Clc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000397623084 1081327771 /nfs/dbraw/zinc/32/77/71/1081327771.db2.gz JPSCRMJIPSAQRR-JOCHJYFZSA-N 2 0 354.925 4.309 20 0 FIADRP C[C@H](C[NH2+]CC(C)(C)c1ccc(Br)cc1)N1CCCCC1 ZINC001648889268 1081343944 /nfs/dbraw/zinc/34/39/44/1081343944.db2.gz OJGBPAOYQGHPOS-OAHLLOKOSA-N 2 0 353.348 4.191 20 0 FIADRP O[C@@H](C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1cccc2ccccc21 ZINC001167325465 1081403917 /nfs/dbraw/zinc/40/39/17/1081403917.db2.gz BTXVABYKOHKMRM-YKSBVNFPSA-N 2 0 366.549 4.461 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000580073578 1081571880 /nfs/dbraw/zinc/57/18/80/1081571880.db2.gz PDWQHMHLULWPRQ-NRFANRHFSA-N 2 0 359.517 4.497 20 0 FIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000312698466 1081594787 /nfs/dbraw/zinc/59/47/87/1081594787.db2.gz RFMYCAXVHFILTL-TZIWHRDSSA-N 2 0 368.521 4.267 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cnc(-c3ccncc3)s2)c1 ZINC000580109856 1081602407 /nfs/dbraw/zinc/60/24/07/1081602407.db2.gz VDLVVSYRKFHADN-UHFFFAOYSA-N 2 0 366.534 4.337 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000580226549 1081764420 /nfs/dbraw/zinc/76/44/20/1081764420.db2.gz JLYXNLJFMKAMHM-CVDCTZTESA-N 2 0 367.537 4.228 20 0 FIADRP Brc1ccccc1[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccccc1 ZINC000564822308 1081905428 /nfs/dbraw/zinc/90/54/28/1081905428.db2.gz KNKLVWDGKRNZGC-LJQANCHMSA-N 2 0 359.311 4.128 20 0 FIADRP C[C@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Br)cn1 ZINC000580749361 1082120714 /nfs/dbraw/zinc/12/07/14/1082120714.db2.gz YKAMISSRJBZNIV-HNNXBMFYSA-N 2 0 374.326 4.291 20 0 FIADRP CC[N@H+](Cc1cn(C)nc1-c1ccccc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000580801364 1082143115 /nfs/dbraw/zinc/14/31/15/1082143115.db2.gz FMRDWJYTFZXIPJ-UHFFFAOYSA-N 2 0 362.521 4.171 20 0 FIADRP Cc1cc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)ccc1Oc1cccnc1 ZINC000581131566 1082332956 /nfs/dbraw/zinc/33/29/56/1082332956.db2.gz LMBZHBOODSWZSP-HXUWFJFHSA-N 2 0 351.494 4.004 20 0 FIADRP CCCOc1ccc(Br)cc1C[NH2+]CC1CC[NH+](CC)CC1 ZINC000065996813 1082501002 /nfs/dbraw/zinc/50/10/02/1082501002.db2.gz LFERHLBYNGOLBW-UHFFFAOYSA-N 2 0 369.347 4.059 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000430581507 1082519034 /nfs/dbraw/zinc/51/90/34/1082519034.db2.gz OQWCGICURZOUTO-QKLQHJQFSA-N 2 0 351.494 4.059 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000430581509 1082519310 /nfs/dbraw/zinc/51/93/10/1082519310.db2.gz OQWCGICURZOUTO-SQGPQFPESA-N 2 0 351.494 4.059 20 0 FIADRP C[NH+](C)CCc1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000581489005 1082617760 /nfs/dbraw/zinc/61/77/60/1082617760.db2.gz JJNFSBKKKPZMJW-QHCPKHFHSA-N 2 0 363.549 4.400 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC(F)(F)CC2)cc1OC ZINC000647172484 1082792329 /nfs/dbraw/zinc/79/23/29/1082792329.db2.gz YALHVLYITBCBGZ-UHFFFAOYSA-N 2 0 370.484 4.083 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)CC1 ZINC000430764093 1083157314 /nfs/dbraw/zinc/15/73/14/1083157314.db2.gz RKYUSXHIHLAITL-KOMQPUFPSA-N 2 0 369.322 4.297 20 0 FIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000510686179 1083238521 /nfs/dbraw/zinc/23/85/21/1083238521.db2.gz UOEKMHJPBBWAJD-RBBKRZOGSA-N 2 0 361.549 4.097 20 0 FIADRP FCCC[C@H]1CCC[C@H]1[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000510686176 1083238627 /nfs/dbraw/zinc/23/86/27/1083238627.db2.gz UOEKMHJPBBWAJD-IFMALSPDSA-N 2 0 361.549 4.097 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)[NH+]2CCC([C@H](C)[NH3+])CC2)c1 ZINC000430965539 1083260619 /nfs/dbraw/zinc/26/06/19/1083260619.db2.gz KEIGURBZBPIYQS-AVRDEDQJSA-N 2 0 365.521 4.042 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CCc2c(F)cccc2F)[C@@H](C)C1 ZINC000510755981 1083294074 /nfs/dbraw/zinc/29/40/74/1083294074.db2.gz YBCJJTCTYQCYMR-FIKGOQFSSA-N 2 0 368.512 4.013 20 0 FIADRP COc1cccc(C2([NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)CCC2)c1 ZINC000658324186 1083409949 /nfs/dbraw/zinc/40/99/49/1083409949.db2.gz ZMCXJFKVYGTTSS-SFHVURJKSA-N 2 0 368.521 4.366 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCc3cccnc3CC2)C[N@@H+]1Cc1ccccc1 ZINC000421836285 1083433006 /nfs/dbraw/zinc/43/30/06/1083433006.db2.gz ODSQKONXIQMAAG-NWSQWKLXSA-N 2 0 363.549 4.219 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cnc(CC(F)(F)F)s2)cc1 ZINC000892460595 1083521393 /nfs/dbraw/zinc/52/13/93/1083521393.db2.gz PTCCUUALWFOFEM-UHFFFAOYSA-N 2 0 371.472 4.380 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3Cl)C2)[C@@H](C)C1 ZINC000510979877 1083555205 /nfs/dbraw/zinc/55/52/05/1083555205.db2.gz FSHYRVLFJBIYCQ-GHQDRPGLSA-N 2 0 364.961 4.313 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(Cl)c(F)c1 ZINC000535778223 1083652477 /nfs/dbraw/zinc/65/24/77/1083652477.db2.gz QJMXFVWUZLFZGB-CQSZACIVSA-N 2 0 350.865 4.270 20 0 FIADRP Cc1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1Oc1cccnc1 ZINC000535806064 1083692372 /nfs/dbraw/zinc/69/23/72/1083692372.db2.gz CFXDUBRQECAMSL-FPOVZHCZSA-N 2 0 351.494 4.098 20 0 FIADRP COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000163341522 1083816045 /nfs/dbraw/zinc/81/60/45/1083816045.db2.gz FQRWBBSEDOUBIE-HOTGVXAUSA-N 2 0 360.473 4.187 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC000215636648 1083907822 /nfs/dbraw/zinc/90/78/22/1083907822.db2.gz SWIFNNVVBPMHBR-AWEZNQCLSA-N 2 0 365.949 4.264 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000382384490 1084129237 /nfs/dbraw/zinc/12/92/37/1084129237.db2.gz SDBDFIMOLWISRV-DHIUTWEWSA-N 2 0 350.506 4.184 20 0 FIADRP CC[C@H]1C[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC[C@H]1[NH3+] ZINC000647497904 1084249723 /nfs/dbraw/zinc/24/97/23/1084249723.db2.gz ZZNGQAQSODNMGM-OXJNMPFZSA-N 2 0 371.912 4.152 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2ccnn2CC2CC2)cc1 ZINC000657302967 1084332321 /nfs/dbraw/zinc/33/23/21/1084332321.db2.gz IILZBHZBLNSNDP-UHFFFAOYSA-N 2 0 374.532 4.312 20 0 FIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000466923087 1084368536 /nfs/dbraw/zinc/36/85/36/1084368536.db2.gz IKAVAZVUWPHOMA-LJQANCHMSA-N 2 0 352.522 4.478 20 0 FIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000472509432 1084369233 /nfs/dbraw/zinc/36/92/33/1084369233.db2.gz XSQWIOCWLQUXQQ-KRWDZBQOSA-N 2 0 370.459 4.138 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@H]3CCCC[NH+]3C)cc2)C1 ZINC000431755847 1084408954 /nfs/dbraw/zinc/40/89/54/1084408954.db2.gz DWRSWJJOIHACBY-WIYYLYMNSA-N 2 0 357.542 4.122 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2c(C3CCC3)cnn2C)CC1 ZINC000657310696 1084413137 /nfs/dbraw/zinc/41/31/37/1084413137.db2.gz REVCBYJMLQVPLF-UHFFFAOYSA-N 2 0 366.553 4.209 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1c(C2CCC2)cnn1C ZINC000657311785 1084436006 /nfs/dbraw/zinc/43/60/06/1084436006.db2.gz VDEWCKOBHJOWQN-GOSISDBHSA-N 2 0 366.553 4.352 20 0 FIADRP C[N@@H+](Cc1ccc(Cl)cc1OC(F)(F)F)CC1CC[NH+](C)CC1 ZINC001143433491 1084496170 /nfs/dbraw/zinc/49/61/70/1084496170.db2.gz WWDGTYAJNREDOP-UHFFFAOYSA-N 2 0 350.812 4.012 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000072085635 1084655093 /nfs/dbraw/zinc/65/50/93/1084655093.db2.gz BCVFGDZCVQNRNK-KDURUIRLSA-N 2 0 352.522 4.161 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3c(C4CCC4)cnn3C)c2)CC1 ZINC000657349348 1084683863 /nfs/dbraw/zinc/68/38/63/1084683863.db2.gz QSHHMKBYOPSXAA-UHFFFAOYSA-N 2 0 366.553 4.209 20 0 FIADRP Fc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c2ncccc12 ZINC000613421385 1084712753 /nfs/dbraw/zinc/71/27/53/1084712753.db2.gz RJTGMJDSAWFLPM-UHFFFAOYSA-N 2 0 355.501 4.462 20 0 FIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000414184549 1084762017 /nfs/dbraw/zinc/76/20/17/1084762017.db2.gz NZDMNHRDGNXDMQ-LAUBAEHRSA-N 2 0 357.929 4.340 20 0 FIADRP C(CC[N@@H+]1CCC[C@]2(CCSC2)C1)C[NH+]1CCC[C@]2(CCSC2)C1 ZINC000582282488 1084829074 /nfs/dbraw/zinc/82/90/74/1084829074.db2.gz BBHBONBWBBXEHV-PMACEKPBSA-N 2 0 368.656 4.205 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@H]1CN(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167573361 1084992228 /nfs/dbraw/zinc/99/22/28/1084992228.db2.gz VKNLBHHDVKEEFE-MZYLBHOOSA-N 2 0 357.586 4.234 20 0 FIADRP C[C@H](CCOCc1ccccc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000582438745 1084999865 /nfs/dbraw/zinc/99/98/65/1084999865.db2.gz BBPHOFHFLGNGJW-PQNGQFLHSA-N 2 0 366.549 4.482 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cnc(CC(F)(F)F)s2)c1 ZINC000892612670 1085054244 /nfs/dbraw/zinc/05/42/44/1085054244.db2.gz LETZQHBOUZSENI-UHFFFAOYSA-N 2 0 371.472 4.380 20 0 FIADRP CO[C@@H](C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000549065107 1085067471 /nfs/dbraw/zinc/06/74/71/1085067471.db2.gz HZKAGCTVYCNFMN-QFIPXVFZSA-N 2 0 353.510 4.008 20 0 FIADRP c1ccc(C2CC([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)C2)cc1 ZINC000684931717 1085214333 /nfs/dbraw/zinc/21/43/33/1085214333.db2.gz BWDUJFJBPVWIBY-UHFFFAOYSA-N 2 0 350.506 4.197 20 0 FIADRP Clc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)cs2)cc1 ZINC000564973402 1085221951 /nfs/dbraw/zinc/22/19/51/1085221951.db2.gz HMGKDMGFBZAZRM-MRXNPFEDSA-N 2 0 361.942 4.285 20 0 FIADRP COc1cc(OC)c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1F ZINC000651670064 1085318196 /nfs/dbraw/zinc/31/81/96/1085318196.db2.gz SRZMKZMBCNEXAH-UHFFFAOYSA-N 2 0 372.484 4.119 20 0 FIADRP COCc1ccc(C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000549549503 1085672809 /nfs/dbraw/zinc/67/28/09/1085672809.db2.gz UDVDABGUWCVAKZ-RTBURBONSA-N 2 0 352.522 4.079 20 0 FIADRP c1ccc(C[C@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613836 1085700227 /nfs/dbraw/zinc/70/02/27/1085700227.db2.gz SLNIOOQVXKYVAX-RPWUZVMVSA-N 2 0 363.549 4.295 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347826 1085918805 /nfs/dbraw/zinc/91/88/05/1085918805.db2.gz MVCNFROEBZHNDE-VAGZCVSGSA-N 2 0 357.325 4.273 20 0 FIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(OCc4ccc(F)cc4)cc3)CC[C@@H]21 ZINC001167648333 1086030236 /nfs/dbraw/zinc/03/02/36/1086030236.db2.gz SMCFXJIYYUDDTP-REWPJTCUSA-N 2 0 368.496 4.321 20 0 FIADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000583063422 1086131207 /nfs/dbraw/zinc/13/12/07/1086131207.db2.gz SQKIQLDLPRJDCW-UGKGYDQZSA-N 2 0 350.506 4.184 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1C ZINC000248451392 1086169022 /nfs/dbraw/zinc/16/90/22/1086169022.db2.gz PILGECBPRQWEKI-DENIHFKCSA-N 2 0 352.522 4.029 20 0 FIADRP C[C@H](CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000249053749 1086183299 /nfs/dbraw/zinc/18/32/99/1086183299.db2.gz YCEMTOUNKUBYPY-XBYSBRQOSA-N 2 0 355.570 4.036 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+]([C@@H](C(=O)OC(C)(C)C)C2CC2)CC1 ZINC001167658707 1086388157 /nfs/dbraw/zinc/38/81/57/1086388157.db2.gz KOWORSNPDQJQNL-FXAWDEMLSA-N 2 0 364.574 4.083 20 0 FIADRP c1ccc(Oc2cccnc2)c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000662294207 1086398498 /nfs/dbraw/zinc/39/84/98/1086398498.db2.gz PUFJFIKFTAKLEA-LJQANCHMSA-N 2 0 351.494 4.086 20 0 FIADRP c1ccc(-c2nc3c(s2)C[N@H+](Cc2cccc4c2CC[NH2+]C4)CC3)cc1 ZINC000662304433 1086404650 /nfs/dbraw/zinc/40/46/50/1086404650.db2.gz IRGKRLCIMPJZES-UHFFFAOYSA-N 2 0 361.514 4.014 20 0 FIADRP Cc1cccc([C@H](C)[NH+]2CCC(c3cc(C4CC[NH2+]CC4)[nH]n3)CC2)c1 ZINC000662327730 1086418797 /nfs/dbraw/zinc/41/87/97/1086418797.db2.gz UIYFHJHKJLRKTH-KRWDZBQOSA-N 2 0 352.526 4.126 20 0 FIADRP C[C@H](c1cccc(Cl)c1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327351 1086418987 /nfs/dbraw/zinc/41/89/87/1086418987.db2.gz OEZJSBINPPYJCC-OAHLLOKOSA-N 2 0 372.944 4.471 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)C[C@H]3[NH2+]Cc4ccccc43)cc2)CC1 ZINC000662387512 1086428410 /nfs/dbraw/zinc/42/84/10/1086428410.db2.gz GXSXGLYROWQQRG-JOCHJYFZSA-N 2 0 363.505 4.092 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc3c(s2)CC[NH2+]C3)cc1 ZINC000662389025 1086429136 /nfs/dbraw/zinc/42/91/36/1086429136.db2.gz WRCHBDFNNRWMCD-OAHLLOKOSA-N 2 0 369.534 4.021 20 0 FIADRP C[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1OC(F)F ZINC000663468201 1086571576 /nfs/dbraw/zinc/57/15/76/1086571576.db2.gz KEXYRMCICPRMFR-HIFRSBDPSA-N 2 0 356.432 4.200 20 0 FIADRP COc1cc(OC)c([C@@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663470148 1086574278 /nfs/dbraw/zinc/57/42/78/1086574278.db2.gz SLVMTBFLJAEBOB-GDBMZVCRSA-N 2 0 366.933 4.130 20 0 FIADRP CC(C)(C)[N@@H+]1CC[C@](F)(c2nc(-c3cccc(C[NH+]4CCCC4)c3)no2)C1 ZINC000583351593 1086597328 /nfs/dbraw/zinc/59/73/28/1086597328.db2.gz HDMMSSOGQRWJGA-OAQYLSRUSA-N 2 0 372.488 4.001 20 0 FIADRP CC[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000319533293 1086601077 /nfs/dbraw/zinc/60/10/77/1086601077.db2.gz BCNZSTOEAZRSTP-QGZVFWFLSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000663500979 1086611409 /nfs/dbraw/zinc/61/14/09/1086611409.db2.gz XHKNSGSIRIVBJA-LJQANCHMSA-N 2 0 359.901 4.055 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC([N@H+](CC)Cc2ccccc2)CC1 ZINC001167826534 1086616871 /nfs/dbraw/zinc/61/68/71/1086616871.db2.gz PTTVOPNKYQIHJD-OAQYLSRUSA-N 3 0 359.602 4.483 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@H]1c1ccc(OC)cc1 ZINC001167827195 1086621003 /nfs/dbraw/zinc/62/10/03/1086621003.db2.gz UQHJDEKRGJYCBQ-PXNSSMCTSA-N 2 0 350.572 4.296 20 0 FIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000092759085 1086626519 /nfs/dbraw/zinc/62/65/19/1086626519.db2.gz TZUORZQCNRJCIS-UHFFFAOYSA-N 2 0 372.553 4.085 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@@H]1c1cccc(OC)c1 ZINC001167833643 1086666823 /nfs/dbraw/zinc/66/68/23/1086666823.db2.gz CUQOQHKAGRFKSK-FXAWDEMLSA-N 2 0 350.572 4.296 20 0 FIADRP CCOC(=O)CCC[N@H+](Cc1ccccc1)[C@@H](C)CCC[NH+](CC)CC ZINC001167833638 1086668245 /nfs/dbraw/zinc/66/82/45/1086668245.db2.gz CTOPISOBMPLKES-FQEVSTJZSA-N 2 0 362.558 4.342 20 0 FIADRP Cc1noc(C)c1[C@H](C)[NH2+]CCC(C)CC[NH2+][C@@H](C)c1c(C)noc1C ZINC000663597660 1086695017 /nfs/dbraw/zinc/69/50/17/1086695017.db2.gz FXWSODXPEBRGGR-KBPBESRZSA-N 2 0 362.518 4.314 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](Cc1cccc(OC)c1)[C@@H](C)COC ZINC001167838059 1086711773 /nfs/dbraw/zinc/71/17/73/1086711773.db2.gz PFQUNHFSYJSECK-MOPGFXCFSA-N 2 0 350.547 4.043 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2cccc(C(=O)OC)c2)CC1 ZINC001167840086 1086718730 /nfs/dbraw/zinc/71/87/30/1086718730.db2.gz DSGCVXCUCYUIHJ-SFHVURJKSA-N 2 0 360.542 4.163 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N(C)Cc2cccc(F)c2)CC1 ZINC001167840671 1086726741 /nfs/dbraw/zinc/72/67/41/1086726741.db2.gz HLNAGCOWXKPYDF-IBGZPJMESA-N 2 0 363.565 4.232 20 0 FIADRP Cn1ccnc1[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CC1 ZINC000127564477 1086734061 /nfs/dbraw/zinc/73/40/61/1086734061.db2.gz AANVBXDJWBZPQO-HSZRJFAPSA-N 2 0 374.532 4.390 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H]2CCCSc3ccc(Cl)cc32)CCCO1 ZINC000432416900 1086742285 /nfs/dbraw/zinc/74/22/85/1086742285.db2.gz JJMHIDIIPOLLET-YJBOKZPZSA-N 2 0 368.974 4.358 20 0 FIADRP CCOc1cc2c(cc1OCC)C[N@@H+]([C@@H](C)CCC[NH+](CC)CC)CC2 ZINC001167842006 1086742430 /nfs/dbraw/zinc/74/24/30/1086742430.db2.gz VPGDQFSBRUDXKY-SFHVURJKSA-N 2 0 362.558 4.353 20 0 FIADRP Brc1cccc(C2CC([NH2+]C3CC[NH+](C4CCC4)CC3)C2)c1 ZINC000432423425 1086751969 /nfs/dbraw/zinc/75/19/69/1086751969.db2.gz XVZHNIMFTMYMEF-UHFFFAOYSA-N 2 0 363.343 4.302 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccc(Cl)cc4)o3)C2)C1 ZINC000650706237 1086753758 /nfs/dbraw/zinc/75/37/58/1086753758.db2.gz GUOVMBVTCCDVLQ-HGHGUNKESA-N 2 0 374.912 4.318 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(Br)cc1SC ZINC000650719102 1086800781 /nfs/dbraw/zinc/80/07/81/1086800781.db2.gz DAWWJMNLMBSLHR-UHFFFAOYSA-N 2 0 365.340 4.180 20 0 FIADRP CCC1(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCOCC1 ZINC000657771796 1086820953 /nfs/dbraw/zinc/82/09/53/1086820953.db2.gz GHBSADMVUYWFMB-OAQYLSRUSA-N 2 0 356.554 4.085 20 0 FIADRP Cn1cncc1CCC[NH2+][C@H]1c2cc(Br)ccc2CC1(C)C ZINC000583639115 1086886479 /nfs/dbraw/zinc/88/64/79/1086886479.db2.gz WKUNAQOEPLMCHZ-KRWDZBQOSA-N 2 0 362.315 4.028 20 0 FIADRP CC(C)C(C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C(C)C ZINC000583644325 1086892612 /nfs/dbraw/zinc/89/26/12/1086892612.db2.gz YUQQGXFCUBCEFA-JOCHJYFZSA-N 2 0 372.597 4.433 20 0 FIADRP CCOCc1cc(CN2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)ccc1OC ZINC000512180278 1086903695 /nfs/dbraw/zinc/90/36/95/1086903695.db2.gz NSIMXWFLZBMYSZ-NRFANRHFSA-N 2 0 374.569 4.176 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)CNC1CC([NH+]2CCCCC2)C1 ZINC000583663143 1086906176 /nfs/dbraw/zinc/90/61/76/1086906176.db2.gz PJBPREIITWWJTG-RVDMUPIBSA-N 2 0 350.453 4.298 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccncc1 ZINC000647302717 1086909126 /nfs/dbraw/zinc/90/91/26/1086909126.db2.gz NNMZVBPIOMQAPP-QHCPKHFHSA-N 2 0 367.537 4.432 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000650757040 1086969448 /nfs/dbraw/zinc/96/94/48/1086969448.db2.gz NNBHWRSFMBMWIN-QFIPXVFZSA-N 2 0 350.506 4.288 20 0 FIADRP C[C@H]([NH2+]CCCn1ccnc1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000151159221 1086975104 /nfs/dbraw/zinc/97/51/04/1086975104.db2.gz PVOXMGRLJJXTRB-KRWDZBQOSA-N 2 0 353.441 4.342 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2-c2cccs2)CC1)CC1CC1 ZINC000536141421 1086986897 /nfs/dbraw/zinc/98/68/97/1086986897.db2.gz RKDMNFIHSJKIMI-UHFFFAOYSA-N 2 0 372.582 4.472 20 0 FIADRP c1coc(COCc2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2)c1 ZINC000583928705 1087037273 /nfs/dbraw/zinc/03/72/73/1087037273.db2.gz ABPAVJVBVYFEBO-YTFSRNRJSA-N 2 0 368.521 4.397 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000151306864 1087085931 /nfs/dbraw/zinc/08/59/31/1087085931.db2.gz BCHHYGIZZMXVNR-KRWDZBQOSA-N 2 0 351.494 4.002 20 0 FIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCc3ncc(C)cc3C)C2)s1 ZINC000584354744 1087276707 /nfs/dbraw/zinc/27/67/07/1087276707.db2.gz WAWVMAGVDXTHJK-LJQANCHMSA-N 2 0 357.567 4.065 20 0 FIADRP CC(C)[C@H](Cc1ccc(Br)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657839828 1087282714 /nfs/dbraw/zinc/28/27/14/1087282714.db2.gz HKEKBJAXYOKRPX-OTWHNJEPSA-N 2 0 365.359 4.233 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000084018229 1087344687 /nfs/dbraw/zinc/34/46/87/1087344687.db2.gz JQVQJZPIVNLQHJ-CALCHBBNSA-N 2 0 365.587 4.170 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(CN3CCOCC3)cc2)C(C)C)cc1 ZINC000091265909 1087426445 /nfs/dbraw/zinc/42/64/45/1087426445.db2.gz YKQUIUCWYUPDCV-QHCPKHFHSA-N 2 0 368.521 4.014 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000091285132 1087427146 /nfs/dbraw/zinc/42/71/46/1087427146.db2.gz VEJBLSAUVHBJGI-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP CC[N@H+](Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H](C)c1cccnc1 ZINC000685469910 1087578294 /nfs/dbraw/zinc/57/82/94/1087578294.db2.gz NIIOGWZGQLMVGN-IBGZPJMESA-N 2 0 353.510 4.139 20 0 FIADRP CC(C)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cc(F)cc(Br)c1 ZINC000658046371 1087703814 /nfs/dbraw/zinc/70/38/14/1087703814.db2.gz KNRZSHCOEZWAQN-OAUYIBNBSA-N 2 0 357.311 4.215 20 0 FIADRP CCC[C@H](CCc1ccccc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067896 1087709758 /nfs/dbraw/zinc/70/97/58/1087709758.db2.gz RINVYKLGITZIBQ-JOCHJYFZSA-N 2 0 358.570 4.269 20 0 FIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658069964 1087711034 /nfs/dbraw/zinc/71/10/34/1087711034.db2.gz SHBJJIYOGIKYNW-KRWDZBQOSA-N 2 0 356.510 4.283 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(Cl)c1 ZINC000658144502 1087736387 /nfs/dbraw/zinc/73/63/87/1087736387.db2.gz MHNLDRQTEAYSBZ-SFTDATJTSA-N 2 0 358.913 4.148 20 0 FIADRP Cc1cc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)ccc1Oc1cccnc1 ZINC000414772266 1087739016 /nfs/dbraw/zinc/73/90/16/1087739016.db2.gz BOPVSHIKQGYFLG-VQTJNVASSA-N 2 0 351.494 4.004 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccs1 ZINC000658137524 1087742673 /nfs/dbraw/zinc/74/26/73/1087742673.db2.gz HIIJQMLYZJFJKB-UXHICEINSA-N 2 0 358.551 4.192 20 0 FIADRP CC1(C)CC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c2ccccc21 ZINC000658138413 1087744403 /nfs/dbraw/zinc/74/44/03/1087744403.db2.gz MXSKEEOFZTZICA-REWPJTCUSA-N 2 0 364.533 4.156 20 0 FIADRP C[C@H](Cc1coc2ccccc12)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658163178 1087758569 /nfs/dbraw/zinc/75/85/69/1087758569.db2.gz HXUZZJGRAWZXQS-GOSISDBHSA-N 2 0 363.505 4.261 20 0 FIADRP Cc1cccc(C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)c1 ZINC000658163780 1087759227 /nfs/dbraw/zinc/75/92/27/1087759227.db2.gz AZOYNZORPCEZNP-DEOSSOPVSA-N 2 0 363.549 4.213 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](Cc2ccncc2)c2cccs2)cc1 ZINC000424253437 1087873601 /nfs/dbraw/zinc/87/36/01/1087873601.db2.gz FQQUIXNALDAXEB-HXUWFJFHSA-N 2 0 351.519 4.278 20 0 FIADRP Cc1cc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)nc(-c2ccc(Cl)cc2)n1 ZINC000424289557 1087898807 /nfs/dbraw/zinc/89/88/07/1087898807.db2.gz LZARORJERRGFRV-MRXNPFEDSA-N 2 0 370.928 4.069 20 0 FIADRP C[C@H]1CC2(C[N@@H+]1Cc1csc(-c3ccc(Cl)cc3)n1)CC[NH2+]CC2 ZINC000424299974 1087904461 /nfs/dbraw/zinc/90/44/61/1087904461.db2.gz WIPQLYAIALFVON-AWEZNQCLSA-N 2 0 361.942 4.428 20 0 FIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000504900425 1087955809 /nfs/dbraw/zinc/95/58/09/1087955809.db2.gz XUJYDDZBNVXPAC-FPOVZHCZSA-N 2 0 355.570 4.083 20 0 FIADRP C[C@H](C[N@@H+]1CCCC12CC[NH+](C)CC2)c1cccc(Br)c1 ZINC000472598535 1087990605 /nfs/dbraw/zinc/99/06/05/1087990605.db2.gz LVUVOCSSFGFZMG-OAHLLOKOSA-N 2 0 351.332 4.113 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423366015 1088167940 /nfs/dbraw/zinc/16/79/40/1088167940.db2.gz BKYNCMGWLMZCGK-IBGZPJMESA-N 2 0 357.295 4.220 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CCC[C@H]([NH3+])C2)nc1 ZINC000423375653 1088181303 /nfs/dbraw/zinc/18/13/03/1088181303.db2.gz UOKGXUXBKOPVLY-BVSLBCMMSA-N 2 0 371.956 4.311 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)nc1 ZINC000423375655 1088182020 /nfs/dbraw/zinc/18/20/20/1088182020.db2.gz UOKGXUXBKOPVLY-HJNYFJLDSA-N 2 0 371.956 4.311 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OCCC(C)C ZINC000414811240 1088208700 /nfs/dbraw/zinc/20/87/00/1088208700.db2.gz PKMYILZNDNAMKZ-KRWDZBQOSA-N 2 0 356.510 4.430 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000163558143 1088210900 /nfs/dbraw/zinc/21/09/00/1088210900.db2.gz INUUZNMBMPZSOD-SSOJOUAXSA-N 2 0 358.551 4.117 20 0 FIADRP CSc1cc(Br)ccc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414815581 1088244394 /nfs/dbraw/zinc/24/43/94/1088244394.db2.gz XQNOTESQFHJGOY-GFCCVEGCSA-N 2 0 365.340 4.481 20 0 FIADRP COC(=O)c1csc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000514084239 1088312553 /nfs/dbraw/zinc/31/25/53/1088312553.db2.gz OYRZOLAYQFTGTM-MRXNPFEDSA-N 2 0 372.534 4.371 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414825271 1088329184 /nfs/dbraw/zinc/32/91/84/1088329184.db2.gz GXBJLAFCHYEGHX-OAHLLOKOSA-N 2 0 360.933 4.048 20 0 FIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000513826828 1088426263 /nfs/dbraw/zinc/42/62/63/1088426263.db2.gz CKMGJTNGKUGMJI-ICSRJNTNSA-N 2 0 360.542 4.160 20 0 FIADRP CC[C@@H]1C[N@@H+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC[C@@H]1[NH3+] ZINC000647938488 1088453415 /nfs/dbraw/zinc/45/34/15/1088453415.db2.gz OLXVMDPKFIWWDK-LZJOCLMNSA-N 2 0 351.494 4.059 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCC(F)(F)C1 ZINC000514126581 1088772104 /nfs/dbraw/zinc/77/21/04/1088772104.db2.gz JVAVIRSGGLAWAJ-SFHVURJKSA-N 2 0 351.485 4.445 20 0 FIADRP C[N@H+](Cc1ccccc1)Cc1cccc(-c2nc(C3([NH3+])CCCC3)no2)c1 ZINC000414620053 1088907028 /nfs/dbraw/zinc/90/70/28/1088907028.db2.gz PDJBTJSWTOAWGK-UHFFFAOYSA-N 2 0 362.477 4.097 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000312390451 1089060544 /nfs/dbraw/zinc/06/05/44/1089060544.db2.gz CTQUTUVUNQEUCI-UYAOXDASSA-N 2 0 366.505 4.021 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000415042242 1089078506 /nfs/dbraw/zinc/07/85/06/1089078506.db2.gz QNLXVBRAKRQASM-OLZOCXBDSA-N 2 0 365.340 4.395 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000415049429 1089084857 /nfs/dbraw/zinc/08/48/57/1089084857.db2.gz HFKNCEJIQSLSJR-GOSISDBHSA-N 2 0 362.901 4.317 20 0 FIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(Cl)c1 ZINC000415045797 1089090827 /nfs/dbraw/zinc/09/08/27/1089090827.db2.gz BUDGEFZZBNYKGD-APWZRJJASA-N 2 0 373.928 4.435 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000415059368 1089096080 /nfs/dbraw/zinc/09/60/80/1089096080.db2.gz WTXIQLRFNYGQDB-IFMALSPDSA-N 2 0 350.506 4.326 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000415055883 1089102110 /nfs/dbraw/zinc/10/21/10/1089102110.db2.gz PFLOXMMJLDLOSJ-NHYNNZIHSA-N 3 0 363.549 4.252 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)ccc1Oc1cccnc1 ZINC000415075520 1089123431 /nfs/dbraw/zinc/12/34/31/1089123431.db2.gz BQFBVJOJCGPGAE-MISYRCLQSA-N 2 0 355.457 4.023 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1OCC ZINC000414857894 1089133130 /nfs/dbraw/zinc/13/31/30/1089133130.db2.gz QKUDYQVAFHDUDS-HOCLYGCPSA-N 2 0 354.922 4.005 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](C)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000415084429 1089140319 /nfs/dbraw/zinc/14/03/19/1089140319.db2.gz PDZGAPXXLCETDA-AMEVOLBXSA-N 2 0 374.569 4.212 20 0 FIADRP CCOc1ccc(C2(C[NH2+][C@H](C)C[C@H]3CCCCC[NH2+]3)CCOCC2)cc1 ZINC000415090040 1089142287 /nfs/dbraw/zinc/14/22/87/1089142287.db2.gz OMFSSQALJRVTDX-TZIWHRDSSA-N 2 0 374.569 4.034 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCN[C@H](c4ccccc4)C3)CC2)CC1 ZINC000415095981 1089153600 /nfs/dbraw/zinc/15/36/00/1089153600.db2.gz AEBMWSMYHXMXKI-ZWDXQAFOSA-N 2 0 355.570 4.112 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@@H]1CCC[NH2+]C1 ZINC000414860431 1089167863 /nfs/dbraw/zinc/16/78/63/1089167863.db2.gz VJRIYGAHWLMTMU-NVXWUHKLSA-N 2 0 371.912 4.070 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4)cc3F)CC2)C1 ZINC000415122056 1089185424 /nfs/dbraw/zinc/18/54/24/1089185424.db2.gz JIQTXVFHZFMEBC-FYYLOGMGSA-N 2 0 368.496 4.211 20 0 FIADRP C[C@@H]1CC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@H]1C[NH3+] ZINC000415131977 1089197089 /nfs/dbraw/zinc/19/70/89/1089197089.db2.gz SWKHJKMNNAETOO-NVXWUHKLSA-N 2 0 371.912 4.009 20 0 FIADRP C[C@H]1CC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@@H]1C[NH3+] ZINC000415131978 1089198476 /nfs/dbraw/zinc/19/84/76/1089198476.db2.gz SWKHJKMNNAETOO-RDJZCZTQSA-N 2 0 371.912 4.009 20 0 FIADRP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000549201422 1089215846 /nfs/dbraw/zinc/21/58/46/1089215846.db2.gz KDAHSVWQEOYZEH-FQEVSTJZSA-N 2 0 350.934 4.225 20 0 FIADRP CCOC[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549235835 1089315037 /nfs/dbraw/zinc/31/50/37/1089315037.db2.gz OYWGTUJRHNWNGU-BUHWKMJWSA-N 2 0 350.934 4.269 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000435134420 1089318664 /nfs/dbraw/zinc/31/86/64/1089318664.db2.gz HOWNRFBIRWCBRK-UHFFFAOYSA-N 2 0 364.493 4.014 20 0 FIADRP Cc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(-c2ccnn2C)c1 ZINC000549245432 1089381777 /nfs/dbraw/zinc/38/17/77/1089381777.db2.gz BRYXEXGIQVULPO-UHFFFAOYSA-N 2 0 374.532 4.281 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(-c2ccnn2C)c1 ZINC000549245722 1089386580 /nfs/dbraw/zinc/38/65/80/1089386580.db2.gz HAMOFJWTNUASGL-UHFFFAOYSA-N 2 0 374.532 4.281 20 0 FIADRP Cc1nc2ccccn2c1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000514744535 1089421924 /nfs/dbraw/zinc/42/19/24/1089421924.db2.gz CNELJYDTHCIKEW-GOSISDBHSA-N 2 0 354.542 4.119 20 0 FIADRP CC[C@@H]1CN([C@@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)CC[C@H]1[NH3+] ZINC000647940040 1089472885 /nfs/dbraw/zinc/47/28/85/1089472885.db2.gz KRUKFUVLTUOGEP-SYYKKAFVSA-N 2 0 365.521 4.042 20 0 FIADRP FC(F)(F)c1ccc(CN(Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1 ZINC000435373257 1089567365 /nfs/dbraw/zinc/56/73/65/1089567365.db2.gz UPHZRLDNWMBELT-IBGZPJMESA-N 2 0 363.427 4.245 20 0 FIADRP [NH3+]CC1CC[NH+](Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000435375184 1089568918 /nfs/dbraw/zinc/56/89/18/1089568918.db2.gz SXAUVRWPZBVFTD-UHFFFAOYSA-N 2 0 356.322 4.288 20 0 FIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435369362 1089580028 /nfs/dbraw/zinc/58/00/28/1089580028.db2.gz DVZUXZMESFZNDK-RDJZCZTQSA-N 2 0 371.912 4.152 20 0 FIADRP Cc1ccccc1-c1cccc(C[NH2+]CC2CC[NH+](CCN(C)C)CC2)c1 ZINC000518774372 1089611665 /nfs/dbraw/zinc/61/16/65/1089611665.db2.gz CSBASASDWBUHDI-UHFFFAOYSA-N 2 0 365.565 4.025 20 0 FIADRP c1cc(C[N@H+](Cc2cnc3ccccc3c2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000435429686 1089647969 /nfs/dbraw/zinc/64/79/69/1089647969.db2.gz YNGSPHCHFLGAJG-NRFANRHFSA-N 2 0 363.530 4.441 20 0 FIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000893019304 1089675771 /nfs/dbraw/zinc/67/57/71/1089675771.db2.gz QMYSHEZPSAAGCF-UHFFFAOYSA-N 2 0 353.441 4.044 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H]1C(=O)Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC001625891370 1089758900 /nfs/dbraw/zinc/75/89/00/1089758900.db2.gz HGGKQQIHKCNGEN-GHTZIAJQSA-N 2 0 357.542 4.120 20 0 FIADRP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC000659867883 1089841230 /nfs/dbraw/zinc/84/12/30/1089841230.db2.gz XUFVGLHTZIGOPH-JTOYRKQZSA-N 2 0 369.597 4.061 20 0 FIADRP C[C@@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000178742002 1089964839 /nfs/dbraw/zinc/96/48/39/1089964839.db2.gz UNQIYDDWPRMEFN-AZUAARDMSA-N 2 0 357.542 4.027 20 0 FIADRP CC[N@H+](CCC1CCN(C(=O)Nc2cccc(C[NH2+]C)c2)CC1)CC(C)C ZINC000415934745 1090005039 /nfs/dbraw/zinc/00/50/39/1090005039.db2.gz SAPWUUMRYMPOIP-UHFFFAOYSA-N 2 0 374.573 4.018 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)NC[C@@H](c1ccccc1)[NH+](CC)CC ZINC000415941072 1090016832 /nfs/dbraw/zinc/01/68/32/1090016832.db2.gz GFNHWHKKAVFPSA-NRFANRHFSA-N 2 0 368.525 4.001 20 0 FIADRP CCCC[NH+](CCCC)CCNc1ccc([C@@]23CC[NH2+][C@@H]2COCC3)cc1 ZINC001167733394 1090255734 /nfs/dbraw/zinc/25/57/34/1090255734.db2.gz SNABOYHSMXNNNV-PKTZIBPZSA-N 2 0 373.585 4.021 20 0 FIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000378398342 1090345757 /nfs/dbraw/zinc/34/57/57/1090345757.db2.gz QOXMXORYQLRLQT-ZEYPLWLESA-N 2 0 368.521 4.055 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1ccc(-n2ccnc2)cc1 ZINC000378402492 1090347374 /nfs/dbraw/zinc/34/73/74/1090347374.db2.gz LVKSEXYNQWJGJU-QGZVFWFLSA-N 2 0 357.461 4.124 20 0 FIADRP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]C1CCN(c2ccccn2)CC1 ZINC000545456777 1090383493 /nfs/dbraw/zinc/38/34/93/1090383493.db2.gz VECRCXMEBXUVMR-YWZLYKJASA-N 2 0 359.901 4.070 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000183178589 1090396583 /nfs/dbraw/zinc/39/65/83/1090396583.db2.gz SZKVKXWUXGHGLI-INIZCTEOSA-N 2 0 371.481 4.296 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)C[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000431896020 1090481943 /nfs/dbraw/zinc/48/19/43/1090481943.db2.gz KBKFVKJVPCZQJD-OAQYLSRUSA-N 2 0 353.510 4.160 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1OC ZINC000312366439 1090625885 /nfs/dbraw/zinc/62/58/85/1090625885.db2.gz ADSRSPXZJDBOSG-WZONZLPQSA-N 2 0 368.521 4.267 20 0 FIADRP CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)o1 ZINC000500086770 1091029580 /nfs/dbraw/zinc/02/95/80/1091029580.db2.gz DQTKVMDTCRIDQP-TZIWHRDSSA-N 2 0 361.574 4.031 20 0 FIADRP C[C@H]1C[C@@H](NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000390519707 1091163023 /nfs/dbraw/zinc/16/30/23/1091163023.db2.gz FSMVHZYGHNLXAZ-URXFXBBRSA-N 2 0 365.565 4.151 20 0 FIADRP CCC[N@H+](CCc1ccccc1F)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000468763506 1091223992 /nfs/dbraw/zinc/22/39/92/1091223992.db2.gz ANDIGVDGSJLXKB-UHFFFAOYSA-N 2 0 370.516 4.156 20 0 FIADRP O[C@@H](C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000759842906 1091299686 /nfs/dbraw/zinc/29/96/86/1091299686.db2.gz HDXXXNPSIDOTIG-FQEVSTJZSA-N 2 0 368.924 4.101 20 0 FIADRP COCC[C@@H](c1ccccc1)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512237460 1091945912 /nfs/dbraw/zinc/94/59/12/1091945912.db2.gz RJZZTCQVMSMWKO-ZEQRLZLVSA-N 2 0 364.533 4.362 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2C(C)(C)CC([NH3+])CC2(C)C)C[C@H](C)N1Cc1ccccc1 ZINC001168012462 1092339748 /nfs/dbraw/zinc/33/97/48/1092339748.db2.gz ANVXJIAWGSJMRN-RMFSNUHRSA-N 2 0 357.586 4.408 20 0 FIADRP [NH3+][C@@H]1C[C@@H](NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c2ccccc21 ZINC000665277186 1092505977 /nfs/dbraw/zinc/50/59/77/1092505977.db2.gz WEYUNZGNTFYORR-WWPVKYPJSA-N 2 0 361.533 4.023 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000521312892 1092636099 /nfs/dbraw/zinc/63/60/99/1092636099.db2.gz JAFJTTOFWLCFTG-UTKZUKDTSA-N 2 0 364.518 4.254 20 0 FIADRP c1cc(C[NH+]2CCCCC2)cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@H]4[NH2+]3)n2)c1 ZINC000442756194 1092756231 /nfs/dbraw/zinc/75/62/31/1092756231.db2.gz YVHTZGDZQIDNFS-SXLOBPIMSA-N 2 0 366.509 4.316 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000442800061 1092772589 /nfs/dbraw/zinc/77/25/89/1092772589.db2.gz JQZGUSIMTAZXQQ-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP Cn1nccc1-c1ccccc1C[NH2+]C[C@H](c1ccccc1)N1CCCC1 ZINC000509616464 1093172504 /nfs/dbraw/zinc/17/25/04/1093172504.db2.gz ILDCKFOVTCVLJY-HSZRJFAPSA-N 2 0 360.505 4.014 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)cc1 ZINC000474061510 1093174926 /nfs/dbraw/zinc/17/49/26/1093174926.db2.gz SKSIIRDIKCEQST-AKIFATBCSA-N 2 0 374.569 4.092 20 0 FIADRP Cc1ccnc(CCC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168020395 1093211755 /nfs/dbraw/zinc/21/17/55/1093211755.db2.gz MXWBVSYTRNDVBR-PMACEKPBSA-N 2 0 351.538 4.354 20 0 FIADRP [NH3+]C1CC[NH+](CCCC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000433113407 1093264104 /nfs/dbraw/zinc/26/41/04/1093264104.db2.gz DOEYONRPSCSMCX-QFIPXVFZSA-N 2 0 371.569 4.018 20 0 FIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168024091 1093374160 /nfs/dbraw/zinc/37/41/60/1093374160.db2.gz ZTWIYEPESRZFPT-MUWAIZJESA-N 2 0 372.553 4.140 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168024240 1093380244 /nfs/dbraw/zinc/38/02/44/1093380244.db2.gz CTCIOWWHGDTTIW-GUDVDZBRSA-N 2 0 352.522 4.354 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(Br)c2)[C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918877 1093417442 /nfs/dbraw/zinc/41/74/42/1093417442.db2.gz NDBLIFCENKUOPO-MBBYRJAFSA-N 2 0 363.343 4.320 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(-c3cc[nH]n3)o2)C[N@@H+]1Cc1ccccc1 ZINC000433310820 1093565132 /nfs/dbraw/zinc/56/51/32/1093565132.db2.gz JRLAMZDTQVPBMZ-HKUYNNGSSA-N 2 0 364.493 4.060 20 0 FIADRP CCCC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000535918052 1093596595 /nfs/dbraw/zinc/59/65/95/1093596595.db2.gz JFTLIOZIUZLCNC-LJQANCHMSA-N 2 0 372.384 4.452 20 0 FIADRP C[C@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)Oc1cccc(Br)c1 ZINC000512969909 1093606604 /nfs/dbraw/zinc/60/66/04/1093606604.db2.gz LPQBSCORZOIWOS-CQSZACIVSA-N 2 0 369.347 4.069 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@@H]2COc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032957 1093679876 /nfs/dbraw/zinc/67/98/76/1093679876.db2.gz JEIIHMPSACKTBV-SFHLNBCPSA-N 2 0 364.533 4.269 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2COc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032955 1093680393 /nfs/dbraw/zinc/68/03/93/1093680393.db2.gz JEIIHMPSACKTBV-QRICJDHISA-N 2 0 364.533 4.269 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4cc(F)ccc34)CC2)C1 ZINC000513063209 1093711913 /nfs/dbraw/zinc/71/19/13/1093711913.db2.gz GZKQPBIUSDOQPF-OXJNMPFZSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)C1 ZINC000614387522 1093805114 /nfs/dbraw/zinc/80/51/14/1093805114.db2.gz JSIRMWSWZZCBGY-GOSISDBHSA-N 2 0 360.505 4.152 20 0 FIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000474484352 1093831266 /nfs/dbraw/zinc/83/12/66/1093831266.db2.gz IEVBKYZZPPGYLX-OALUTQOASA-N 2 0 354.542 4.232 20 0 FIADRP C[C@H]1CC(N(C(N)=[NH2+])c2ccc(Cl)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168036256 1093849039 /nfs/dbraw/zinc/84/90/39/1093849039.db2.gz URCHWPMEYKWVHV-HOTGVXAUSA-N 2 0 370.928 4.481 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(Br)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000513407691 1094105567 /nfs/dbraw/zinc/10/55/67/1094105567.db2.gz HFWFWQWIHNUXPR-ZBFHGGJFSA-N 2 0 351.332 4.192 20 0 FIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1F ZINC000513494102 1094161883 /nfs/dbraw/zinc/16/18/83/1094161883.db2.gz FWRQSVDBGWEFFI-YLJYHZDGSA-N 2 0 356.485 4.225 20 0 FIADRP Cc1ccn2c(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cnc2c1 ZINC000513494346 1094162289 /nfs/dbraw/zinc/16/22/89/1094162289.db2.gz HONRAUYGRIUZEU-FPOVZHCZSA-N 2 0 362.521 4.033 20 0 FIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1OC ZINC000513495747 1094163295 /nfs/dbraw/zinc/16/32/95/1094163295.db2.gz UPRKDIZMMIZCBM-UYAOXDASSA-N 2 0 368.521 4.094 20 0 FIADRP COc1cc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc(OC)c1 ZINC000513501433 1094174272 /nfs/dbraw/zinc/17/42/72/1094174272.db2.gz SXWIVGYXQSOPIV-ICSRJNTNSA-N 2 0 368.521 4.094 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)nn1 ZINC000414270347 1094256075 /nfs/dbraw/zinc/25/60/75/1094256075.db2.gz LOVXNEJNMCUIPZ-UHFFFAOYSA-N 2 0 372.516 4.338 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@H]2CCc3ccccc3O2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036726 1094297153 /nfs/dbraw/zinc/29/71/53/1094297153.db2.gz WSGFMFAQRJFOAW-DNVFCKCGSA-N 2 0 364.533 4.411 20 0 FIADRP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)c(OC(F)F)c1 ZINC000513698098 1094360168 /nfs/dbraw/zinc/36/01/68/1094360168.db2.gz WMFWQPFZIYRRRB-KSZLIROESA-N 2 0 368.468 4.039 20 0 FIADRP C[N@@H+](Cc1cc(-c2ccccc2)no1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501048843 1094454112 /nfs/dbraw/zinc/45/41/12/1094454112.db2.gz HMFFMXJHCNASGO-UHFFFAOYSA-N 2 0 362.477 4.085 20 0 FIADRP CC[C@@H](C)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501055094 1094466363 /nfs/dbraw/zinc/46/63/63/1094466363.db2.gz PZWPCXBCPGFBBL-WIYYLYMNSA-N 2 0 365.993 4.433 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)CC1 ZINC000501060564 1094473237 /nfs/dbraw/zinc/47/32/37/1094473237.db2.gz SWOGLLIRKPSECI-QMMLZNLJSA-N 2 0 363.977 4.043 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001168039917 1094480803 /nfs/dbraw/zinc/48/08/03/1094480803.db2.gz IRQKWXRKYSKLLI-FQVVGKCUSA-N 2 0 357.586 4.136 20 0 FIADRP CC(=O)Nc1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000513707298 1094516311 /nfs/dbraw/zinc/51/63/11/1094516311.db2.gz BFJKHJSWQNVNAI-UHFFFAOYSA-N 2 0 365.521 4.178 20 0 FIADRP Cc1ccc(CCC[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cn1 ZINC000474708072 1094531498 /nfs/dbraw/zinc/53/14/98/1094531498.db2.gz BMYAABDIWUYDOV-UHFFFAOYSA-N 2 0 371.956 4.478 20 0 FIADRP C[C@H]1CC([NH2+]C2CCC(C[NH+](C)C)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041566 1094591545 /nfs/dbraw/zinc/59/15/45/1094591545.db2.gz TVKJWCBONPEYNY-CDNGDFIJSA-N 3 0 357.586 4.138 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)[C@@H](C)C1CCCCC1 ZINC000474798620 1094616545 /nfs/dbraw/zinc/61/65/45/1094616545.db2.gz DJZCNHQQUKCDTK-MOPGFXCFSA-N 2 0 358.570 4.338 20 0 FIADRP C[N@H+](CCCCCc1cc(-c2cccc(F)c2)no1)CC[C@@H]1CC[NH2+]C1 ZINC000420294170 1094853023 /nfs/dbraw/zinc/85/30/23/1094853023.db2.gz AUEAXIXJYNJELA-KRWDZBQOSA-N 2 0 359.489 4.125 20 0 FIADRP CCC[N@H+](CC[C@H]1CCC[NH2+]C1)CC(=O)Nc1ccc(Cl)cc1Cl ZINC000420325007 1094888807 /nfs/dbraw/zinc/88/88/07/1094888807.db2.gz VXLMYNCVHAROPG-CQSZACIVSA-N 2 0 372.340 4.034 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000420382946 1094906780 /nfs/dbraw/zinc/90/67/80/1094906780.db2.gz PZSGATSBQDECBN-KXBFYZLASA-N 2 0 364.942 4.273 20 0 FIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccccc3Oc3ccccc3)CC2)C1 ZINC000420386644 1094906974 /nfs/dbraw/zinc/90/69/74/1094906974.db2.gz JBPMWPQZQLCKKH-REWPJTCUSA-N 2 0 366.505 4.197 20 0 FIADRP COc1ccc([C@@H](C[NH3+])C[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000420416905 1094914092 /nfs/dbraw/zinc/91/40/92/1094914092.db2.gz WAXHYJDNMNBJSY-HIFRSBDPSA-N 2 0 352.400 4.107 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000522551457 1095134575 /nfs/dbraw/zinc/13/45/75/1095134575.db2.gz JBOGHZBVTSFAQJ-PZJWPPBQSA-N 2 0 351.538 4.003 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000502274522 1095294692 /nfs/dbraw/zinc/29/46/92/1095294692.db2.gz NQCWDVIZCHCPTP-JOCHJYFZSA-N 2 0 368.521 4.351 20 0 FIADRP COc1cc(C)c(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000502469991 1095498818 /nfs/dbraw/zinc/49/88/18/1095498818.db2.gz DMCSBZQJLXXDDZ-GBESFXJTSA-N 2 0 374.569 4.186 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)C1 ZINC000421321695 1095519957 /nfs/dbraw/zinc/51/99/57/1095519957.db2.gz CITHPQYHEVIXDP-GOSISDBHSA-N 2 0 352.526 4.097 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cnn(C3CCCC3)c2-c2ccccc2)C1 ZINC000421321697 1095520642 /nfs/dbraw/zinc/52/06/42/1095520642.db2.gz CITHPQYHEVIXDP-SFHVURJKSA-N 2 0 352.526 4.097 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CCC(C)(C)CC2)c1)C1CCOCC1 ZINC000237201929 1095575632 /nfs/dbraw/zinc/57/56/32/1095575632.db2.gz WOKOTZJAHGNWFU-UHFFFAOYSA-N 2 0 374.569 4.235 20 0 FIADRP C[C@H](NC1CC[NH+](CCc2ccccc2)CC1)c1cnn(C2CCCC2)c1 ZINC000502699727 1095724710 /nfs/dbraw/zinc/72/47/10/1095724710.db2.gz ZKXWNPRVBSMNCD-IBGZPJMESA-N 2 0 366.553 4.356 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cc(C)c(C)o3)CC2)cc1 ZINC000502724433 1095760597 /nfs/dbraw/zinc/76/05/97/1095760597.db2.gz UOKMBHCRYYAOPJ-QGZVFWFLSA-N 2 0 356.510 4.468 20 0 FIADRP C[C@@H](c1ncc(C(C)(C)C)o1)N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000281952748 1095777010 /nfs/dbraw/zinc/77/70/10/1095777010.db2.gz FRFGAJNLIKLSGC-JKSUJKDBSA-N 2 0 356.514 4.446 20 0 FIADRP COc1ccc(Cl)cc1C[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000502880584 1095916074 /nfs/dbraw/zinc/91/60/74/1095916074.db2.gz QGNXQXUKYHZHSL-APWZRJJASA-N 2 0 350.934 4.087 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CC2)c(F)c1 ZINC000421823952 1095937444 /nfs/dbraw/zinc/93/74/44/1095937444.db2.gz GDGHXXAAOLIOBN-JOCHJYFZSA-N 2 0 372.484 4.016 20 0 FIADRP FC(F)(F)CCN1CCC([NH2+]C[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000272649895 1096197742 /nfs/dbraw/zinc/19/77/42/1096197742.db2.gz DTHQXIIFGANLSO-PKOBYXMFSA-N 2 0 370.459 4.161 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000414654328 1096350292 /nfs/dbraw/zinc/35/02/92/1096350292.db2.gz BYKPKUFMXQAMSH-OALUTQOASA-N 2 0 360.505 4.017 20 0 FIADRP COCC[C@H](c1ccccc1)[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503428742 1096395084 /nfs/dbraw/zinc/39/50/84/1096395084.db2.gz HWXRJOBXUYDVNE-TZIWHRDSSA-N 2 0 353.510 4.177 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC000503562799 1096465040 /nfs/dbraw/zinc/46/50/40/1096465040.db2.gz NMTCOZNTFCPWRE-ROUUACIJSA-N 2 0 358.482 4.051 20 0 FIADRP CC[C@H]1C[C@H](C[NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000503581071 1096475020 /nfs/dbraw/zinc/47/50/20/1096475020.db2.gz IWODGEWXWAAZHL-YADHBBJMSA-N 2 0 358.570 4.474 20 0 FIADRP FC(F)(F)c1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422759265 1096475135 /nfs/dbraw/zinc/47/51/35/1096475135.db2.gz KZCCUZVMXRNPRE-HKUYNNGSSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc(C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(OC)cc2)cc1 ZINC000422769705 1096486706 /nfs/dbraw/zinc/48/67/06/1096486706.db2.gz PDKJJJCCOOFFLH-KXNZUKPASA-N 2 0 368.521 4.095 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000422778217 1096488767 /nfs/dbraw/zinc/48/87/67/1096488767.db2.gz GUQGEEMPOIMKFL-SFHVURJKSA-N 3 0 366.553 4.076 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000422780069 1096489187 /nfs/dbraw/zinc/48/91/87/1096489187.db2.gz JSVUYTWCVOWAIT-OXQOHEQNSA-N 2 0 364.892 4.220 20 0 FIADRP COc1ccc([C@H](C)CC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422784638 1096490361 /nfs/dbraw/zinc/49/03/61/1096490361.db2.gz PZPNAWXPFUUQDD-FRGLQRNOSA-N 2 0 366.505 4.034 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C(C)C)cc1 ZINC000422786472 1096491235 /nfs/dbraw/zinc/49/12/35/1096491235.db2.gz OXPSXOMLTIQWRH-YMPZKCBVSA-N 2 0 366.505 4.238 20 0 FIADRP CC[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1F ZINC000422762269 1096491258 /nfs/dbraw/zinc/49/12/58/1096491258.db2.gz MMFXIRYJIDTNLL-QKNQBKEWSA-N 2 0 358.432 4.261 20 0 FIADRP FC(F)(F)c1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422795380 1096492265 /nfs/dbraw/zinc/49/22/65/1096492265.db2.gz HLVNUWKFUDIKAF-HKUYNNGSSA-N 2 0 362.395 4.051 20 0 FIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)c(OC)c1 ZINC000422799990 1096493907 /nfs/dbraw/zinc/49/39/07/1096493907.db2.gz YZQOMENTRYMVBT-XFMWISLNSA-N 2 0 374.912 4.306 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422801661 1096495098 /nfs/dbraw/zinc/49/50/98/1096495098.db2.gz CIENTPLWLHIEPC-YSFPZDHXSA-N 2 0 356.554 4.363 20 0 FIADRP COc1cccc([C@H]([NH2+][C@@H](C)CCCC[NH3+])c2cc(F)ccc2OC)c1 ZINC000422824994 1096500298 /nfs/dbraw/zinc/50/02/98/1096500298.db2.gz OVODNMHTDWURLX-BTYIYWSLSA-N 2 0 360.473 4.039 20 0 FIADRP c1nc2ccccc2n1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422828252 1096500830 /nfs/dbraw/zinc/50/08/30/1096500830.db2.gz ODRSJNJTAHLAAZ-YPAWHYETSA-N 2 0 374.532 4.095 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000422832168 1096501286 /nfs/dbraw/zinc/50/12/86/1096501286.db2.gz UTWMUJIRBQSDGN-AKHDSKFASA-N 2 0 350.453 4.176 20 0 FIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000422846600 1096504234 /nfs/dbraw/zinc/50/42/34/1096504234.db2.gz FSTRLAYYZLRWQO-BUIAKZPTSA-N 2 0 368.443 4.201 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000422851355 1096504590 /nfs/dbraw/zinc/50/45/90/1096504590.db2.gz ORKSDAHEODMCIU-MRXNPFEDSA-N 2 0 353.510 4.411 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000422855851 1096505771 /nfs/dbraw/zinc/50/57/71/1096505771.db2.gz FLOWQKRUZOWOGW-MSOLQXFVSA-N 3 0 366.553 4.074 20 0 FIADRP Cc1ccccc1Oc1ccccc1C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000422860770 1096506965 /nfs/dbraw/zinc/50/69/65/1096506965.db2.gz MYQWPZBRWLYVOC-PCCBWWKXSA-N 2 0 366.505 4.034 20 0 FIADRP c1ccc(COCc2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000422859907 1096506998 /nfs/dbraw/zinc/50/69/98/1096506998.db2.gz KNQRHXPFGGKBOA-TZRRMPRUSA-N 2 0 364.533 4.414 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000422877046 1096509946 /nfs/dbraw/zinc/50/99/46/1096509946.db2.gz HGRWRSIDSYUFAG-KRWDZBQOSA-N 2 0 361.489 4.279 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422880810 1096510820 /nfs/dbraw/zinc/51/08/20/1096510820.db2.gz OTBOAZKARGMSCM-YSGRDPCXSA-N 2 0 355.913 4.209 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OC1CCCC1 ZINC000422944417 1096531707 /nfs/dbraw/zinc/53/17/07/1096531707.db2.gz SAKNRAPFVKKBKL-HNNXBMFYSA-N 2 0 369.509 4.030 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1cccs1)c1ccc2c(c1)CCCC2 ZINC000422963407 1096533580 /nfs/dbraw/zinc/53/35/80/1096533580.db2.gz IMIFUKQMDMXHIC-FPOVZHCZSA-N 2 0 358.551 4.060 20 0 FIADRP Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422993766 1096542687 /nfs/dbraw/zinc/54/26/87/1096542687.db2.gz GDYXQTIXXUMNKC-BULFRSBZSA-N 2 0 353.510 4.198 20 0 FIADRP Clc1ccc(COCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000423021797 1096551738 /nfs/dbraw/zinc/55/17/38/1096551738.db2.gz CXHLGRLQGKECLJ-CGTJXYLNSA-N 2 0 357.325 4.020 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC000423040782 1096557599 /nfs/dbraw/zinc/55/75/99/1096557599.db2.gz HXTLVNRMPHKMRG-QWHCGFSZSA-N 2 0 351.416 4.149 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H](CC(F)(F)F)c1ccc(Br)cc1 ZINC000423041889 1096558790 /nfs/dbraw/zinc/55/87/90/1096558790.db2.gz YALSNMVZOVVSLN-ZWNOBZJWSA-N 2 0 353.226 4.160 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCN(c3ccccc3C(F)(F)F)C2)c2ccccc21 ZINC000423067614 1096562867 /nfs/dbraw/zinc/56/28/67/1096562867.db2.gz ZZLQIFPGBPQJBM-VHSSKADRSA-N 2 0 361.411 4.019 20 0 FIADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c2ccccc21 ZINC000423067615 1096563452 /nfs/dbraw/zinc/56/34/52/1096563452.db2.gz ZZLQIFPGBPQJBM-XWIAVFTESA-N 2 0 361.411 4.019 20 0 FIADRP C[C@H](CCCC[NH3+])NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414715608 1096564137 /nfs/dbraw/zinc/56/41/37/1096564137.db2.gz REZRSDHMZWEPOT-QGZVFWFLSA-N 2 0 360.546 4.090 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2cccc(F)c2o1 ZINC000423074848 1096564299 /nfs/dbraw/zinc/56/42/99/1096564299.db2.gz VSDXUXQRRJLTIQ-GKIWIXTESA-N 2 0 366.436 4.478 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423100984 1096575699 /nfs/dbraw/zinc/57/56/99/1096575699.db2.gz NFYKKZKXGFFJOD-XERREHJYSA-N 2 0 354.519 4.315 20 0 FIADRP Clc1cc2c(s1)CC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423120312 1096577943 /nfs/dbraw/zinc/57/79/43/1096577943.db2.gz GBUXIFYVJMQHQA-DOXZYTNZSA-N 2 0 360.910 4.234 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423125467 1096579718 /nfs/dbraw/zinc/57/97/18/1096579718.db2.gz QNPDEEZBOGMIKP-MEDUHNTESA-N 2 0 350.304 4.025 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000423125466 1096580244 /nfs/dbraw/zinc/58/02/44/1096580244.db2.gz QNPDEEZBOGMIKP-BZNIZROVSA-N 2 0 350.304 4.025 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423129807 1096581111 /nfs/dbraw/zinc/58/11/11/1096581111.db2.gz MIZCHZCUZFBLKG-CEWLAPEOSA-N 2 0 358.913 4.315 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000423107019 1096583049 /nfs/dbraw/zinc/58/30/49/1096583049.db2.gz PDHJPNQYIRSOTI-JEBQAFNWSA-N 2 0 366.347 4.196 20 0 FIADRP Fc1cc(F)c2c(c1)[C@@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146247 1096586710 /nfs/dbraw/zinc/58/67/10/1096586710.db2.gz OVMVWBVCASAQOH-VWPQPMDRSA-N 2 0 370.443 4.188 20 0 FIADRP Fc1cc(F)c2c(c1)[C@@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146240 1096586854 /nfs/dbraw/zinc/58/68/54/1096586854.db2.gz OVMVWBVCASAQOH-JAXLGGSGSA-N 2 0 370.443 4.188 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000503920500 1096587783 /nfs/dbraw/zinc/58/77/83/1096587783.db2.gz LQFWUZXPPCLZAR-UHFFFAOYSA-N 2 0 355.309 4.091 20 0 FIADRP Cc1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc12 ZINC000423169030 1096601106 /nfs/dbraw/zinc/60/11/06/1096601106.db2.gz IOXHKYVOQWBESD-LADGPHEKSA-N 2 0 358.485 4.494 20 0 FIADRP COCCC[C@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(Br)cc1 ZINC000423180408 1096606281 /nfs/dbraw/zinc/60/62/81/1096606281.db2.gz NNYLLUQZSGPPLQ-KRWDZBQOSA-N 2 0 369.347 4.168 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423238397 1096617799 /nfs/dbraw/zinc/61/77/99/1096617799.db2.gz ADVKTGAMCYBZMH-GXTWGEPZSA-N 2 0 367.324 4.138 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423220622 1096620255 /nfs/dbraw/zinc/62/02/55/1096620255.db2.gz YNCPBKVCNXVMTH-MNOVXSKESA-N 2 0 354.338 4.374 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]C2CCC([NH3+])CC2)c2ccc(F)cc2)CC1 ZINC000423229634 1096624669 /nfs/dbraw/zinc/62/46/69/1096624669.db2.gz HLCHUUUBGHZZCA-HRTMPFAESA-N 3 0 361.549 4.238 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC[C@@H]3CCC[NH2+]C3)s2)cc1 ZINC000423258371 1096633085 /nfs/dbraw/zinc/63/30/85/1096633085.db2.gz LZBQWRRWGVHNPZ-HOCLYGCPSA-N 2 0 359.539 4.167 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Br)c1 ZINC000423291104 1096635850 /nfs/dbraw/zinc/63/58/50/1096635850.db2.gz GUHIXOAOLHSIJH-OLZOCXBDSA-N 2 0 363.299 4.328 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)c(Br)c2)cc1 ZINC000423291522 1096636300 /nfs/dbraw/zinc/63/63/00/1096636300.db2.gz ISGPRSVNYFXKHU-NEPJUHHUSA-N 2 0 351.263 4.459 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OC(F)F ZINC000423293824 1096643245 /nfs/dbraw/zinc/64/32/45/1096643245.db2.gz SDLCTNDBAJJQDS-CHWSQXEVSA-N 2 0 350.409 4.167 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423295960 1096644208 /nfs/dbraw/zinc/64/42/08/1096644208.db2.gz XXQBIBLDAVIURI-HXOBKFHXSA-N 2 0 361.489 4.184 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2Br)cc1 ZINC000423295692 1096644221 /nfs/dbraw/zinc/64/42/21/1096644221.db2.gz XFJYTGSOJVKXJZ-RYUDHWBXSA-N 2 0 351.263 4.459 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423300348 1096645767 /nfs/dbraw/zinc/64/57/67/1096645767.db2.gz RJARRCIXGBXMJK-MNOVXSKESA-N 2 0 368.344 4.126 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423333999 1096650024 /nfs/dbraw/zinc/65/00/24/1096650024.db2.gz FLLAHNCPWYWTRM-LJQANCHMSA-N 2 0 357.295 4.048 20 0 FIADRP [NH3+]CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000423341271 1096651138 /nfs/dbraw/zinc/65/11/38/1096651138.db2.gz XZAKEWLTISENOK-KRWDZBQOSA-N 2 0 351.263 4.006 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCc3cc(N)ccc32)CC1 ZINC000423354097 1096654156 /nfs/dbraw/zinc/65/41/56/1096654156.db2.gz CMYVVCQSTDWWMF-MHECFPHRSA-N 2 0 363.549 4.331 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC[NH2+]1 ZINC000423391516 1096664084 /nfs/dbraw/zinc/66/40/84/1096664084.db2.gz WXWWUABHVKGPEX-BTJLNZGRSA-N 2 0 362.315 4.038 20 0 FIADRP CSC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423420261 1096669322 /nfs/dbraw/zinc/66/93/22/1096669322.db2.gz AJFQHXGRBIKCJO-GVDBMIGSSA-N 2 0 358.473 4.087 20 0 FIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423405348 1096673575 /nfs/dbraw/zinc/67/35/75/1096673575.db2.gz TUJCOCOLFXHFIZ-WQVCFCJDSA-N 2 0 361.942 4.429 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000423453558 1096679379 /nfs/dbraw/zinc/67/93/79/1096679379.db2.gz AQBALJDXXAGXGT-XYPHTWIQSA-N 2 0 359.514 4.434 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)s2)cc1 ZINC000423432709 1096684252 /nfs/dbraw/zinc/68/42/52/1096684252.db2.gz JFPKEUNBXKMQLZ-ZNZDAUKMSA-N 2 0 371.550 4.166 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC000423438111 1096686955 /nfs/dbraw/zinc/68/69/55/1096686955.db2.gz MPOZMJLJMPHJHJ-OQIJWPOYSA-N 2 0 352.444 4.319 20 0 FIADRP CC[C@H]([NH3+])CN[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423463674 1096690376 /nfs/dbraw/zinc/69/03/76/1096690376.db2.gz LMLJZNCQXZXBPE-YGRLFVJLSA-N 2 0 368.344 4.269 20 0 FIADRP CC[C@@H]([NH3+])CN[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000423463672 1096690667 /nfs/dbraw/zinc/69/06/67/1096690667.db2.gz LMLJZNCQXZXBPE-QMTHXVAHSA-N 2 0 368.344 4.269 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000423470582 1096693110 /nfs/dbraw/zinc/69/31/10/1096693110.db2.gz LKTSIEPUDFUPOL-UFWSDVQLSA-N 2 0 352.497 4.301 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)C1CCC(F)(F)CC1 ZINC000423471477 1096694521 /nfs/dbraw/zinc/69/45/21/1096694521.db2.gz MESVBQNZCAIBDZ-DKSSEZFCSA-N 2 0 354.460 4.322 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCC2 ZINC000423474385 1096695848 /nfs/dbraw/zinc/69/58/48/1096695848.db2.gz HGSOLRUVZUVSPJ-WMLDXEAASA-N 2 0 359.514 4.448 20 0 FIADRP CCc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)s1 ZINC000423478101 1096696415 /nfs/dbraw/zinc/69/64/15/1096696415.db2.gz SZTJVIMMCJVYEK-RPVQJOFSSA-N 2 0 361.530 4.197 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423478693 1096696547 /nfs/dbraw/zinc/69/65/47/1096696547.db2.gz UJWNTZZVOBVZEM-ZTNFWEORSA-N 2 0 360.448 4.485 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cc2cc(Br)ccc2o1 ZINC000423477990 1096696631 /nfs/dbraw/zinc/69/66/31/1096696631.db2.gz SUMSXKNDLRENLR-HUBLWGQQSA-N 2 0 351.288 4.363 20 0 FIADRP CC(C)C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccn1 ZINC000423478698 1096697236 /nfs/dbraw/zinc/69/72/36/1096697236.db2.gz UKEOQWHJFQFHNH-DWLFOUALSA-N 2 0 355.501 4.291 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]3CCC[C@H]([NH3+])C3)s2)cc1 ZINC000423454774 1096697885 /nfs/dbraw/zinc/69/78/85/1096697885.db2.gz DJEPDTULXHQOOG-LXZKKBNFSA-N 2 0 359.539 4.295 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[C@H](C[NH3+])C2)nc1 ZINC000423498128 1096699065 /nfs/dbraw/zinc/69/90/65/1096699065.db2.gz GMQLZBVSCQZKDV-NYVOZVTQSA-N 2 0 371.956 4.168 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(Br)cc1C(F)(F)F ZINC000423504890 1096701151 /nfs/dbraw/zinc/70/11/51/1096701151.db2.gz LIMHGLPOKWKTST-JBLDHEPKSA-N 2 0 365.237 4.246 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423506988 1096702391 /nfs/dbraw/zinc/70/23/91/1096702391.db2.gz JFWPHBDSZAOXDD-GBXCKJPGSA-N 3 0 365.565 4.152 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423483968 1096703059 /nfs/dbraw/zinc/70/30/59/1096703059.db2.gz QLWDAXAVVUNCHH-SJORKVTESA-N 2 0 359.514 4.448 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423483966 1096703210 /nfs/dbraw/zinc/70/32/10/1096703210.db2.gz QLWDAXAVVUNCHH-IAGOWNOFSA-N 2 0 359.514 4.448 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC1=CC[NH2+]CC1)CCC2 ZINC000423540540 1096716243 /nfs/dbraw/zinc/71/62/43/1096716243.db2.gz QQFXKQAJMTWYDQ-QGZVFWFLSA-N 2 0 357.498 4.226 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546837 1096718373 /nfs/dbraw/zinc/71/83/73/1096718373.db2.gz ZOFQAJPJBCFGAZ-SJCJKPOMSA-N 2 0 367.356 4.131 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423550590 1096719534 /nfs/dbraw/zinc/71/95/34/1096719534.db2.gz SWNURGWCDFOWTC-PHAGKYIGSA-N 2 0 352.444 4.319 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423551855 1096720225 /nfs/dbraw/zinc/72/02/25/1096720225.db2.gz UKWUEWYCHUQTEF-BWUSGFMJSA-N 2 0 359.514 4.296 20 0 FIADRP CCCC[N@@H+]1CCCC[C@H]1CNC(=O)c1ccc(C[NH+](CC)C2CC2)cc1 ZINC000504561308 1096809286 /nfs/dbraw/zinc/80/92/86/1096809286.db2.gz QEHXJOLGJMJAKL-QFIPXVFZSA-N 2 0 371.569 4.055 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245659145 1098559701 /nfs/dbraw/zinc/55/97/01/1098559701.db2.gz FFYUUPVNAWSSOJ-KOUNCHBCSA-N 2 0 355.570 4.035 20 0 FIADRP CN1CC[C@H]([NH2+]Cc2ccc(-n3ccnc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000514694953 1098560292 /nfs/dbraw/zinc/56/02/92/1098560292.db2.gz UEMSTECGPXJRKX-LEWJYISDSA-N 2 0 366.896 4.061 20 0 FIADRP CC(C)(C)[NH+]1CCC(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000245659144 1098560364 /nfs/dbraw/zinc/56/03/64/1098560364.db2.gz FFYUUPVNAWSSOJ-DKUWSORSSA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H](CC[NH2+]Cc1c[nH]nc1-c1ccsc1)[N@H+](C)Cc1ccccc1 ZINC000436241882 1098848052 /nfs/dbraw/zinc/84/80/52/1098848052.db2.gz LDPABSNTHJOYCT-INIZCTEOSA-N 2 0 354.523 4.138 20 0 FIADRP c1cc(-c2n[nH]cc2C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cs1 ZINC000436282152 1098885226 /nfs/dbraw/zinc/88/52/26/1098885226.db2.gz QKYIGLYBFWPPOV-UHFFFAOYSA-N 2 0 352.507 4.024 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436293582 1098907940 /nfs/dbraw/zinc/90/79/40/1098907940.db2.gz VRZFUEYEPWILAX-WDSOQIARSA-N 2 0 356.485 4.363 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000436403974 1098993134 /nfs/dbraw/zinc/99/31/34/1098993134.db2.gz AUWJAMPAECOLIU-AEFFLSMTSA-N 2 0 351.469 4.307 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cncc(Br)c1 ZINC000578084184 1099304560 /nfs/dbraw/zinc/30/45/60/1099304560.db2.gz RWAJOSHBODEEOV-GJZGRUSLSA-N 2 0 354.336 4.149 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)cs2)cc1 ZINC000516297589 1099344387 /nfs/dbraw/zinc/34/43/87/1099344387.db2.gz GYOFNJIGAOPIDY-FQEVSTJZSA-N 2 0 371.550 4.173 20 0 FIADRP Cc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc(C)c1OCc1ccccn1 ZINC000237401133 1099472962 /nfs/dbraw/zinc/47/29/62/1099472962.db2.gz ZGHDHYOVUNDBNY-SFHVURJKSA-N 2 0 367.537 4.099 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)cc1 ZINC000648605952 1099778069 /nfs/dbraw/zinc/77/80/69/1099778069.db2.gz OOSAOXPWSAVIBB-OAQYLSRUSA-N 2 0 360.448 4.072 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508698486 1099830849 /nfs/dbraw/zinc/83/08/49/1099830849.db2.gz OPJHTDOSPOBOBW-DENIHFKCSA-N 2 0 352.522 4.046 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000162535499 1099831625 /nfs/dbraw/zinc/83/16/25/1099831625.db2.gz WJCHEKPYEYQEOI-HXUWFJFHSA-N 2 0 374.912 4.284 20 0 FIADRP Cc1csc(CCCC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000508698587 1099831778 /nfs/dbraw/zinc/83/17/78/1099831778.db2.gz PFBMYGOQBZXOLX-UYAOXDASSA-N 2 0 357.567 4.274 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Oc1cccc(F)c1 ZINC000508702102 1099857521 /nfs/dbraw/zinc/85/75/21/1099857521.db2.gz YNXRTPFAKIXUMC-GGPKGHCWSA-N 2 0 356.485 4.093 20 0 FIADRP CCOCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508703571 1099858289 /nfs/dbraw/zinc/85/82/89/1099858289.db2.gz YWTAGFDSYRTLEB-UNMCSNQZSA-N 2 0 358.570 4.474 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccccc2-c2ccnn2C)cc1 ZINC000509684037 1099881179 /nfs/dbraw/zinc/88/11/79/1099881179.db2.gz KDIAAJROEHEDLQ-UHFFFAOYSA-N 2 0 362.521 4.219 20 0 FIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714331 1099882922 /nfs/dbraw/zinc/88/29/22/1099882922.db2.gz GZLDRXFFPUILJB-QWFCFKBJSA-N 2 0 356.485 4.093 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000508712665 1099902688 /nfs/dbraw/zinc/90/26/88/1099902688.db2.gz RMVOUBRDVSVNQI-JTAQYXEDSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)COCc1ccccc1 ZINC000508712287 1099904038 /nfs/dbraw/zinc/90/40/38/1099904038.db2.gz QLRNQJPADKUIMM-DPLHUUCSSA-N 2 0 366.549 4.340 20 0 FIADRP CCc1ccc([C@@H](C)[NH2+]CC2CCN(Cc3nc(C)c(C)o3)CC2)cc1 ZINC000162728911 1099976230 /nfs/dbraw/zinc/97/62/30/1099976230.db2.gz ZCMJUNFSGIFNET-QGZVFWFLSA-N 2 0 355.526 4.417 20 0 FIADRP Brc1ccc2c(c1)CC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459402755 1100109180 /nfs/dbraw/zinc/10/91/80/1100109180.db2.gz ZYWVWQITBZVJPU-LJQANCHMSA-N 2 0 372.310 4.090 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)C[C@H]1C ZINC000536659685 1100129916 /nfs/dbraw/zinc/12/99/16/1100129916.db2.gz RLSRDSMMULFLMU-UYAOXDASSA-N 2 0 353.510 4.487 20 0 FIADRP Clc1ccc(C2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CCC2)cc1 ZINC000459410082 1100134632 /nfs/dbraw/zinc/13/46/32/1100134632.db2.gz NKRRSKYKXQETGR-UHFFFAOYSA-N 2 0 355.913 4.415 20 0 FIADRP Cc1cc(Cl)cc(C)c1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000536666024 1100141043 /nfs/dbraw/zinc/14/10/43/1100141043.db2.gz GFXZLQCUTGETLI-UHFFFAOYSA-N 2 0 350.934 4.034 20 0 FIADRP [NH3+]CCCC[NH2+]Cc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000414913002 1100153577 /nfs/dbraw/zinc/15/35/77/1100153577.db2.gz VMJKWNHNQSERQC-UHFFFAOYSA-N 2 0 368.912 4.080 20 0 FIADRP CC[N@H+](Cc1cccc(O)c1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000536672841 1100158665 /nfs/dbraw/zinc/15/86/65/1100158665.db2.gz SVOHBKJSLJFFLU-UHFFFAOYSA-N 2 0 368.525 4.105 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1N(C)C ZINC000536705905 1100212532 /nfs/dbraw/zinc/21/25/32/1100212532.db2.gz QIGPVYVRIJERGP-IBGZPJMESA-N 2 0 367.537 4.078 20 0 FIADRP CC[N@@H+](Cc1cccc(COC)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536708662 1100225402 /nfs/dbraw/zinc/22/54/02/1100225402.db2.gz LZGMJIAPVFEFMJ-HSZRJFAPSA-N 2 0 352.522 4.177 20 0 FIADRP Cn1nccc1[C@H]1CCC[C@H]([NH2+]CC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000517278539 1100251448 /nfs/dbraw/zinc/25/14/48/1100251448.db2.gz JDEOECAOSDAXMD-PMACEKPBSA-N 2 0 358.574 4.225 20 0 FIADRP c1cn(CC[N@@H+]2CCCCC[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000459528959 1100276038 /nfs/dbraw/zinc/27/60/38/1100276038.db2.gz ROIRVIOMHWELIE-HSZRJFAPSA-N 2 0 366.553 4.040 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000425934568 1100314957 /nfs/dbraw/zinc/31/49/57/1100314957.db2.gz DCDCXOBDHZPEME-QFIPXVFZSA-N 2 0 364.533 4.054 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(OC(F)(F)F)c1 ZINC000536859466 1100376227 /nfs/dbraw/zinc/37/62/27/1100376227.db2.gz UYNXXYJSRUBJBP-OWCLPIDISA-N 2 0 374.447 4.125 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OCCC(C)C ZINC000459658487 1100405910 /nfs/dbraw/zinc/40/59/10/1100405910.db2.gz KNOOEZZDTSTDBX-UHFFFAOYSA-N 2 0 353.466 4.058 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)Nc2ccccc2)CC1)CC(C)C ZINC000536885228 1100411247 /nfs/dbraw/zinc/41/12/47/1100411247.db2.gz KBGVVIGFBLEFLD-UHFFFAOYSA-N 2 0 359.558 4.095 20 0 FIADRP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CCC(OCC[NH+]3CCCC3)CC2)C1 ZINC000438116806 1100442282 /nfs/dbraw/zinc/44/22/82/1100442282.db2.gz KCRUERIFKQSUOZ-GMAHTHKFSA-N 2 0 356.554 4.074 20 0 FIADRP COC(=O)C1CCC([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000425951344 1100454231 /nfs/dbraw/zinc/45/42/31/1100454231.db2.gz PGKIPJVQENZMAM-UHFFFAOYSA-N 2 0 372.553 4.273 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC[NH2+]1 ZINC000414955337 1100925374 /nfs/dbraw/zinc/92/53/74/1100925374.db2.gz UCBTVDKIRBWRQE-CHWSQXEVSA-N 2 0 365.340 4.408 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2-n2ccnc2)CC1 ZINC000438826387 1100948196 /nfs/dbraw/zinc/94/81/96/1100948196.db2.gz NCJQRSVUOBUDJZ-UHFFFAOYSA-N 2 0 374.532 4.405 20 0 FIADRP C[C@H](C[NH2+][C@@H](c1ccc(Br)s1)C1CC1)C[NH+]1CCCC1 ZINC000439133816 1101190079 /nfs/dbraw/zinc/19/00/79/1101190079.db2.gz SWOZVBKONYIFCD-MLGOLLRUSA-N 2 0 357.361 4.283 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138721 1101194724 /nfs/dbraw/zinc/19/47/24/1101194724.db2.gz DQSULFJRVABSLN-OAHLLOKOSA-N 2 0 357.361 4.283 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)ccc1SC ZINC000414990697 1101282358 /nfs/dbraw/zinc/28/23/58/1101282358.db2.gz ALDNKPONTWZVCW-PKOBYXMFSA-N 2 0 374.525 4.039 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000536954550 1101370723 /nfs/dbraw/zinc/37/07/23/1101370723.db2.gz KARFAPMZMBQAMR-HXUWFJFHSA-N 2 0 353.466 4.082 20 0 FIADRP Fc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000537000352 1101388118 /nfs/dbraw/zinc/38/81/18/1101388118.db2.gz BKSROJDXAQVPRI-XXBNENTESA-N 2 0 352.497 4.431 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)C1 ZINC000414998960 1101458005 /nfs/dbraw/zinc/45/80/05/1101458005.db2.gz REUJRKLOLOYQIL-IINYFYTJSA-N 2 0 365.237 4.075 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760161995 1101487272 /nfs/dbraw/zinc/48/72/72/1101487272.db2.gz WNRSOGZEJKTBQW-GFCCVEGCSA-N 2 0 352.309 4.488 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Br)s2)C1 ZINC000518763545 1101519328 /nfs/dbraw/zinc/51/93/28/1101519328.db2.gz UZPMMSNDPXTWSO-ZIAGYGMSSA-N 2 0 359.377 4.358 20 0 FIADRP CCO[C@H]1C[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C12CCCCC2 ZINC000537294006 1101613953 /nfs/dbraw/zinc/61/39/53/1101613953.db2.gz PZTRJNABXWTFRV-RTWAWAEBSA-N 2 0 357.542 4.016 20 0 FIADRP CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537303983 1101627586 /nfs/dbraw/zinc/62/75/86/1101627586.db2.gz LVKNXDGZEBQMIU-HOIFWPIMSA-N 2 0 374.500 4.193 20 0 FIADRP CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537303991 1101628117 /nfs/dbraw/zinc/62/81/17/1101628117.db2.gz LVKNXDGZEBQMIU-JLHGSKIFSA-N 2 0 374.500 4.193 20 0 FIADRP CCC1(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000537307394 1101634142 /nfs/dbraw/zinc/63/41/42/1101634142.db2.gz NQWVNSPNMFFRAL-BHDDXSALSA-N 2 0 368.565 4.226 20 0 FIADRP OC1(C(F)(F)F)CCC([NH2+]CC2([NH+]3CCCCC3)CCCCC2)CC1 ZINC000396324338 1101727881 /nfs/dbraw/zinc/72/78/81/1101727881.db2.gz OXMMHQHDMSYYGK-UHFFFAOYSA-N 2 0 362.480 4.001 20 0 FIADRP FC(F)(F)c1cc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc(C(F)(F)F)c1 ZINC000415006244 1101882313 /nfs/dbraw/zinc/88/23/13/1101882313.db2.gz KGEKQLJDWSQJGP-LSDHHAIUSA-N 2 0 366.349 4.202 20 0 FIADRP C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000060368355 1101938026 /nfs/dbraw/zinc/93/80/26/1101938026.db2.gz KFYJXOZIPMGACW-BBWFWOEESA-N 2 0 350.934 4.222 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC(F)(F)F)cc1 ZINC000123723458 1102010029 /nfs/dbraw/zinc/01/00/29/1102010029.db2.gz SYHVXCIFMVUCKI-CQSZACIVSA-N 2 0 352.400 4.498 20 0 FIADRP COc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2Cl)cc1OC ZINC000643465566 1102131517 /nfs/dbraw/zinc/13/15/17/1102131517.db2.gz WFBPJWJPWJELIK-KKSFZXQISA-N 2 0 374.912 4.178 20 0 FIADRP c1sc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1-c1ccccn1 ZINC000090044560 1102228092 /nfs/dbraw/zinc/22/80/92/1102228092.db2.gz AREPYWOKMQHJGC-UHFFFAOYSA-N 2 0 370.566 4.134 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000415012836 1102248582 /nfs/dbraw/zinc/24/85/82/1102248582.db2.gz XRYDZVWRFGZCPO-FZCLSBEQSA-N 2 0 358.423 4.230 20 0 FIADRP C[C@H](C[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1)CN1CC[NH+](C)CC1 ZINC000120989014 1102301951 /nfs/dbraw/zinc/30/19/51/1102301951.db2.gz DLQHWWHFQTXCHK-WOJBJXKFSA-N 2 0 367.537 4.013 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000040622757 1102344533 /nfs/dbraw/zinc/34/45/33/1102344533.db2.gz MCSMFMHUERKZJO-MXWWQKGMSA-N 2 0 351.332 4.015 20 0 FIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532454381 1102345325 /nfs/dbraw/zinc/34/53/25/1102345325.db2.gz VIVGQSSUVKDAMS-HSZRJFAPSA-N 2 0 350.506 4.458 20 0 FIADRP C[C@H]([NH3+])c1ccc(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000519538988 1102365200 /nfs/dbraw/zinc/36/52/00/1102365200.db2.gz LPIUDSLAYWCMMO-MSOLQXFVSA-N 2 0 365.521 4.011 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC001168200092 1102367076 /nfs/dbraw/zinc/36/70/76/1102367076.db2.gz FPASLYVNLRHPQP-UHFFFAOYSA-N 3 0 357.586 4.226 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000532462203 1102369538 /nfs/dbraw/zinc/36/95/38/1102369538.db2.gz FYCKHHZGGCHRLC-QGZVFWFLSA-N 2 0 357.542 4.134 20 0 FIADRP COc1ccc2cccc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2c1 ZINC001167969358 1102375171 /nfs/dbraw/zinc/37/51/71/1102375171.db2.gz BKIAVRCVKURRMW-FRIKZZABSA-N 2 0 364.533 4.386 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c(C)n1 ZINC000121643129 1102430113 /nfs/dbraw/zinc/43/01/13/1102430113.db2.gz FGDQGBDPVKAFTN-KRWDZBQOSA-N 2 0 352.526 4.320 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1 ZINC000121643239 1102430236 /nfs/dbraw/zinc/43/02/36/1102430236.db2.gz ZDAVCHXGRZNWBE-GOSISDBHSA-N 2 0 374.573 4.333 20 0 FIADRP CC1CCC([NH+]2CCC3(C[C@H]([N@H+](C)Cc4cccs4)CO3)CC2)CC1 ZINC001168212878 1102490285 /nfs/dbraw/zinc/49/02/85/1102490285.db2.gz SVALUDBSRCKIHP-ACBHZAAOSA-N 2 0 362.583 4.382 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000122282212 1102555356 /nfs/dbraw/zinc/55/53/56/1102555356.db2.gz QUROYXBFFVWAGB-LJQANCHMSA-N 2 0 374.912 4.284 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3c(s2)CCC3)[C@H](C)C1 ZINC000122289661 1102556386 /nfs/dbraw/zinc/55/63/86/1102556386.db2.gz PSAYFFUNYDGQKV-RYRKJORJSA-N 2 0 350.572 4.024 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1OC(F)F ZINC000122324627 1102556615 /nfs/dbraw/zinc/55/66/15/1102556615.db2.gz KQFKPSMRTWUTED-HNNXBMFYSA-N 2 0 364.436 4.079 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(OC(F)F)cc1 ZINC000122384419 1102570054 /nfs/dbraw/zinc/57/00/54/1102570054.db2.gz UGDALJKCBGDYCB-OAHLLOKOSA-N 2 0 364.436 4.079 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccc3c(c2)CCO3)CC1 ZINC000550902112 1102679081 /nfs/dbraw/zinc/67/90/81/1102679081.db2.gz FSGWOCSTITZOCE-UHFFFAOYSA-N 2 0 364.533 4.197 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)CC1 ZINC000550920873 1102693283 /nfs/dbraw/zinc/69/32/83/1102693283.db2.gz KNXFAHPULJPWOS-FDTLVRFQSA-N 2 0 368.565 4.367 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000125918216 1102693489 /nfs/dbraw/zinc/69/34/89/1102693489.db2.gz QEZMZXXPCRWQOP-JOCHJYFZSA-N 2 0 373.504 4.238 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1OC ZINC000123005844 1102726508 /nfs/dbraw/zinc/72/65/08/1102726508.db2.gz DWXFPGHKOOSEAN-SFHVURJKSA-N 2 0 368.521 4.459 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(-n2ccnc2)cc1 ZINC000123045171 1102757523 /nfs/dbraw/zinc/75/75/23/1102757523.db2.gz RZFVXYRDCNGSHV-IBGZPJMESA-N 2 0 360.505 4.319 20 0 FIADRP C[C@@H](CCc1ccccc1)[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000237334988 1102844469 /nfs/dbraw/zinc/84/44/69/1102844469.db2.gz QTSYSKXIIQKWJA-IBGZPJMESA-N 2 0 351.538 4.332 20 0 FIADRP CC1(C)CCC[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550271813 1102904499 /nfs/dbraw/zinc/90/44/99/1102904499.db2.gz XIMBYRNLJCAVDM-VXKWHMMOSA-N 2 0 370.581 4.474 20 0 FIADRP CCOc1cc(C[NH+]2CCC(C[NH+](CC)CC)CC2)cc(Cl)c1OC ZINC000506928012 1102966312 /nfs/dbraw/zinc/96/63/12/1102966312.db2.gz QZEGRHSDLJOKLV-UHFFFAOYSA-N 2 0 368.949 4.301 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC000537698601 1102985046 /nfs/dbraw/zinc/98/50/46/1102985046.db2.gz UVUQYQDHWMJRFK-DNVJHFABSA-N 2 0 350.506 4.037 20 0 FIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3nc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000426808533 1103005040 /nfs/dbraw/zinc/00/50/40/1103005040.db2.gz RWYGXRZPKPORJB-IRXDYDNUSA-N 2 0 373.566 4.008 20 0 FIADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551263642 1103022376 /nfs/dbraw/zinc/02/23/76/1103022376.db2.gz DDUREAVJZFVRRR-KNQAVFIVSA-N 2 0 356.554 4.084 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)ccn1 ZINC000551270089 1103030864 /nfs/dbraw/zinc/03/08/64/1103030864.db2.gz KTORZXXQLMZOPE-CEXWTWQISA-N 2 0 367.537 4.419 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)ccn1 ZINC000551288673 1103048181 /nfs/dbraw/zinc/04/81/81/1103048181.db2.gz UWGFAMSFTCUGLW-KRWDZBQOSA-N 2 0 365.477 4.166 20 0 FIADRP CCc1c(C)[nH+]c2ccccc2c1N1CCC(OCCC[NH+](C)C)CC1 ZINC000477088959 1103094614 /nfs/dbraw/zinc/09/46/14/1103094614.db2.gz KIGYQCLYMSDWJF-UHFFFAOYSA-N 2 0 355.526 4.043 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(C(F)(F)F)cn1 ZINC000551394634 1103177256 /nfs/dbraw/zinc/17/72/56/1103177256.db2.gz KHSLHNBYJBHNME-DNVCBOLYSA-N 2 0 363.427 4.101 20 0 FIADRP c1ccc(C(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000459384324 1103232026 /nfs/dbraw/zinc/23/20/26/1103232026.db2.gz VRUUVWXOCNPDOA-UHFFFAOYSA-N 2 0 357.501 4.472 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000507430751 1103382933 /nfs/dbraw/zinc/38/29/33/1103382933.db2.gz UKCYZHZXGOSJJN-YWZLYKJASA-N 2 0 362.439 4.147 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000507430747 1103383555 /nfs/dbraw/zinc/38/35/55/1103383555.db2.gz UKCYZHZXGOSJJN-MGPUTAFESA-N 2 0 362.439 4.147 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)[C@@H]1COc2ccccc21 ZINC000507485309 1103433238 /nfs/dbraw/zinc/43/32/38/1103433238.db2.gz LKOTXXATFBUPDU-CJTHLSDLSA-N 2 0 362.517 4.051 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000187996971 1103732955 /nfs/dbraw/zinc/73/29/55/1103732955.db2.gz QVUGGMKIAPWIIX-IGCXYCKISA-N 2 0 358.423 4.194 20 0 FIADRP COc1ccc2ccccc2c1-c1cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])on1 ZINC000519763902 1103835699 /nfs/dbraw/zinc/83/56/99/1103835699.db2.gz HYGDQQBPRITAPU-APWZRJJASA-N 2 0 365.477 4.111 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@@H](C)[C@H](C)C2)cc1)c1cscn1 ZINC000538193971 1104029083 /nfs/dbraw/zinc/02/90/83/1104029083.db2.gz GCSDCCBGVPGJQR-KURKYZTESA-N 2 0 373.566 4.003 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000520045226 1104051554 /nfs/dbraw/zinc/05/15/54/1104051554.db2.gz LIHGIEDPIRBXKY-INIZCTEOSA-N 2 0 374.504 4.299 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC(CC)(CC)c2ccc(OC)c(OC)c2)CC1 ZINC000461093534 1104091762 /nfs/dbraw/zinc/09/17/62/1104091762.db2.gz WIPUFADKNRJDIP-UHFFFAOYSA-N 2 0 362.558 4.226 20 0 FIADRP Clc1ccc(SCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441397529 1104330274 /nfs/dbraw/zinc/33/02/74/1104330274.db2.gz WSNYSMXVGLJFSA-HNAYVOBHSA-N 2 0 350.959 4.381 20 0 FIADRP FC(F)(F)Oc1cccc(CC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441404532 1104344420 /nfs/dbraw/zinc/34/44/20/1104344420.db2.gz SWRMFXUHNWBXTA-APWZRJJASA-N 2 0 368.443 4.076 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccccc1F ZINC000112524932 1104374503 /nfs/dbraw/zinc/37/45/03/1104374503.db2.gz KMOANTAJSZZGLZ-KURKYZTESA-N 2 0 356.485 4.286 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccccc3)n2)cc1 ZINC000536302058 1104636130 /nfs/dbraw/zinc/63/61/30/1104636130.db2.gz JNTSBWPSVTWULQ-HXUWFJFHSA-N 2 0 362.477 4.135 20 0 FIADRP CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537963790 1104745536 /nfs/dbraw/zinc/74/55/36/1104745536.db2.gz VSPXODZFZQJMEM-JLHGSKIFSA-N 2 0 374.500 4.193 20 0 FIADRP Clc1ccc(-c2cc(C[NH+]3CCC(Nc4ccccn4)CC3)on2)cc1 ZINC000536368832 1104827453 /nfs/dbraw/zinc/82/74/53/1104827453.db2.gz ICSBRWFQQFVXDH-UHFFFAOYSA-N 2 0 368.868 4.467 20 0 FIADRP C[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000507772686 1104959468 /nfs/dbraw/zinc/95/94/68/1104959468.db2.gz HPUMJZGQGSOTLP-SFHVURJKSA-N 2 0 370.512 4.017 20 0 FIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152370953 1105057177 /nfs/dbraw/zinc/05/71/77/1105057177.db2.gz OQORAKVVXMZLFL-HIFRSBDPSA-N 2 0 359.514 4.393 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C4CC4)C2)CCC3)cc1 ZINC000152394376 1105075281 /nfs/dbraw/zinc/07/52/81/1105075281.db2.gz QEVKVYHOLCHCOX-YJBOKZPZSA-N 2 0 353.535 4.261 20 0 FIADRP C[C@@H]1CC([NH2+][C@H]2COc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005194 1105076707 /nfs/dbraw/zinc/07/67/07/1105076707.db2.gz HUDSRRRUDKSMTR-JBYIUTFZSA-N 2 0 350.506 4.021 20 0 FIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530221137 1106914633 /nfs/dbraw/zinc/91/46/33/1106914633.db2.gz NOOIICFUAVILAO-SVFBPWRDSA-N 2 0 354.881 4.173 20 0 FIADRP Clc1c2ccccc2sc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530239961 1106922490 /nfs/dbraw/zinc/92/24/90/1106922490.db2.gz JHFCUWPFZKQWTL-OAHLLOKOSA-N 2 0 364.942 4.145 20 0 FIADRP C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530243465 1106923430 /nfs/dbraw/zinc/92/34/30/1106923430.db2.gz YKLJJASOYPUCEN-CZUORRHYSA-N 2 0 357.325 4.145 20 0 FIADRP C[C@@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530243461 1106923575 /nfs/dbraw/zinc/92/35/75/1106923575.db2.gz YKLJJASOYPUCEN-BBRMVZONSA-N 2 0 357.325 4.145 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c(-c2ccccc2)cc1OC ZINC000530675905 1107248506 /nfs/dbraw/zinc/24/85/06/1107248506.db2.gz ZQPVHMQHOCPZDL-WOJBJXKFSA-N 2 0 368.521 4.333 20 0 FIADRP COc1ccc([C@@H](CNc2cc[nH+]c3cc(F)ccc23)[NH+](C)C)cc1OC ZINC000302570339 1107391690 /nfs/dbraw/zinc/39/16/90/1107391690.db2.gz QHMBUNMEBGNWQD-LJQANCHMSA-N 2 0 369.440 4.106 20 0 FIADRP CCCCOC(=O)[C@@H]1CC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168067984 1107514104 /nfs/dbraw/zinc/51/41/04/1107514104.db2.gz VZBLKZLPMWBVPP-SFHLNBCPSA-N 2 0 372.553 4.093 20 0 FIADRP Brc1ccc(C2CC([NH2+]C3CC([NH+]4CCCCC4)C3)C2)cc1 ZINC000475562828 1107744648 /nfs/dbraw/zinc/74/46/48/1107744648.db2.gz DYHIULDTLQRJSW-UHFFFAOYSA-N 2 0 363.343 4.302 20 0 FIADRP COc1ccc(CN2CCC[C@H]([N@H+](C)Cc3ccc(OC)cc3)CC2)cc1 ZINC000444655847 1108050479 /nfs/dbraw/zinc/05/04/79/1108050479.db2.gz BDLSWMLWDAVVOA-NRFANRHFSA-N 2 0 368.521 4.190 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000531690285 1108057016 /nfs/dbraw/zinc/05/70/16/1108057016.db2.gz LPUIKUYOKQICQG-KRWDZBQOSA-N 2 0 365.521 4.264 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2cccs2)cc1 ZINC000444667171 1108071787 /nfs/dbraw/zinc/07/17/87/1108071787.db2.gz SDTXGGDYACXNQV-HSALFYBXSA-N 2 0 356.535 4.099 20 0 FIADRP COc1ccc(OC)c(CC[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000531700256 1108079036 /nfs/dbraw/zinc/07/90/36/1108079036.db2.gz ABDOJZZEIZLWJB-MRXNPFEDSA-N 2 0 365.477 4.091 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000531709936 1108089520 /nfs/dbraw/zinc/08/95/20/1108089520.db2.gz BTBGVUHCNPJBJX-RPWUZVMVSA-N 2 0 365.565 4.278 20 0 FIADRP FC(F)(F)C[C@@H]1CC[NH+](C/C=C\C[N@H+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000444689652 1108091573 /nfs/dbraw/zinc/09/15/73/1108091573.db2.gz GPEXYPOOJRBXIA-GFCAHOMWSA-N 2 0 358.370 4.091 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCCSc1ccccc1Br ZINC000531713907 1108093427 /nfs/dbraw/zinc/09/34/27/1108093427.db2.gz VBLVQKOUDJUULH-GDBMZVCRSA-N 2 0 371.388 4.251 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccsc1 ZINC000453066179 1108118938 /nfs/dbraw/zinc/11/89/38/1108118938.db2.gz QRTJJUKNQXQTIF-OAQYLSRUSA-N 2 0 357.567 4.127 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccsc1 ZINC000453070938 1108123056 /nfs/dbraw/zinc/12/30/56/1108123056.db2.gz WANRJKMMESTHHP-NRFANRHFSA-N 2 0 357.567 4.127 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2csc(C)c2)CC1 ZINC000453055359 1108131908 /nfs/dbraw/zinc/13/19/08/1108131908.db2.gz AUMCIHUAZBHRFL-GOSISDBHSA-N 2 0 357.567 4.045 20 0 FIADRP CCn1ccnc1[C@H](C)NCc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000453057479 1108132677 /nfs/dbraw/zinc/13/26/77/1108132677.db2.gz FJPYGPUODICHNJ-FHWLQOOXSA-N 2 0 354.542 4.232 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C)c2)CC1)c1ccncc1 ZINC000453065011 1108144506 /nfs/dbraw/zinc/14/45/06/1108144506.db2.gz HHJVXINUMDRSLH-QHCPKHFHSA-N 2 0 366.553 4.033 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc(C[NH+](C)C)cc3)cc2)C1 ZINC000523381361 1108163716 /nfs/dbraw/zinc/16/37/16/1108163716.db2.gz JWJOQRPUWVSHPA-SFHVURJKSA-N 2 0 365.521 4.232 20 0 FIADRP CC1(C)Cc2cccc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)c2O1 ZINC000523390913 1108175356 /nfs/dbraw/zinc/17/53/56/1108175356.db2.gz JPEXFBCEWRJSKT-UHFFFAOYSA-N 2 0 350.506 4.286 20 0 FIADRP CCOC1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000453205613 1108274642 /nfs/dbraw/zinc/27/46/42/1108274642.db2.gz HAJWMPHFCRIWCQ-JTPDYBDNSA-N 2 0 356.554 4.224 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CSCCc3ccccc32)cc1 ZINC000531960117 1108453265 /nfs/dbraw/zinc/45/32/65/1108453265.db2.gz AURQBKMHLCEFQP-JOCHJYFZSA-N 2 0 370.562 4.137 20 0 FIADRP C[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc2ccccc2c1 ZINC000531965311 1108461107 /nfs/dbraw/zinc/46/11/07/1108461107.db2.gz VJJRDJMNDNEXRZ-NBGIEHNGSA-N 2 0 373.544 4.479 20 0 FIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C)cc1 ZINC000531965336 1108461678 /nfs/dbraw/zinc/46/16/78/1108461678.db2.gz XGXSXDYIYLLBRF-XZOQPEGZSA-N 2 0 351.538 4.024 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)ccc1OC ZINC000453388516 1108474233 /nfs/dbraw/zinc/47/42/33/1108474233.db2.gz WOFFGNZOKRUJKD-XMSQKQJNSA-N 2 0 360.542 4.101 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000531969858 1108477134 /nfs/dbraw/zinc/47/71/34/1108477134.db2.gz LUVOPMMAOJRKDJ-DPLHUUCSSA-N 3 0 371.613 4.040 20 0 FIADRP C[N@H+](CCCC[NH2+][C@@H]1CCSc2ccc(Br)cc21)C1CC1 ZINC000453410831 1108508906 /nfs/dbraw/zinc/50/89/06/1108508906.db2.gz VJGOMVSZLFNRCK-MRXNPFEDSA-N 2 0 369.372 4.450 20 0 FIADRP c1nc(C[N@H+]2CCCCC[C@@H]2C2CC[NH+](Cc3ccccc3)CC2)c[nH]1 ZINC000453594267 1108630343 /nfs/dbraw/zinc/63/03/43/1108630343.db2.gz FEPHIOVWTNVGAJ-JOCHJYFZSA-N 2 0 352.526 4.067 20 0 FIADRP Cc1cc(Br)c(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000453587323 1108646457 /nfs/dbraw/zinc/64/64/57/1108646457.db2.gz SZJWMZWHTZKLSY-UHFFFAOYSA-N 2 0 353.329 4.170 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3CCc4c3cccc4Cl)c2)CCO1 ZINC000532207227 1108695538 /nfs/dbraw/zinc/69/55/38/1108695538.db2.gz UZUWLWGAYDECAZ-AOMKIAJQSA-N 2 0 370.924 4.338 20 0 FIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000532216200 1108717597 /nfs/dbraw/zinc/71/75/97/1108717597.db2.gz XWJPURIIGADPTI-SFHVURJKSA-N 2 0 356.510 4.185 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCC(C)(C)C2)c1)C1CCOCC1 ZINC000532265228 1108736454 /nfs/dbraw/zinc/73/64/54/1108736454.db2.gz JVTYYSJOCWYXPM-HXUWFJFHSA-N 2 0 374.569 4.235 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(OC)c(Br)c1 ZINC000034991370 1108916861 /nfs/dbraw/zinc/91/68/61/1108916861.db2.gz APSIOICSSHXUAP-CQSZACIVSA-N 2 0 357.336 4.058 20 0 FIADRP Clc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc1Br ZINC000446891259 1109378937 /nfs/dbraw/zinc/37/89/37/1109378937.db2.gz WEGAZGFAWTZRJL-UHFFFAOYSA-N 2 0 357.723 4.067 20 0 FIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@H](C)c3cccc4ccccc43)C2)CC1 ZINC000525779471 1109515749 /nfs/dbraw/zinc/51/57/49/1109515749.db2.gz RRDRXWIPBGAYKG-TZIWHRDSSA-N 2 0 351.538 4.001 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)o1 ZINC000447560011 1109581516 /nfs/dbraw/zinc/58/15/16/1109581516.db2.gz BSYMKQADEDAUGK-CVEARBPZSA-N 2 0 359.489 4.199 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000447565584 1109584294 /nfs/dbraw/zinc/58/42/94/1109584294.db2.gz MGYUOHNKGOATKF-FZKQIMNGSA-N 2 0 363.343 4.461 20 0 FIADRP Fc1cc(Br)cc2c1CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447565868 1109584375 /nfs/dbraw/zinc/58/43/75/1109584375.db2.gz OIJBITFPZGHAQH-GOSISDBHSA-N 2 0 367.306 4.040 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c2ccccc21 ZINC000447582093 1109585596 /nfs/dbraw/zinc/58/55/96/1109585596.db2.gz XWGUKZSINZXSSW-MLCQCVOFSA-N 2 0 356.554 4.229 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1Br ZINC000447582248 1109585739 /nfs/dbraw/zinc/58/57/39/1109585739.db2.gz VYIGWKCRXDGBAF-GFCCVEGCSA-N 2 0 355.295 4.113 20 0 FIADRP COC(=O)c1coc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000447587046 1109588247 /nfs/dbraw/zinc/58/82/47/1109588247.db2.gz PYENBPMAUKTDRD-ZIFCJYIRSA-N 2 0 370.493 4.018 20 0 FIADRP c1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)n(-c2ccccc2)n1 ZINC000447930856 1109681494 /nfs/dbraw/zinc/68/14/94/1109681494.db2.gz NDBRRWHIZKAATE-UHFFFAOYSA-N 2 0 360.505 4.148 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccnn2-c2ccccc2)C1 ZINC000447935511 1109682720 /nfs/dbraw/zinc/68/27/20/1109682720.db2.gz HQGHVKKJBHCXST-HXUWFJFHSA-N 2 0 374.532 4.394 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC[C@H]2CCC[NH+](CC(C)C)C2)cc1 ZINC000448428390 1109789371 /nfs/dbraw/zinc/78/93/71/1109789371.db2.gz ZXMAOHDJLUQVSX-OAQYLSRUSA-N 2 0 373.585 4.016 20 0 FIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000527852926 1109839084 /nfs/dbraw/zinc/83/90/84/1109839084.db2.gz PKYYSBQDQUYXCO-OALUTQOASA-N 2 0 366.553 4.198 20 0 FIADRP CC(C)c1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000527883631 1109848870 /nfs/dbraw/zinc/84/88/70/1109848870.db2.gz DLUFUVQCYJGIPZ-WZONZLPQSA-N 2 0 352.522 4.227 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000449016116 1109954475 /nfs/dbraw/zinc/95/44/75/1109954475.db2.gz MTAPONSESLKLLY-UHFFFAOYSA-N 2 0 365.493 4.252 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCC34CCCCC4)cc2)CC1 ZINC000449058389 1109970539 /nfs/dbraw/zinc/97/05/39/1109970539.db2.gz ISJRDHIIKLAVDE-QFIPXVFZSA-N 2 0 356.554 4.236 20 0 FIADRP COCc1ccccc1C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449068206 1109971914 /nfs/dbraw/zinc/97/19/14/1109971914.db2.gz AMPZBEKHTSHEKM-LJQANCHMSA-N 2 0 352.522 4.018 20 0 FIADRP CCOCc1ccccc1C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449077839 1109974310 /nfs/dbraw/zinc/97/43/10/1109974310.db2.gz ZFIYFSJUKOVGOK-HXUWFJFHSA-N 2 0 366.549 4.408 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000449081242 1109974789 /nfs/dbraw/zinc/97/47/89/1109974789.db2.gz DAQHGRLKLLLLDK-FGZHOGPDSA-N 3 0 371.613 4.326 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000449081244 1109974997 /nfs/dbraw/zinc/97/49/97/1109974997.db2.gz DAQHGRLKLLLLDK-YADHBBJMSA-N 3 0 371.613 4.326 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3ccnn3C3CCCC3)CC2)c1 ZINC000449103672 1109977100 /nfs/dbraw/zinc/97/71/00/1109977100.db2.gz BSYVRMATDKXALC-UHFFFAOYSA-N 2 0 358.555 4.062 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449130040 1109981753 /nfs/dbraw/zinc/98/17/53/1109981753.db2.gz FOXZYKOZWOZDHV-IBGZPJMESA-N 2 0 351.623 4.376 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449130041 1109981926 /nfs/dbraw/zinc/98/19/26/1109981926.db2.gz FOXZYKOZWOZDHV-LJQANCHMSA-N 2 0 351.623 4.376 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCOc3ccccc32)CC1 ZINC000449145501 1109984890 /nfs/dbraw/zinc/98/48/90/1109984890.db2.gz LMHQJZVSWLJYGM-PZJWPPBQSA-N 2 0 364.533 4.238 20 0 FIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C[C@@H]4CCOC4)CC3)C2)cc1 ZINC000449164150 1109990312 /nfs/dbraw/zinc/99/03/12/1109990312.db2.gz YEADQSMEPRICCS-YRISNDGFSA-N 2 0 362.945 4.067 20 0 FIADRP CCc1cnccc1[C@@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449207916 1109995834 /nfs/dbraw/zinc/99/58/34/1109995834.db2.gz RQUBWMITDRJQIU-RTBURBONSA-N 2 0 351.538 4.390 20 0 FIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CC1 ZINC000449235172 1109998657 /nfs/dbraw/zinc/99/86/57/1109998657.db2.gz FIDIJIMBPOUJCR-UDTLNKQYSA-N 2 0 358.570 4.267 20 0 FIADRP Cc1ncsc1CN(C)C[C@H]1CC[N@H+](Cc2cccc3ccoc32)C1 ZINC000449263193 1110018269 /nfs/dbraw/zinc/01/82/69/1110018269.db2.gz HKDZCFVOTZCZLN-MRXNPFEDSA-N 2 0 355.507 4.152 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000449305231 1110022076 /nfs/dbraw/zinc/02/20/76/1110022076.db2.gz FJKOQXMIAPSDPB-IEBWSBKVSA-N 2 0 350.497 4.497 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCCC34CCC4)C3(C2)CCOCC3)cc1 ZINC000449343625 1110034623 /nfs/dbraw/zinc/03/46/23/1110034623.db2.gz LXEBUXIIVXIMIV-FGZHOGPDSA-N 2 0 368.565 4.228 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]1C ZINC000449366471 1110043544 /nfs/dbraw/zinc/04/35/44/1110043544.db2.gz WKOFHMXEIPRBDQ-NWANDNLSSA-N 2 0 352.404 4.127 20 0 FIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccnc2c(Br)cccc12 ZINC000449525084 1110099289 /nfs/dbraw/zinc/09/92/89/1110099289.db2.gz AUIUDMJIGJWUAU-UHFFFAOYSA-N 2 0 364.331 4.207 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)nn1C ZINC000282027391 1110280936 /nfs/dbraw/zinc/28/09/36/1110280936.db2.gz FGLKEGZYDQPJCB-GOSISDBHSA-N 2 0 362.521 4.308 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)C2CC(F)(F)C2)CC1 ZINC000529541045 1110284818 /nfs/dbraw/zinc/28/48/18/1110284818.db2.gz ZVDHXEDWIUVNBG-GJZGRUSLSA-N 2 0 369.475 4.052 20 0 FIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408896 1111129819 /nfs/dbraw/zinc/12/98/19/1111129819.db2.gz XBDXSLSXAYSVTI-GOSISDBHSA-N 2 0 351.332 4.012 20 0 FIADRP C[C@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1cccc(Cl)c1 ZINC000538589349 1111210708 /nfs/dbraw/zinc/21/07/08/1111210708.db2.gz ZGEHZJIFZMYONG-HNNXBMFYSA-N 2 0 358.917 4.439 20 0 FIADRP c1[nH]nc2cc(CN3CC[C@@H]4[C@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc12 ZINC000538798623 1111294794 /nfs/dbraw/zinc/29/47/94/1111294794.db2.gz PTPUWHFPLYNRIS-FYYLOGMGSA-N 2 0 360.505 4.049 20 0 FIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1sc(CCOC)nc1C ZINC000538869209 1111328897 /nfs/dbraw/zinc/32/88/97/1111328897.db2.gz IMVOTAZWICYZTF-SZMVWBNQSA-N 2 0 367.603 4.192 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000539056876 1111403996 /nfs/dbraw/zinc/40/39/96/1111403996.db2.gz DDVKZOODWLPXMP-OFAXGOBFSA-N 2 0 374.569 4.140 20 0 FIADRP CC[NH+]1CCC([NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC1 ZINC000462029336 1111473506 /nfs/dbraw/zinc/47/35/06/1111473506.db2.gz SZBXXSKXIGHUDL-UHFFFAOYSA-N 2 0 371.352 4.116 20 0 FIADRP CC[C@@H](C[NH2+]C1CC[NH+](CC)CC1)Cc1cccc(Br)c1 ZINC000462105667 1111495024 /nfs/dbraw/zinc/49/50/24/1111495024.db2.gz QDZGRYNDHWHGHD-OAHLLOKOSA-N 2 0 353.348 4.092 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2ccccc2COc2ccccc2Cl)CC1 ZINC000462118039 1111503939 /nfs/dbraw/zinc/50/39/39/1111503939.db2.gz CYAFEVXZMURTQB-UHFFFAOYSA-N 2 0 358.913 4.493 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@H]2CCN(CC)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000539296727 1111506279 /nfs/dbraw/zinc/50/62/79/1111506279.db2.gz KGSLQOLNNHKDBE-VQTJNVASSA-N 2 0 367.940 4.078 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1O2 ZINC000539370363 1111533364 /nfs/dbraw/zinc/53/33/64/1111533364.db2.gz SSGUCMZYODDNIZ-FQEVSTJZSA-N 2 0 370.924 4.460 20 0 FIADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000552056188 1111559749 /nfs/dbraw/zinc/55/97/49/1111559749.db2.gz VWGDNNFWMGWYJE-QPTUXGOLSA-N 2 0 363.549 4.213 20 0 FIADRP COC(=O)c1csc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000552062594 1111563005 /nfs/dbraw/zinc/56/30/05/1111563005.db2.gz AHJAOQSHQCAIOW-FAEJEUNOSA-N 2 0 364.555 4.228 20 0 FIADRP COCC[C@H](Cc1ccco1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552065464 1111564472 /nfs/dbraw/zinc/56/44/72/1111564472.db2.gz AGRNMIRKRFTCSD-ATKRNPRHSA-N 2 0 370.537 4.260 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)CC1 ZINC000552067387 1111565768 /nfs/dbraw/zinc/56/57/68/1111565768.db2.gz IGUTUHUGTUSKFG-ZSTXGWIISA-N 2 0 356.554 4.224 20 0 FIADRP C[NH+]1CCN(C[C@H]([NH2+][C@@H]2CCCCC23CCCC3)c2ccccc2)CC1 ZINC000552072243 1111573296 /nfs/dbraw/zinc/57/32/96/1111573296.db2.gz PFJVCWKTSGVFPG-FCHUYYIVSA-N 2 0 355.570 4.068 20 0 FIADRP Clc1cc2[nH]cc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)c2c(Cl)c1 ZINC000477867463 1111583648 /nfs/dbraw/zinc/58/36/48/1111583648.db2.gz UCWSHUSEOJQNHC-GJZGRUSLSA-N 2 0 352.309 4.234 20 0 FIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2n[nH]cc2c1 ZINC000552099306 1111585308 /nfs/dbraw/zinc/58/53/08/1111585308.db2.gz DSOQLZXNMQBHDG-DHWLSRIRSA-N 2 0 360.505 4.409 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2ccc(OC)c(OC)c2C)c1 ZINC000552250223 1111628833 /nfs/dbraw/zinc/62/88/33/1111628833.db2.gz YSIDFTKPWRPYAY-KRWDZBQOSA-N 2 0 370.537 4.185 20 0 FIADRP CCC1(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCOCC1 ZINC000552272150 1111645803 /nfs/dbraw/zinc/64/58/03/1111645803.db2.gz DKVARFBWWKLPAP-UHFFFAOYSA-N 2 0 356.554 4.181 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]CCC3CCCCC3)C3(C2)CCOCC3)cc1 ZINC000552362756 1111685559 /nfs/dbraw/zinc/68/55/59/1111685559.db2.gz LHKSELIFWAIATE-HSZRJFAPSA-N 2 0 370.581 4.475 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)[C@H]1COc2ccccc21 ZINC000552575964 1111748406 /nfs/dbraw/zinc/74/84/06/1111748406.db2.gz LZTKUVGBBRCYFT-BAYUQKDNSA-N 2 0 350.506 4.194 20 0 FIADRP Brc1ccc([C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2ccccc2)cc1 ZINC000643537104 1111774963 /nfs/dbraw/zinc/77/49/63/1111774963.db2.gz ZJGILODWSDEYRU-OALUTQOASA-N 2 0 371.322 4.270 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(F)ccc1F ZINC000479065580 1111939910 /nfs/dbraw/zinc/93/99/10/1111939910.db2.gz ROEDTYCXZKPILC-NRFANRHFSA-N 2 0 362.464 4.392 20 0 FIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)Cc2ccc(Br)cc2)CC1 ZINC000479246537 1111973480 /nfs/dbraw/zinc/97/34/80/1111973480.db2.gz DVECTOSGDBPJCP-OAHLLOKOSA-N 2 0 353.348 4.092 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298069 1111988526 /nfs/dbraw/zinc/98/85/26/1111988526.db2.gz UAUTXGNDPVMMKA-IBGZPJMESA-N 2 0 361.327 4.470 20 0 FIADRP Cn1cc2c(n1)CCC[C@H]2[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000479348629 1111995750 /nfs/dbraw/zinc/99/57/50/1111995750.db2.gz QYMHSSAOEJIVIE-JOCHJYFZSA-N 2 0 366.553 4.352 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)C1 ZINC000479358119 1111998036 /nfs/dbraw/zinc/99/80/36/1111998036.db2.gz ITJOBOOUQXSMCA-SUMWQHHRSA-N 2 0 351.332 4.103 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3c(cc(C)cc3C)[nH]2)[C@H](C)C1 ZINC000479396181 1112012159 /nfs/dbraw/zinc/01/21/59/1112012159.db2.gz PBFROJQNLJEMFB-NQIIRXRSSA-N 2 0 357.542 4.011 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000479463031 1112033143 /nfs/dbraw/zinc/03/31/43/1112033143.db2.gz HUWVMKYEFSKFQQ-FPOVZHCZSA-N 2 0 366.505 4.021 20 0 FIADRP COC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC(C)CC1 ZINC000479487206 1112041929 /nfs/dbraw/zinc/04/19/29/1112041929.db2.gz FZRSQFHFWPWOCN-YYDSYHLRSA-N 2 0 356.554 4.367 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCO[C@@H](C(F)(F)F)C2)CC1 ZINC000554049187 1112176349 /nfs/dbraw/zinc/17/63/49/1112176349.db2.gz LXHUQNRWZUUEPR-RBUKOAKNSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCO[C@H](C(F)(F)F)C3)cc2)C1 ZINC000554050140 1112177010 /nfs/dbraw/zinc/17/70/10/1112177010.db2.gz FYJNFFHIDYNRFX-MNEFBYGVSA-N 2 0 370.459 4.118 20 0 FIADRP COc1cc([C@@H](C)NCc2ccccc2C[NH+]2CCCCCC2)c(F)cn1 ZINC000554073266 1112183859 /nfs/dbraw/zinc/18/38/59/1112183859.db2.gz WXOBEAZWWUYNIN-QGZVFWFLSA-N 2 0 371.500 4.456 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(C(=O)OC(C)(C)C)c2)c1 ZINC000480025470 1112243738 /nfs/dbraw/zinc/24/37/38/1112243738.db2.gz LWCPUGSQLSMZHF-UHFFFAOYSA-N 2 0 368.521 4.383 20 0 FIADRP c1nc(-c2ccncc2)sc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000554295503 1112288934 /nfs/dbraw/zinc/28/89/34/1112288934.db2.gz AYTZPWSOLPCZQY-UHFFFAOYSA-N 2 0 364.518 4.091 20 0 FIADRP COc1ccc(C2([NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000480204659 1112331689 /nfs/dbraw/zinc/33/16/89/1112331689.db2.gz ZLXSDZRDIQMDFP-UYAOXDASSA-N 2 0 350.506 4.185 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000480277751 1112371331 /nfs/dbraw/zinc/37/13/31/1112371331.db2.gz YBOSUESGMYCJIA-HSZRJFAPSA-N 2 0 350.506 4.458 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2cccnc2)c(F)c1 ZINC000658355118 1112455793 /nfs/dbraw/zinc/45/57/93/1112455793.db2.gz HJUUZQKPPQHVOQ-JOCHJYFZSA-N 2 0 371.475 4.161 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cccc(N2CCCC2=O)c1 ZINC000480613859 1112501487 /nfs/dbraw/zinc/50/14/87/1112501487.db2.gz TZDRISUJPLPEOY-AQNXPRMDSA-N 2 0 371.569 4.222 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1OC(F)F ZINC000480606304 1112506743 /nfs/dbraw/zinc/50/67/43/1112506743.db2.gz CSQZKNKBVODTMD-JKSUJKDBSA-N 2 0 370.484 4.459 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)nnn1-c1ccc(C)cc1 ZINC000480607214 1112507482 /nfs/dbraw/zinc/50/74/82/1112507482.db2.gz DYBFLBAOWRAVDB-LJQANCHMSA-N 2 0 369.557 4.047 20 0 FIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480630550 1112510080 /nfs/dbraw/zinc/51/00/80/1112510080.db2.gz JZGFTFADSQPVNL-HZPDHXFCSA-N 2 0 352.494 4.006 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000480641619 1112517582 /nfs/dbraw/zinc/51/75/82/1112517582.db2.gz QCGXXZTXPDWKOF-INIZCTEOSA-N 2 0 352.494 4.006 20 0 FIADRP CC(C)N(C)c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cn1 ZINC000480644698 1112519748 /nfs/dbraw/zinc/51/97/48/1112519748.db2.gz OQNULGOIJPPBRF-UHFFFAOYSA-N 2 0 366.553 4.202 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCO2 ZINC000480636655 1112524413 /nfs/dbraw/zinc/52/44/13/1112524413.db2.gz CVSUNBKZMJXRTP-ZWKOTPCHSA-N 2 0 366.505 4.498 20 0 FIADRP CC[NH+](CC)CCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000554840742 1112525149 /nfs/dbraw/zinc/52/51/49/1112525149.db2.gz DDVNXGNTSFFLQS-UHFFFAOYSA-N 2 0 358.448 4.033 20 0 FIADRP Cc1ccc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c(-c2ccnn2C)c1 ZINC000554923235 1112572240 /nfs/dbraw/zinc/57/22/40/1112572240.db2.gz OGZDSAISZMJCRU-UHFFFAOYSA-N 2 0 366.553 4.140 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480779068 1112593513 /nfs/dbraw/zinc/59/35/13/1112593513.db2.gz JVEGGIYQGVOFKY-OAQYLSRUSA-N 2 0 365.993 4.435 20 0 FIADRP FC(F)(F)Oc1ccc2c(NCC3CC[NH+](C4CC4)CC3)cc[nH+]c2c1 ZINC000899873942 1113036845 /nfs/dbraw/zinc/03/68/45/1113036845.db2.gz JOOOHJDDLFCHJS-UHFFFAOYSA-N 2 0 365.399 4.420 20 0 FIADRP FC(F)(F)Oc1ccc2c(NC3CC[NH+](C4CC4)CC3)cc[nH+]c2c1 ZINC000899874591 1113037465 /nfs/dbraw/zinc/03/74/65/1113037465.db2.gz DZYQVCZONNKQKQ-UHFFFAOYSA-N 2 0 351.372 4.172 20 0 FIADRP COc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000481725229 1113055543 /nfs/dbraw/zinc/05/55/43/1113055543.db2.gz OPYJEOONIZEJKW-FQEVSTJZSA-N 2 0 356.535 4.246 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000481731889 1113059240 /nfs/dbraw/zinc/05/92/40/1113059240.db2.gz GCZOFFFLXXLBBV-YLJYHZDGSA-N 2 0 366.977 4.344 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCc4cc(F)ccc43)CC2)cc1 ZINC000481733910 1113059979 /nfs/dbraw/zinc/05/99/79/1113059979.db2.gz JAGQFTYQNSHCNS-QHCPKHFHSA-N 2 0 368.496 4.323 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000481720336 1113060688 /nfs/dbraw/zinc/06/06/88/1113060688.db2.gz FJJYABIYXBYBFN-HYFFOGBASA-N 2 0 350.506 4.107 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C(=O)OC)cc1 ZINC000556051160 1113127236 /nfs/dbraw/zinc/12/72/36/1113127236.db2.gz QVJLCRJJLHPDDA-JOCHJYFZSA-N 2 0 366.505 4.310 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cs1 ZINC000481907036 1113134530 /nfs/dbraw/zinc/13/45/30/1113134530.db2.gz GTWJTLLOCXRRPQ-FXAWDEMLSA-N 2 0 357.567 4.309 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)CC1 ZINC000482130058 1113184027 /nfs/dbraw/zinc/18/40/27/1113184027.db2.gz TUYIHDLOPFHWDG-SFHVURJKSA-N 2 0 368.521 4.018 20 0 FIADRP C[C@H]([NH2+]CCCc1ccc2c(c1)CCO2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000482220805 1113202612 /nfs/dbraw/zinc/20/26/12/1113202612.db2.gz NPJLHWSDVKZDCZ-WMZHIEFXSA-N 2 0 364.533 4.054 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccccc2Cl)[C@@H](C)C1 ZINC000482236614 1113206241 /nfs/dbraw/zinc/20/62/41/1113206241.db2.gz ASMMRCJABMSOPW-PXNSSMCTSA-N 2 0 366.977 4.344 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(OC)c1 ZINC000482434945 1113253786 /nfs/dbraw/zinc/25/37/86/1113253786.db2.gz HGGDXCWGMARFSB-NZQKXSOJSA-N 2 0 352.522 4.301 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482445206 1113258451 /nfs/dbraw/zinc/25/84/51/1113258451.db2.gz AQDWNMJARJFAAJ-PZJWPPBQSA-N 2 0 352.522 4.301 20 0 FIADRP Cc1cccc2[nH]cc(CC[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)c21 ZINC000482438101 1113260363 /nfs/dbraw/zinc/26/03/63/1113260363.db2.gz LHOPUTYIGGDINO-GOSISDBHSA-N 2 0 365.521 4.310 20 0 FIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482554102 1113298017 /nfs/dbraw/zinc/29/80/17/1113298017.db2.gz FEEFROANJWJSTH-JTSKRJEESA-N 2 0 367.512 4.224 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)cc1Cl ZINC000482876199 1113386129 /nfs/dbraw/zinc/38/61/29/1113386129.db2.gz UHZMHUDZEICRLT-QAPCUYQASA-N 2 0 359.341 4.271 20 0 FIADRP CC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000482882246 1113391329 /nfs/dbraw/zinc/39/13/29/1113391329.db2.gz AUNZAVKXLNXNRG-MAUKXSAKSA-N 2 0 359.341 4.271 20 0 FIADRP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000483219530 1113467190 /nfs/dbraw/zinc/46/71/90/1113467190.db2.gz UGCOASIGJKXVSF-UZLBHIALSA-N 2 0 370.562 4.369 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC000483276401 1113478212 /nfs/dbraw/zinc/47/82/12/1113478212.db2.gz NAAJYYYSENOOFV-NQIIRXRSSA-N 2 0 357.542 4.264 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486487858 1113579831 /nfs/dbraw/zinc/57/98/31/1113579831.db2.gz KNNYKMKWXKOREK-QFBILLFUSA-N 2 0 360.448 4.288 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cc3ccc(F)cc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000486717112 1113628459 /nfs/dbraw/zinc/62/84/59/1113628459.db2.gz MZQHMMYSCUNQFB-OXJNMPFZSA-N 2 0 351.469 4.450 20 0 FIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 ZINC000488045255 1113846234 /nfs/dbraw/zinc/84/62/34/1113846234.db2.gz ILBQSSFGQOFPKJ-BDTNDASRSA-N 2 0 354.538 4.110 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)CC1 ZINC000488051320 1113847069 /nfs/dbraw/zinc/84/70/69/1113847069.db2.gz UDEROGPBDBPLCQ-NRSPTQNISA-N 2 0 374.956 4.099 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2 ZINC000488071763 1113850177 /nfs/dbraw/zinc/85/01/77/1113850177.db2.gz HOZCOSPXFATLIQ-BHDDXSALSA-N 2 0 354.538 4.110 20 0 FIADRP c1cc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000488089564 1113852458 /nfs/dbraw/zinc/85/24/58/1113852458.db2.gz POVPIMNVMKTXSM-BHDDXSALSA-N 2 0 354.538 4.110 20 0 FIADRP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000488404294 1113923290 /nfs/dbraw/zinc/92/32/90/1113923290.db2.gz ZKLKPIHSUPANPW-LJQANCHMSA-N 2 0 369.336 4.025 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000488445349 1113933315 /nfs/dbraw/zinc/93/33/15/1113933315.db2.gz FRQKCBYZDFIVPS-PNJWGLBASA-N 2 0 358.570 4.439 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490167619 1114228600 /nfs/dbraw/zinc/22/86/00/1114228600.db2.gz LKKJWONOYZQLAN-XUZZJYLKSA-N 2 0 365.565 4.008 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490167617 1114228656 /nfs/dbraw/zinc/22/86/56/1114228656.db2.gz LKKJWONOYZQLAN-QPPBQGQZSA-N 2 0 365.565 4.008 20 0 FIADRP Cc1cc(C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)n(C)n1 ZINC000571780325 1114537190 /nfs/dbraw/zinc/53/71/90/1114537190.db2.gz VDHOKKGXUQVHEK-QFIPXVFZSA-N 2 0 372.532 4.211 20 0 FIADRP C[C@H](c1ccccc1Cl)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000588710760 1114601940 /nfs/dbraw/zinc/60/19/40/1114601940.db2.gz LARARRYYLMKYRW-IXDOHACOSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(F)c(Br)c1 ZINC000589835997 1114847425 /nfs/dbraw/zinc/84/74/25/1114847425.db2.gz CFLWTHGPWXALNC-CQSZACIVSA-N 2 0 357.311 4.332 20 0 FIADRP Cc1c(Cl)cccc1NC(=O)[C@H](C)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590787050 1114973944 /nfs/dbraw/zinc/97/39/44/1114973944.db2.gz RCUVRNOHGDEYFV-INIZCTEOSA-N 2 0 365.949 4.028 20 0 FIADRP CCC[C@H](NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1)c1ccccc1 ZINC000590786827 1114974335 /nfs/dbraw/zinc/97/43/35/1114974335.db2.gz NZXAPCYYLLWVOK-UGKGYDQZSA-N 2 0 373.585 4.085 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC(O)(c3ccccc3)CC2)CC1 ZINC000760909934 1115171508 /nfs/dbraw/zinc/17/15/08/1115171508.db2.gz TWPMYSOORWFSMM-VCERZCPPSA-N 2 0 370.581 4.450 20 0 FIADRP CSC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000593320215 1115322564 /nfs/dbraw/zinc/32/25/64/1115322564.db2.gz ATTKQRWUWQFRKY-QGZVFWFLSA-N 2 0 372.431 4.497 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)[C@@H]1C[C@H](C(=O)OC(C)(C)C)C1(C)C ZINC000594519095 1115458687 /nfs/dbraw/zinc/45/86/87/1115458687.db2.gz CWLNHVIVNMEVMO-RYQLBKOJSA-N 2 0 366.590 4.231 20 0 FIADRP CC(C)C[C@H](CNC(=O)c1ccc([C@H](C)[NH3+])cc1)[NH2+][C@@H](C)c1ccccc1 ZINC000575178045 1115546869 /nfs/dbraw/zinc/54/68/69/1115546869.db2.gz HJGCJRGEQVAAKV-NPPFBWRTSA-N 2 0 367.537 4.202 20 0 FIADRP COC(=O)c1oc(CNCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1C ZINC000597050433 1115638085 /nfs/dbraw/zinc/63/80/85/1115638085.db2.gz NHUNJWQUDMLXPR-KRWDZBQOSA-N 2 0 370.493 4.039 20 0 FIADRP CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2ccccc2-n2ccnc2)s1 ZINC000598957024 1115770860 /nfs/dbraw/zinc/77/08/60/1115770860.db2.gz GBPBEFDFNMSWLO-UHFFFAOYSA-N 2 0 369.490 4.179 20 0 FIADRP FC1(F)CCC[C@@H](C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000669685317 1115787201 /nfs/dbraw/zinc/78/72/01/1115787201.db2.gz SIJJQAWDJRAAEL-GOSISDBHSA-N 2 0 352.469 4.076 20 0 FIADRP CC(C)(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000605323456 1115885669 /nfs/dbraw/zinc/88/56/69/1115885669.db2.gz XIEWRRWVYYSGAU-IFMALSPDSA-N 2 0 374.569 4.092 20 0 FIADRP Cc1cccc(O[C@@H](C)C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000608064514 1116080336 /nfs/dbraw/zinc/08/03/36/1116080336.db2.gz CLBLASVPDXFEBZ-FQEVSTJZSA-N 2 0 368.521 4.027 20 0 FIADRP CCC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000534494174 1116207344 /nfs/dbraw/zinc/20/73/44/1116207344.db2.gz AMHYPZRVEASWJZ-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000535509441 1116313718 /nfs/dbraw/zinc/31/37/18/1116313718.db2.gz SHXQKIBYBULFRR-ZBEGNZNMSA-N 2 0 357.723 4.021 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)CC1 ZINC000462675454 1116389258 /nfs/dbraw/zinc/38/92/58/1116389258.db2.gz GSYAWHCNWREAAE-OAQYLSRUSA-N 2 0 365.565 4.086 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccccc2OCC(F)(F)F)C1 ZINC000462681878 1116390120 /nfs/dbraw/zinc/39/01/20/1116390120.db2.gz WGPBQTXFWGQVIW-CALCHBBNSA-N 2 0 372.475 4.475 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1N(C)C ZINC000539860475 1116391916 /nfs/dbraw/zinc/39/19/16/1116391916.db2.gz SKIXWYUKAWVEMQ-QGZVFWFLSA-N 2 0 357.567 4.377 20 0 FIADRP c1nc(-c2ccccc2)[nH]c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000539852082 1116393022 /nfs/dbraw/zinc/39/30/22/1116393022.db2.gz LVGVKMIWGWLXBQ-UHFFFAOYSA-N 2 0 352.526 4.165 20 0 FIADRP COc1ccc2cc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000539895373 1117739061 /nfs/dbraw/zinc/73/90/61/1117739061.db2.gz CSQNUOJRLZVMPQ-REWPJTCUSA-N 2 0 350.506 4.297 20 0 FIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000462796805 1117779419 /nfs/dbraw/zinc/77/94/19/1117779419.db2.gz XFXBTHRUISUTPR-YTFSRNRJSA-N 2 0 356.554 4.357 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000462799658 1117783899 /nfs/dbraw/zinc/78/38/99/1117783899.db2.gz VUJJHADUGPWFDS-KSEOMHKRSA-N 2 0 374.569 4.092 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000462803686 1117787178 /nfs/dbraw/zinc/78/71/78/1117787178.db2.gz CDYRIXNRZRDHLD-KNQAVFIVSA-N 2 0 362.533 4.395 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3ccccc3nc2C)CC1)CC1CC1 ZINC000540049104 1117830212 /nfs/dbraw/zinc/83/02/12/1117830212.db2.gz DMQQMXYRACPBGP-UHFFFAOYSA-N 2 0 366.553 4.272 20 0 FIADRP CCC1(C[NH2+][C@@H](C)c2cn(C)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000540142125 1117893616 /nfs/dbraw/zinc/89/36/16/1117893616.db2.gz PEUCMFRINLSREI-SFHVURJKSA-N 2 0 354.542 4.072 20 0 FIADRP CCC1(C[NH2+][C@@H](C)c2cnc(C)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000540142238 1117894950 /nfs/dbraw/zinc/89/49/50/1117894950.db2.gz UVEJIRSTFYAABU-SFHVURJKSA-N 2 0 366.553 4.436 20 0 FIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000540136439 1117900984 /nfs/dbraw/zinc/90/09/84/1117900984.db2.gz QHUYLKHAKJGOQU-GOSISDBHSA-N 2 0 353.510 4.438 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(-c2ccccc2)cc1 ZINC000540158408 1117903182 /nfs/dbraw/zinc/90/31/82/1117903182.db2.gz QUHVESKPOGMCKR-GLYQVZKVSA-N 2 0 364.533 4.382 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3ccccc32)[C@H](C)C1 ZINC000540169445 1117912129 /nfs/dbraw/zinc/91/21/29/1117912129.db2.gz TUTMNJQGOOOFLU-AUSIDOKSSA-N 2 0 354.538 4.109 20 0 FIADRP CC(C)O[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1(C)C ZINC000463023063 1117927734 /nfs/dbraw/zinc/92/77/34/1117927734.db2.gz GKSXCCGLTZTMBH-RBUKOAKNSA-N 2 0 350.572 4.142 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(NC(C)=O)c2)CC1)CC(C)C ZINC000540197437 1117937942 /nfs/dbraw/zinc/93/79/42/1117937942.db2.gz OWUMNWCZGHBKQF-UHFFFAOYSA-N 2 0 359.558 4.225 20 0 FIADRP C[NH+](C)CC[C@H]([NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C(C)(C)C ZINC000463124172 1117973747 /nfs/dbraw/zinc/97/37/47/1117973747.db2.gz FXPHNGICWFJOQX-FQEVSTJZSA-N 2 0 365.993 4.260 20 0 FIADRP CC(C)[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Nc1ccccc1 ZINC000463158811 1117988819 /nfs/dbraw/zinc/98/88/19/1117988819.db2.gz XSTMACYMFATPAT-XMMPIXPASA-N 2 0 365.565 4.420 20 0 FIADRP COC(=O)c1oc([C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1C ZINC000540337973 1117990446 /nfs/dbraw/zinc/99/04/46/1117990446.db2.gz IGAIDNJZUMBJGL-QGZVFWFLSA-N 2 0 362.514 4.024 20 0 FIADRP COc1cccc([C@@H](C)[NH2+][C@H](C)CC[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000540327442 1117994503 /nfs/dbraw/zinc/99/45/03/1117994503.db2.gz CXUYHYLSAQDUQQ-FGTMMUONSA-N 2 0 356.510 4.484 20 0 FIADRP CC(C)(C[NH2+]C1CCN(Cc2ccccc2Cl)CC1)C[NH+]1CCCC1 ZINC000463252682 1118062454 /nfs/dbraw/zinc/06/24/54/1118062454.db2.gz SDQWEZHRVJNBCA-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)c1ccccc1O2 ZINC000540491578 1118090575 /nfs/dbraw/zinc/09/05/75/1118090575.db2.gz FBPASDMLHHWQHO-FCEUIQTBSA-N 2 0 362.517 4.195 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000540596837 1118139944 /nfs/dbraw/zinc/13/99/44/1118139944.db2.gz JQKCEQKBJMYWSZ-FQEVSTJZSA-N 2 0 365.993 4.435 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(F)c1 ZINC000540986673 1118338162 /nfs/dbraw/zinc/33/81/62/1118338162.db2.gz XNGKKOGBLHZIOR-NRFANRHFSA-N 2 0 362.464 4.392 20 0 FIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000541156171 1118404262 /nfs/dbraw/zinc/40/42/62/1118404262.db2.gz VQPDGJGNFJMHDZ-UWJYYQICSA-N 2 0 363.977 4.187 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)C1CC[NH+](C)CC1 ZINC000312267199 1118406555 /nfs/dbraw/zinc/40/65/55/1118406555.db2.gz GELREKUOGJLAJN-FOIQADDNSA-N 2 0 373.541 4.341 20 0 FIADRP CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccncc1CC ZINC000541193411 1118414445 /nfs/dbraw/zinc/41/44/45/1118414445.db2.gz QCEOUGFJAZGQRA-OKZBNKHCSA-N 2 0 354.542 4.381 20 0 FIADRP Brc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000541221684 1118433937 /nfs/dbraw/zinc/43/39/37/1118433937.db2.gz LXRFKRBYVKYFNJ-LJQANCHMSA-N 2 0 363.343 4.291 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H](c2ccco2)c2ccccc2)cc1 ZINC000541544597 1118549936 /nfs/dbraw/zinc/54/99/36/1118549936.db2.gz WXSMVSSPHKZGRP-HSZRJFAPSA-N 2 0 364.489 4.142 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000541564054 1118556238 /nfs/dbraw/zinc/55/62/38/1118556238.db2.gz CMXXJNCYMVLDDB-HSZRJFAPSA-N 2 0 361.464 4.315 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC(=O)Nc2ccccc21 ZINC000541552110 1118559819 /nfs/dbraw/zinc/55/98/19/1118559819.db2.gz MEFBNLIECDVDJG-HXUWFJFHSA-N 2 0 351.494 4.090 20 0 FIADRP C[C@@H]([NH2+]CCOc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541602837 1118583461 /nfs/dbraw/zinc/58/34/61/1118583461.db2.gz BKNIUIWLKDUNRG-CABCVRRESA-N 2 0 354.897 4.101 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](CCCc2ccccc2Cl)CC1 ZINC000542277769 1118878614 /nfs/dbraw/zinc/87/86/14/1118878614.db2.gz VWKMVLFKOXWKHB-UHFFFAOYSA-N 2 0 352.950 4.095 20 0 FIADRP Cc1ccc(C[C@@H](C)[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)s1 ZINC000151889473 1118998078 /nfs/dbraw/zinc/99/80/78/1118998078.db2.gz VUZPPJCNOMNWAK-MRXNPFEDSA-N 2 0 357.567 4.312 20 0 FIADRP COc1cccc(CCC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000492469443 1119100025 /nfs/dbraw/zinc/10/00/25/1119100025.db2.gz XZSDOSLPIREMJS-UGKGYDQZSA-N 2 0 352.522 4.128 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000542464848 1119338976 /nfs/dbraw/zinc/33/89/76/1119338976.db2.gz LYGFYHVOCKXAJJ-QVKFZJNVSA-N 2 0 350.441 4.298 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000178012358 1119364963 /nfs/dbraw/zinc/36/49/63/1119364963.db2.gz OZBWDWNTKLUOQQ-GKVSMKOHSA-N 2 0 358.551 4.115 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000178134513 1119373067 /nfs/dbraw/zinc/37/30/67/1119373067.db2.gz VSMYYTMQGZMOCK-KSZLIROESA-N 2 0 354.542 4.057 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCc2cccc(OCc3ccccc3)c2)CC1 ZINC000311483406 1119376210 /nfs/dbraw/zinc/37/62/10/1119376210.db2.gz IFZHANWUYNQHKS-UHFFFAOYSA-N 2 0 352.522 4.271 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000178216258 1119377848 /nfs/dbraw/zinc/37/78/48/1119377848.db2.gz KOSIWDIGSRAVOA-JIZBTBOESA-N 2 0 369.475 4.250 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC000311771338 1119388930 /nfs/dbraw/zinc/38/89/30/1119388930.db2.gz GOFACDYYTCHQQF-KPDCDPCYSA-N 2 0 350.506 4.183 20 0 FIADRP COc1ccccc1C[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311859758 1119392625 /nfs/dbraw/zinc/39/26/25/1119392625.db2.gz UXICNPXCASZHOC-JQVVWYNYSA-N 2 0 352.522 4.126 20 0 FIADRP c1ccc(C[N@H+]2CCCC[C@H](C[NH2+][C@H]3CCCC34CCOCC4)C2)cc1 ZINC000311892245 1119393333 /nfs/dbraw/zinc/39/33/33/1119393333.db2.gz YPKVVOBZLJVWSK-YADHBBJMSA-N 2 0 356.554 4.228 20 0 FIADRP COCc1cccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000312048550 1119397642 /nfs/dbraw/zinc/39/76/42/1119397642.db2.gz AVZHJKGLYPITOH-QHCPKHFHSA-N 2 0 352.522 4.225 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(-n3ccnc3)cs2)CC1 ZINC000542465703 1119448398 /nfs/dbraw/zinc/44/83/98/1119448398.db2.gz JZDJXFAKNOTEKE-GOSISDBHSA-N 2 0 372.582 4.410 20 0 FIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000493969532 1119518504 /nfs/dbraw/zinc/51/85/04/1119518504.db2.gz NXUZTIPENWWKRO-XXBNENTESA-N 2 0 352.522 4.264 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000183197470 1119568434 /nfs/dbraw/zinc/56/84/34/1119568434.db2.gz PDHLEFUGGIWOCK-FGTMMUONSA-N 2 0 360.542 4.316 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183196461 1119568477 /nfs/dbraw/zinc/56/84/77/1119568477.db2.gz NHPKBHIHABRBKT-WAOWUJCRSA-N 2 0 366.553 4.484 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cncc(C)c2)CC1 ZINC000184346411 1119604389 /nfs/dbraw/zinc/60/43/89/1119604389.db2.gz XMGCDKIBFUJQFM-ROUUACIJSA-N 2 0 370.516 4.083 20 0 FIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000186593025 1119738430 /nfs/dbraw/zinc/73/84/30/1119738430.db2.gz PBXOSGNHDFVXHG-ROUUACIJSA-N 2 0 365.521 4.263 20 0 FIADRP COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)c1 ZINC000542484505 1119905788 /nfs/dbraw/zinc/90/57/88/1119905788.db2.gz HIPXXFPBPOTRDC-ZHRRBRCNSA-N 2 0 362.477 4.167 20 0 FIADRP COc1cccc(C[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)n1 ZINC000190843370 1119950805 /nfs/dbraw/zinc/95/08/05/1119950805.db2.gz GSAWODOLDPDDDT-UHFFFAOYSA-N 2 0 353.510 4.145 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCS2 ZINC000191547234 1119983685 /nfs/dbraw/zinc/98/36/85/1119983685.db2.gz JPOVLYGLMQDKSX-RZQQEMMASA-N 2 0 360.567 4.475 20 0 FIADRP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000192727617 1120078285 /nfs/dbraw/zinc/07/82/85/1120078285.db2.gz JZJUYAZFAHHKKK-GOTSBHOMSA-N 2 0 357.586 4.061 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000192832691 1120086332 /nfs/dbraw/zinc/08/63/32/1120086332.db2.gz SMAMVBAOFQGPRZ-OAHLLOKOSA-N 2 0 358.357 4.060 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCS2 ZINC000195133641 1120120123 /nfs/dbraw/zinc/12/01/23/1120120123.db2.gz ZYHVIROFDURBMO-WIYYLYMNSA-N 2 0 368.546 4.344 20 0 FIADRP COCCC[NH+]1CCC([NH2+]CCCc2c(Cl)cccc2Cl)CC1 ZINC000193288635 1120124990 /nfs/dbraw/zinc/12/49/90/1120124990.db2.gz BUESAXWERCWWIH-UHFFFAOYSA-N 2 0 359.341 4.017 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495078425 1120462845 /nfs/dbraw/zinc/46/28/45/1120462845.db2.gz JMZBTEOXUNTOKI-CVDCTZTESA-N 2 0 357.586 4.090 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000495089047 1120469094 /nfs/dbraw/zinc/46/90/94/1120469094.db2.gz XBZOKMYZHXXRHF-KNKQGSTJSA-N 2 0 362.533 4.251 20 0 FIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495105411 1120477188 /nfs/dbraw/zinc/47/71/88/1120477188.db2.gz BRMCMPBXMWGHLH-UWJYYQICSA-N 2 0 368.569 4.255 20 0 FIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495410139 1120788295 /nfs/dbraw/zinc/78/82/95/1120788295.db2.gz TYPRIYGSCDIKHJ-UNMCSNQZSA-N 3 0 369.597 4.284 20 0 FIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(Cl)c2)C[C@H](C)O1 ZINC000237623228 1120980341 /nfs/dbraw/zinc/98/03/41/1120980341.db2.gz QOSPTRDBFVITFY-IRXDYDNUSA-N 2 0 358.913 4.239 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2c[nH]c3cc(F)c(Cl)cc23)CC1 ZINC000624288950 1121017622 /nfs/dbraw/zinc/01/76/22/1121017622.db2.gz BCFCLEGETKMXOC-UHFFFAOYSA-N 2 0 351.897 4.355 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1COCc1ccccc1)C1CC[NH+](C)CC1 ZINC000155049616 1121175377 /nfs/dbraw/zinc/17/53/77/1121175377.db2.gz FLAPILSICAKAIV-IBGZPJMESA-N 2 0 352.522 4.223 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+]C3CCN(c4ccccc4)CC3)CC2)cc1 ZINC000397486148 1121185541 /nfs/dbraw/zinc/18/55/41/1121185541.db2.gz CCNMLGFSNLAGCX-UHFFFAOYSA-N 2 0 363.549 4.157 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1OCC ZINC000075780802 1121315871 /nfs/dbraw/zinc/31/58/71/1121315871.db2.gz HSHAGZJUTVRKIH-HNNXBMFYSA-N 2 0 366.933 4.101 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(SC(F)F)c(OC)c2)CC1 ZINC000765766281 1121378114 /nfs/dbraw/zinc/37/81/14/1121378114.db2.gz GLUNYKRBZONDAK-ZDUSSCGKSA-N 2 0 358.498 4.392 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+][C@H](CC[NH+](C)C)c3ccccc3)CCO2)cc1 ZINC001168585269 1121518263 /nfs/dbraw/zinc/51/82/63/1121518263.db2.gz GYWROEFWBTWCPT-MZYLBHOOSA-N 2 0 368.521 4.198 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000062427112 1121540793 /nfs/dbraw/zinc/54/07/93/1121540793.db2.gz LERYXOUHYVSUFB-FQEVSTJZSA-N 2 0 374.532 4.359 20 0 FIADRP CC(C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123549074 1121613811 /nfs/dbraw/zinc/61/38/11/1121613811.db2.gz XASVPRROWZZCMB-SFHVURJKSA-N 2 0 359.558 4.191 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(Cc3ccccc3)c2)c1 ZINC000123977002 1121651863 /nfs/dbraw/zinc/65/18/63/1121651863.db2.gz RTGLRJSLWIZHET-LJQANCHMSA-N 2 0 362.521 4.234 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC001649096261 1121758737 /nfs/dbraw/zinc/75/87/37/1121758737.db2.gz PROXPIDYEYZUKE-UHFFFAOYSA-N 2 0 366.427 4.384 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(C)cc2C[NH+](C)C)cc1 ZINC000072840154 1121905711 /nfs/dbraw/zinc/90/57/11/1121905711.db2.gz NNLVPIJZFHWIKV-UHFFFAOYSA-N 2 0 353.510 4.151 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2CC[NH+](C)CC2)CCC3)cc1 ZINC000126299831 1121943292 /nfs/dbraw/zinc/94/32/92/1121943292.db2.gz DPCDJMMCXQMPCS-GOSISDBHSA-N 2 0 371.550 4.128 20 0 FIADRP Cc1ccsc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126703703 1121978762 /nfs/dbraw/zinc/97/87/62/1121978762.db2.gz XEJQCRCDKYLYEF-CVEARBPZSA-N 2 0 361.530 4.359 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc(F)c(F)c2)cc1 ZINC000917008852 1121995343 /nfs/dbraw/zinc/99/53/43/1121995343.db2.gz SXGUFALSCXEEIA-AOMKIAJQSA-N 2 0 374.475 4.162 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3cc(F)ccc3F)cc2)CC1 ZINC000917000095 1121996098 /nfs/dbraw/zinc/99/60/98/1121996098.db2.gz PVVOQUWTACNXGX-JOCHJYFZSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)CCO2)cc1 ZINC001168616008 1122099703 /nfs/dbraw/zinc/09/97/03/1122099703.db2.gz QEERKWQTBIGAJH-GGAORHGYSA-N 2 0 372.553 4.160 20 0 FIADRP COc1ccc([C@H]2C[C@@H]([NH2+]CC3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168618149 1122154575 /nfs/dbraw/zinc/15/45/75/1122154575.db2.gz WPRWWVFAFPZVFT-RBBKRZOGSA-N 2 0 374.569 4.263 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(C)cc2C)c1 ZINC000056184867 1122298744 /nfs/dbraw/zinc/29/87/44/1122298744.db2.gz CXGHCZVDXXDCAV-IBGZPJMESA-N 2 0 367.537 4.262 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)C[C@H](C)[C@H]3CCC[NH2+]C3)c2C1 ZINC000262653104 1122335915 /nfs/dbraw/zinc/33/59/15/1122335915.db2.gz SCUXUQKVEFZBBW-ROUUACIJSA-N 2 0 357.542 4.013 20 0 FIADRP C[C@@H]1[C@H](C)N(C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000497658540 1122341571 /nfs/dbraw/zinc/34/15/71/1122341571.db2.gz ZHQFCQUOOYPEGP-MSOLQXFVSA-N 2 0 372.557 4.007 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cn1 ZINC000497820491 1122426795 /nfs/dbraw/zinc/42/67/95/1122426795.db2.gz OWJCWYKZJKPPSQ-QFIPXVFZSA-N 2 0 371.500 4.182 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497867178 1122453104 /nfs/dbraw/zinc/45/31/04/1122453104.db2.gz INCDKBFVPDUZLO-UWJYYQICSA-N 2 0 357.542 4.136 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@@H](C[NH+]2CCCC2)c2ccccc2)C[C@H]1c1ccccc1 ZINC000556053488 1122625795 /nfs/dbraw/zinc/62/57/95/1122625795.db2.gz TVUPZEYJAALGKY-HJOGWXRNSA-N 2 0 363.549 4.249 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)CC1 ZINC000556104641 1122657596 /nfs/dbraw/zinc/65/75/96/1122657596.db2.gz FQUPPNIMBZZSNO-XZOQPEGZSA-N 2 0 357.586 4.170 20 0 FIADRP Cn1ncc2c1CCC[C@H]2[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000129872211 1122706349 /nfs/dbraw/zinc/70/63/49/1122706349.db2.gz FEDBLYWWWRSYLK-JOCHJYFZSA-N 2 0 366.553 4.352 20 0 FIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000556417863 1122885913 /nfs/dbraw/zinc/88/59/13/1122885913.db2.gz JQKRVZYIRMHOEG-UHFFFAOYSA-N 2 0 372.940 4.332 20 0 FIADRP C[NH2+]C1CCC([N@H+](C)Cc2ccc(Br)c(Cl)c2F)CC1 ZINC001236214242 1123063190 /nfs/dbraw/zinc/06/31/90/1123063190.db2.gz ABMITSFHTHAMGB-UHFFFAOYSA-N 2 0 363.702 4.204 20 0 FIADRP CCC[C@H](CCO)C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000556871812 1123152903 /nfs/dbraw/zinc/15/29/03/1123152903.db2.gz MXXHRQKNRHDLBI-XBYSBRQOSA-N 2 0 358.570 4.066 20 0 FIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1 ZINC000556889467 1123174800 /nfs/dbraw/zinc/17/48/00/1123174800.db2.gz HSFPGQKGNJHIOK-DVECYGJZSA-N 2 0 366.549 4.303 20 0 FIADRP CSc1cccc(F)c1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000556911923 1123210325 /nfs/dbraw/zinc/21/03/25/1123210325.db2.gz KTSDACYBODDJKA-OAHLLOKOSA-N 2 0 362.514 4.339 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1ccc2n[nH]cc2c1 ZINC000556923533 1123233072 /nfs/dbraw/zinc/23/30/72/1123233072.db2.gz KWIJFDYDYRLPFL-RAQQXGOJSA-N 2 0 360.505 4.124 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC(CCC[NH+](C)C)CC2)cc1)C(C)C ZINC000132498383 1123271428 /nfs/dbraw/zinc/27/14/28/1123271428.db2.gz HAGZUSPDEKFVAY-UHFFFAOYSA-N 2 0 373.585 4.111 20 0 FIADRP CCC(CC)[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)C ZINC000499146318 1123288069 /nfs/dbraw/zinc/28/80/69/1123288069.db2.gz KUOQYSVYUBGFKU-BXXSPATCSA-N 2 0 357.586 4.138 20 0 FIADRP CC(C)(CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000499149339 1123292774 /nfs/dbraw/zinc/29/27/74/1123292774.db2.gz UZFXQVLLUNZXPR-KOUNCHBCSA-N 2 0 355.570 4.036 20 0 FIADRP CCc1nc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1C ZINC000499163954 1123301575 /nfs/dbraw/zinc/30/15/75/1123301575.db2.gz JIWGDMBZOBABLS-ACDBMABISA-N 2 0 369.578 4.342 20 0 FIADRP Cc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4C[C@H]([NH+](C)C)CC[C@H]43)s2)cc1 ZINC000557013837 1123308720 /nfs/dbraw/zinc/30/87/20/1123308720.db2.gz KZRICRPFQJQPRW-HMXCVIKNSA-N 2 0 370.562 4.407 20 0 FIADRP Cc1cc(F)ccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499191623 1123320123 /nfs/dbraw/zinc/32/01/23/1123320123.db2.gz MGRSUAFKIOKRIM-NUNAXRQHSA-N 2 0 352.497 4.462 20 0 FIADRP C[NH+](C)CC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000499217779 1123333326 /nfs/dbraw/zinc/33/33/26/1123333326.db2.gz WONJHVRJFMLZTB-KJJMTIBFSA-N 3 0 357.586 4.138 20 0 FIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Oc1ccccc1 ZINC000499232165 1123340698 /nfs/dbraw/zinc/34/06/98/1123340698.db2.gz GOWJZYVXIDNGMG-UVUJQTEASA-N 2 0 350.506 4.239 20 0 FIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccccc2)cc1 ZINC000132827207 1123365877 /nfs/dbraw/zinc/36/58/77/1123365877.db2.gz UPFIRKHZLRPZRD-URXFXBBRSA-N 2 0 364.533 4.061 20 0 FIADRP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H](N[C@H]2CC[N@@H+](CC4CCCC4)C2)C3)cc1 ZINC000499256251 1123367130 /nfs/dbraw/zinc/36/71/30/1123367130.db2.gz PAJBZMAPPSKBJU-NEWJYFPISA-N 2 0 367.581 4.036 20 0 FIADRP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H](N[C@@H]2CC[N@@H+](CC4CCCC4)C2)C3)cc1 ZINC000499256253 1123367168 /nfs/dbraw/zinc/36/71/68/1123367168.db2.gz PAJBZMAPPSKBJU-YCAMKHIRSA-N 2 0 367.581 4.036 20 0 FIADRP Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000920179161 1123396158 /nfs/dbraw/zinc/39/61/58/1123396158.db2.gz BNLVXQAUFIUORY-KRWDZBQOSA-N 2 0 374.960 4.436 20 0 FIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cn1 ZINC000133396925 1123483665 /nfs/dbraw/zinc/48/36/65/1123483665.db2.gz VYHWLPBCVVOETB-GOSISDBHSA-N 2 0 362.521 4.482 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCOC1 ZINC000133428765 1123485814 /nfs/dbraw/zinc/48/58/14/1123485814.db2.gz STIZAVCPOXSMJG-XXBNENTESA-N 2 0 364.533 4.464 20 0 FIADRP CCCCOc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1OCC ZINC000236729627 1123556975 /nfs/dbraw/zinc/55/69/75/1123556975.db2.gz RCQBEYFYEJVTOD-IHWFROFDSA-N 2 0 360.542 4.369 20 0 FIADRP CC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2C)CC1 ZINC000236831291 1123573381 /nfs/dbraw/zinc/57/33/81/1123573381.db2.gz BBWBQSXKBUZDBK-UHFFFAOYSA-N 2 0 374.532 4.422 20 0 FIADRP CC[C@@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C1 ZINC000236969341 1123586912 /nfs/dbraw/zinc/58/69/12/1123586912.db2.gz HTUVPGWDTOABBD-CTNGQTDRSA-N 2 0 374.569 4.235 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000134172013 1123599832 /nfs/dbraw/zinc/59/98/32/1123599832.db2.gz SUWUSMIBSCZOFA-UHFFFAOYSA-N 2 0 368.525 4.213 20 0 FIADRP Clc1ccc(-c2n[nH]cc2C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000134209038 1123605745 /nfs/dbraw/zinc/60/57/45/1123605745.db2.gz SPMHISRTKSEKFG-UHFFFAOYSA-N 2 0 358.917 4.038 20 0 FIADRP Cc1nccn1C[C@@H](C)C[NH2+]Cc1cn(-c2ccccc2)nc1C(C)(C)C ZINC000237419536 1123628156 /nfs/dbraw/zinc/62/81/56/1123628156.db2.gz WFLGLQSRSXFKHI-KRWDZBQOSA-N 2 0 365.525 4.101 20 0 FIADRP COc1ccc(OCCC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000078704690 1123800474 /nfs/dbraw/zinc/80/04/74/1123800474.db2.gz PDCRYLAKVAUYFM-WOJBJXKFSA-N 2 0 360.542 4.051 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4[nH]ccc43)cc2)C[C@@H](C)O1 ZINC000237577750 1123988914 /nfs/dbraw/zinc/98/89/14/1123988914.db2.gz WWUDQVPUDANEND-QZTJIDSGSA-N 2 0 363.505 4.067 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@@H](C)C1 ZINC000245445710 1124035257 /nfs/dbraw/zinc/03/52/57/1124035257.db2.gz ZDSXSJDVIZYNHR-PGRDOPGGSA-N 2 0 365.521 4.101 20 0 FIADRP OCCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000245642335 1124158869 /nfs/dbraw/zinc/15/88/69/1124158869.db2.gz AZQRXMJWKMAMHG-KOUNCHBCSA-N 2 0 356.554 4.105 20 0 FIADRP CCOCCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000245654053 1124168474 /nfs/dbraw/zinc/16/84/74/1124168474.db2.gz DDMDBHLDRFSOFR-KOUNCHBCSA-N 2 0 356.554 4.369 20 0 FIADRP COc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245682683 1124193681 /nfs/dbraw/zinc/19/36/81/1124193681.db2.gz JBTFSLNIQNLGRY-KOUNCHBCSA-N 2 0 350.506 4.023 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ncc(Br)s1 ZINC000245701782 1124209591 /nfs/dbraw/zinc/20/95/91/1124209591.db2.gz WSWKTZBCSMSABE-QWHCGFSZSA-N 2 0 360.365 4.211 20 0 FIADRP CN(Cc1cccc(OC(C)(C)C)n1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000508891349 1124217686 /nfs/dbraw/zinc/21/76/86/1124217686.db2.gz LNKQXDBMUTUTJB-UHFFFAOYSA-N 2 0 367.537 4.355 20 0 FIADRP c1cnn([C@@H]2CCCC[C@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245777230 1124246965 /nfs/dbraw/zinc/24/69/65/1124246965.db2.gz YINVJLKHYSORAP-PFDCGNQRSA-N 2 0 364.537 4.152 20 0 FIADRP C[C@H](C[C@@H]1CCOC1)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000765895169 1124338419 /nfs/dbraw/zinc/33/84/19/1124338419.db2.gz DEPHBIIWYIRHJG-OFNKIYASSA-N 2 0 358.570 4.126 20 0 FIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1C ZINC000542852111 1124465040 /nfs/dbraw/zinc/46/50/40/1124465040.db2.gz QPCMNONXZYERAX-NFBKMPQASA-N 2 0 366.549 4.419 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000246584098 1124536509 /nfs/dbraw/zinc/53/65/09/1124536509.db2.gz YWNAJUNHVYGPBI-MJXNMMHHSA-N 2 0 371.352 4.412 20 0 FIADRP COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000246805632 1124562427 /nfs/dbraw/zinc/56/24/27/1124562427.db2.gz AHWSGHCEMWOZDJ-CEXWTWQISA-N 2 0 368.521 4.155 20 0 FIADRP Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000246966468 1124576760 /nfs/dbraw/zinc/57/67/60/1124576760.db2.gz IVXNCBWEANWBPH-KURKYZTESA-N 2 0 354.542 4.057 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000246996031 1124579723 /nfs/dbraw/zinc/57/97/23/1124579723.db2.gz KKBKRAMKAHPFGL-CEXWTWQISA-N 2 0 368.521 4.155 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCc4ccccc43)cc2)C[C@@H](C)O1 ZINC000247111009 1124590946 /nfs/dbraw/zinc/59/09/46/1124590946.db2.gz QNSFWKMFYYHING-PNCHPQGNSA-N 2 0 350.506 4.073 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000248396052 1124760534 /nfs/dbraw/zinc/76/05/34/1124760534.db2.gz GSSAIRGZWAVIIX-ZINXYGQCSA-N 2 0 367.537 4.285 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248454496 1124771777 /nfs/dbraw/zinc/77/17/77/1124771777.db2.gz ZKUIYLUBNJQXIH-KOUNCHBCSA-N 2 0 359.517 4.496 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CCC2 ZINC000248456383 1124772002 /nfs/dbraw/zinc/77/20/02/1124772002.db2.gz SFTQVWOJHJWXRA-LADGPHEKSA-N 2 0 364.533 4.119 20 0 FIADRP COc1cccc2[nH]cc(CC[NH2+]C3CC[NH+]([C@@H]4CCC[C@H](C)C4)CC3)c21 ZINC000181331843 1124862435 /nfs/dbraw/zinc/86/24/35/1124862435.db2.gz GCZGWFQZEAUQIE-FXAWDEMLSA-N 2 0 369.553 4.352 20 0 FIADRP COc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000090468911 1124998285 /nfs/dbraw/zinc/99/82/85/1124998285.db2.gz CQEHBIRJOBDSQQ-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccs1 ZINC000090523565 1125001785 /nfs/dbraw/zinc/00/17/85/1125001785.db2.gz VXFZUAIGDOGFTA-FHWLQOOXSA-N 2 0 350.572 4.193 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1OC ZINC000090775246 1125020319 /nfs/dbraw/zinc/02/03/19/1125020319.db2.gz WNCFESGCAQPSJK-QHGAOEGBSA-N 2 0 360.542 4.398 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H](CO)c2ccc(Cl)cc2)CC1 ZINC000672620779 1125198198 /nfs/dbraw/zinc/19/81/98/1125198198.db2.gz ZFHKECPGXNUSJB-MMOPVJDHSA-N 2 0 364.961 4.049 20 0 FIADRP C[C@H](c1cccc(O)c1)[N@H+](C)C/C=C\C[NH+](C)[C@@H](C)c1cccc(O)c1 ZINC000255165600 1125209257 /nfs/dbraw/zinc/20/92/57/1125209257.db2.gz CIQQRCAGPRWCLO-SPCWZHTESA-N 2 0 354.494 4.340 20 0 FIADRP CC(C)[NH+](C/C=C\C[N@H+](Cc1ccccn1)C(C)C)Cc1ccccn1 ZINC000618613217 1125215158 /nfs/dbraw/zinc/21/51/58/1125215158.db2.gz VSVQKLWYVHEUTJ-KTKRTIGZSA-N 2 0 352.526 4.154 20 0 FIADRP COCCc1nc(C)c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)s1 ZINC000092766904 1125242072 /nfs/dbraw/zinc/24/20/72/1125242072.db2.gz PIDAJOURXSRJFT-MRXNPFEDSA-N 2 0 367.603 4.049 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2ccccc2)c1 ZINC000093065965 1125264156 /nfs/dbraw/zinc/26/41/56/1125264156.db2.gz AYKMXNILZKQBGO-UHFFFAOYSA-N 2 0 362.521 4.217 20 0 FIADRP Oc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000312010648 568233166 /nfs/dbraw/zinc/23/31/66/568233166.db2.gz RSYITHVEBYTHCC-XXBNENTESA-N 2 0 350.506 4.271 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)cc1 ZINC000563154074 568305131 /nfs/dbraw/zinc/30/51/31/568305131.db2.gz JEMDBOWZQMQTHV-QGZVFWFLSA-N 2 0 365.702 4.338 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)NC2CC[NH+](CC3CC3)CC2)ccc1OC ZINC000182507100 1125539818 /nfs/dbraw/zinc/53/98/18/1125539818.db2.gz SEQDOMADJUIPEF-GOSISDBHSA-N 2 0 373.585 4.062 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4c3CCC4)cc2)C[C@@H](C)O1 ZINC001648785906 1079577923 /nfs/dbraw/zinc/57/79/23/1079577923.db2.gz LBLOSJDIVYPRAN-RTBURBONSA-N 2 0 364.533 4.074 20 0 FIADRP c1cc(-c2ncc(C[NH2+]CCCN3CCc4ccccc4C3)s2)cs1 ZINC001648785973 1079585827 /nfs/dbraw/zinc/58/58/27/1079585827.db2.gz OPGWGAVTXGNWRK-UHFFFAOYSA-N 2 0 369.559 4.410 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2CC[NH2+]C4(CCC4)C2)CCC3)cc1 ZINC000643545823 1079658453 /nfs/dbraw/zinc/65/84/53/1079658453.db2.gz COQXRDOZAYJNDF-SJORKVTESA-N 2 0 353.535 4.452 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCc2cc(Cl)ccc2Br)CC1 ZINC000544829853 1079667980 /nfs/dbraw/zinc/66/79/80/1079667980.db2.gz SYVRWIIUJFXDOI-UHFFFAOYSA-N 2 0 359.739 4.107 20 0 FIADRP FC(F)(F)Oc1cccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C2CC2)c1 ZINC000643547458 1079677011 /nfs/dbraw/zinc/67/70/11/1079677011.db2.gz FTJHKADCRQQSPS-RDJZCZTQSA-N 2 0 354.416 4.301 20 0 FIADRP Brc1ccccc1C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643547238 1079678005 /nfs/dbraw/zinc/67/80/05/1079678005.db2.gz BSOHHACQNCDQIP-AEFFLSMTSA-N 2 0 363.343 4.035 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000180110435 1080449433 /nfs/dbraw/zinc/44/94/33/1080449433.db2.gz JQMILCOEVPWARA-XMMPIXPASA-N 2 0 365.565 4.092 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc2ccccc2c1 ZINC000180642205 1080532021 /nfs/dbraw/zinc/53/20/21/1080532021.db2.gz VMMHKDSPCDHYHF-KOSHJBKYSA-N 2 0 360.501 4.257 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)CC3 ZINC000180808715 1080550540 /nfs/dbraw/zinc/55/05/40/1080550540.db2.gz SFEKCWBYIIILJW-IBGZPJMESA-N 2 0 374.532 4.235 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3COCC[C@H]3C2)cc1 ZINC001648795415 1080795857 /nfs/dbraw/zinc/79/58/57/1080795857.db2.gz OGUORQJEHUUYKZ-YJSIEXFISA-N 2 0 356.554 4.356 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]CC2(c3ccc(F)cc3)CCCC2)cc1 ZINC001648808260 1081111514 /nfs/dbraw/zinc/11/15/14/1081111514.db2.gz HMZHDQPOJAHZRG-UHFFFAOYSA-N 2 0 370.512 4.368 20 0 FIADRP c1csc(C([NH2+]C2CCN(C[C@@H]3CCCO3)CC2)c2cccs2)c1 ZINC000655729568 1081147001 /nfs/dbraw/zinc/14/70/01/1081147001.db2.gz KLOROOCZNCAEPG-INIZCTEOSA-N 2 0 362.564 4.132 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805433 1081210710 /nfs/dbraw/zinc/21/07/10/1081210710.db2.gz OBMUSRPJYFNUDD-NOSGZIGASA-N 2 0 369.372 4.162 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000655805059 1081211605 /nfs/dbraw/zinc/21/16/05/1081211605.db2.gz AQWYISNNYDLYMM-VBQJREDUSA-N 2 0 359.514 4.256 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000655804954 1081211741 /nfs/dbraw/zinc/21/17/41/1081211741.db2.gz GYXJCRWGYLPMNA-XORNHQRDSA-N 2 0 363.480 4.393 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc(Br)c2)C1 ZINC000655804375 1081213716 /nfs/dbraw/zinc/21/37/16/1081213716.db2.gz WUOYDRSBDTZFMB-UIAACRFSSA-N 2 0 373.338 4.468 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805899 1081214499 /nfs/dbraw/zinc/21/44/99/1081214499.db2.gz UKZOYIJOQMTMQH-WEYGHZABSA-N 2 0 356.485 4.048 20 0 FIADRP Cc1cc(C)c(NC(=O)CCC[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC000137691413 1081275363 /nfs/dbraw/zinc/27/53/63/1081275363.db2.gz XQZCUJGUNHQPLJ-FQEVSTJZSA-N 2 0 359.558 4.137 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(OC)cc3c2C1 ZINC000122998332 1081420007 /nfs/dbraw/zinc/42/00/07/1081420007.db2.gz FWELKIOZHBFWNZ-IAGOWNOFSA-N 2 0 357.542 4.134 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](Cc2nccn2C)c2ccccc2)cc1F ZINC000683772744 1081535764 /nfs/dbraw/zinc/53/57/64/1081535764.db2.gz QFLBLRHXLJPYMJ-IBGZPJMESA-N 2 0 353.441 4.032 20 0 FIADRP CC(C)[NH2+]C1CC[NH+](CC/C=C\c2ccc(Br)cc2)CC1 ZINC000255102326 1081580597 /nfs/dbraw/zinc/58/05/97/1081580597.db2.gz SANGFVIOEDRQPZ-HYXAFXHYSA-N 2 0 351.332 4.315 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000580357602 1081898481 /nfs/dbraw/zinc/89/84/81/1081898481.db2.gz IICMPBFPJDMMFB-UHFFFAOYSA-N 2 0 367.537 4.012 20 0 FIADRP CCCOc1ccc(Oc2ncccc2C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000656194260 1081901894 /nfs/dbraw/zinc/90/18/94/1081901894.db2.gz FPBCBBGFLRIVBK-QZTJIDSGSA-N 2 0 355.482 4.022 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000656201930 1081910807 /nfs/dbraw/zinc/91/08/07/1081910807.db2.gz VKWZCEDLRHCINV-CYBMUJFWSA-N 2 0 365.399 4.087 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cc4ccccc4[nH]3)cc2)C[C@@H](C)O1 ZINC000683927262 1081929239 /nfs/dbraw/zinc/92/92/39/1081929239.db2.gz ICANOOUDXPCYFU-QZTJIDSGSA-N 2 0 363.505 4.067 20 0 FIADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 ZINC000580570535 1082021410 /nfs/dbraw/zinc/02/14/10/1082021410.db2.gz BXOZNOQPCRZLDB-GJZGRUSLSA-N 2 0 365.399 4.252 20 0 FIADRP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](CCc2ccc(C(C)(C)C)cc2)CC1 ZINC000580745974 1082119864 /nfs/dbraw/zinc/11/98/64/1082119864.db2.gz DBSABHFRJRYEOS-SFTDATJTSA-N 2 0 371.613 4.017 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000127421186 1082218106 /nfs/dbraw/zinc/21/81/06/1082218106.db2.gz SSMWHEIVTMVQSZ-QUCCMNQESA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000127562062 1082225861 /nfs/dbraw/zinc/22/58/61/1082225861.db2.gz LJNILNBFIGFADB-UYAOXDASSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)C[C@H](c2ccccc2)C1 ZINC000128079779 1082295680 /nfs/dbraw/zinc/29/56/80/1082295680.db2.gz MUMSLNUMWDOWPN-XKCSPQBFSA-N 2 0 369.597 4.107 20 0 FIADRP CSc1ccc2c(c1)[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)CCC2 ZINC000581131715 1082335234 /nfs/dbraw/zinc/33/52/34/1082335234.db2.gz OVKDKVLWDAJFPB-SFHVURJKSA-N 2 0 350.597 4.203 20 0 FIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000656677446 1082709852 /nfs/dbraw/zinc/70/98/52/1082709852.db2.gz OGFZOGPFGICFAH-HXUWFJFHSA-N 2 0 350.934 4.272 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000656677786 1082711732 /nfs/dbraw/zinc/71/17/32/1082711732.db2.gz PYHRYJGZVSSAFJ-CQSZACIVSA-N 2 0 354.897 4.021 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1Cl ZINC000656683739 1082717588 /nfs/dbraw/zinc/71/75/88/1082717588.db2.gz QALVRJAJGAGPNE-INIZCTEOSA-N 2 0 373.928 4.306 20 0 FIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000684367035 1082768350 /nfs/dbraw/zinc/76/83/50/1082768350.db2.gz KQOFVJILNXFVFS-FCHUYYIVSA-N 2 0 352.522 4.462 20 0 FIADRP COc1ccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)cc1 ZINC000656784047 1082768691 /nfs/dbraw/zinc/76/86/91/1082768691.db2.gz CGVXKIPYJMJICK-SFHVURJKSA-N 2 0 371.550 4.030 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CCC2 ZINC000684420958 1082895877 /nfs/dbraw/zinc/89/58/77/1082895877.db2.gz YWLPIWZHSHTHBU-QHCPKHFHSA-N 2 0 368.496 4.468 20 0 FIADRP CC[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)c1c(C)nn(C)c1C ZINC000581884023 1082970723 /nfs/dbraw/zinc/97/07/23/1082970723.db2.gz ODGLYAAIEWYUPT-LEWJYISDSA-N 2 0 366.553 4.275 20 0 FIADRP CC(C)(C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000647192124 1082976463 /nfs/dbraw/zinc/97/64/63/1082976463.db2.gz QVLLUDPBOSKWRD-RTWAWAEBSA-N 2 0 356.554 4.369 20 0 FIADRP CC(C)(C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000647192125 1082976584 /nfs/dbraw/zinc/97/65/84/1082976584.db2.gz QVLLUDPBOSKWRD-SFTDATJTSA-N 2 0 356.554 4.369 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc1Br ZINC000131798712 1083136854 /nfs/dbraw/zinc/13/68/54/1083136854.db2.gz ZAKRPZLZBIZNFW-WWTUQBGBSA-N 2 0 367.331 4.124 20 0 FIADRP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000430922872 1083237381 /nfs/dbraw/zinc/23/73/81/1083237381.db2.gz CREZHEZBEFXFAT-IAGOWNOFSA-N 2 0 351.494 4.059 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC([C@@H](C)[NH3+])CC2)c1 ZINC000430965546 1083260220 /nfs/dbraw/zinc/26/02/20/1083260220.db2.gz KEIGURBZBPIYQS-XMSQKQJNSA-N 2 0 365.521 4.042 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCc3cccnc3CC2)C[N@@H+]1Cc1ccccc1 ZINC000421836280 1083433710 /nfs/dbraw/zinc/43/37/10/1083433710.db2.gz ODSQKONXIQMAAG-KJXAQDMKSA-N 2 0 363.549 4.219 20 0 FIADRP CCCCCn1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)n1 ZINC000548482327 1083454514 /nfs/dbraw/zinc/45/45/14/1083454514.db2.gz CWKRQROKWKOWOG-SIKLNZKXSA-N 2 0 368.569 4.382 20 0 FIADRP Cc1nccn1CCC[NH2+][C@@H]1CCc2c1cc(Br)cc2Cl ZINC000510946560 1083523403 /nfs/dbraw/zinc/52/34/03/1083523403.db2.gz PDICQBZTSXSEHI-MRXNPFEDSA-N 2 0 368.706 4.275 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000535777580 1083651121 /nfs/dbraw/zinc/65/11/21/1083651121.db2.gz MWYHGGHRHLGTAW-UEVCKROQSA-N 2 0 363.549 4.122 20 0 FIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCCC2)cc1 ZINC000132977327 1083982867 /nfs/dbraw/zinc/98/28/67/1083982867.db2.gz OFQNECJYHQBQKT-ZJSXRUAMSA-N 2 0 370.581 4.269 20 0 FIADRP COc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(Br)c1 ZINC001140761006 1084064950 /nfs/dbraw/zinc/06/49/50/1084064950.db2.gz AOXZQJOFIDZBLL-UHFFFAOYSA-N 2 0 369.347 4.010 20 0 FIADRP Clc1ccc(C[C@H](NCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000511381872 1084101231 /nfs/dbraw/zinc/10/12/31/1084101231.db2.gz KFGUYLILJBXOGV-NRFANRHFSA-N 2 0 357.929 4.484 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+][C@H]3CCc4nc(C(C)(C)C)cn4C3)cc2c1C ZINC000472035387 1084125299 /nfs/dbraw/zinc/12/52/99/1084125299.db2.gz QBRPXMSICBADJA-INIZCTEOSA-N 2 0 350.510 4.383 20 0 FIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000511010136 1084141327 /nfs/dbraw/zinc/14/13/27/1084141327.db2.gz IBTUFOLOQOMIGY-OAHLLOKOSA-N 2 0 354.460 4.491 20 0 FIADRP CC[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC[C@H]1[NH3+] ZINC000647497523 1084252056 /nfs/dbraw/zinc/25/20/56/1084252056.db2.gz JSXVBCSMQGYPKY-OXQOHEQNSA-N 2 0 371.912 4.152 20 0 FIADRP Fc1ccc(OC(F)F)c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000657296439 1084292629 /nfs/dbraw/zinc/29/26/29/1084292629.db2.gz HVAWXVUTIPKPNR-UHFFFAOYSA-N 2 0 364.411 4.313 20 0 FIADRP Fc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1OC(F)F ZINC000657298013 1084297791 /nfs/dbraw/zinc/29/77/91/1084297791.db2.gz SDRFAJBVFBUXQG-UHFFFAOYSA-N 2 0 364.411 4.313 20 0 FIADRP Cc1c(Br)cncc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000657298448 1084304948 /nfs/dbraw/zinc/30/49/48/1084304948.db2.gz UUEWLLRQVJJMBW-UHFFFAOYSA-N 2 0 374.326 4.038 20 0 FIADRP C[C@H](NCc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cc2n(n1)CCC2 ZINC000414055552 1084376945 /nfs/dbraw/zinc/37/69/45/1084376945.db2.gz CQORJYUSHVHLJY-MSOLQXFVSA-N 2 0 352.526 4.055 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc2c(s1)CCCC2 ZINC000537970690 1084381355 /nfs/dbraw/zinc/38/13/55/1084381355.db2.gz HLFLKRPZLLCJRY-IXDOHACOSA-N 2 0 350.572 4.167 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)c1 ZINC000657309355 1084398696 /nfs/dbraw/zinc/39/86/96/1084398696.db2.gz BRSGJZVEXBVZOT-UHFFFAOYSA-N 2 0 358.551 4.416 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000657310865 1084408006 /nfs/dbraw/zinc/40/80/06/1084408006.db2.gz QLTRATKLFJINSA-KRWDZBQOSA-N 2 0 358.551 4.416 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c(C)n1 ZINC000157630684 1084422751 /nfs/dbraw/zinc/42/27/51/1084422751.db2.gz RIKCBKOXPMBHRL-IRXDYDNUSA-N 2 0 352.526 4.176 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(NCc3ccnn3-c3cc[nH+]cc3)cc2)C1 ZINC000657320951 1084543042 /nfs/dbraw/zinc/54/30/42/1084543042.db2.gz KHNRYIAUBNNRML-GOSISDBHSA-N 2 0 361.493 4.111 20 0 FIADRP Clc1cccc([C@@H]2CC[C@H]([NH2+]CC3(N4CCCC4)CCOCC3)C2)c1 ZINC000414124195 1084628337 /nfs/dbraw/zinc/62/83/37/1084628337.db2.gz PFJNXIAUQOBHIJ-QUCCMNQESA-N 2 0 362.945 4.211 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cccc4ccccc43)CC2)C[C@@H](C)O1 ZINC000072085637 1084655021 /nfs/dbraw/zinc/65/50/21/1084655021.db2.gz BCVFGDZCVQNRNK-RTBURBONSA-N 2 0 352.522 4.161 20 0 FIADRP C[C@@H](NCc1ccn(-c2ccc(Cl)cc2)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000467185403 1084659204 /nfs/dbraw/zinc/65/92/04/1084659204.db2.gz FFKOTSKFTDTLDX-SJORKVTESA-N 2 0 372.944 4.268 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2nccn2C2CC2)cc1 ZINC000892541111 1084668823 /nfs/dbraw/zinc/66/88/23/1084668823.db2.gz YYVNSNWFSSNWHB-UHFFFAOYSA-N 2 0 360.505 4.236 20 0 FIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)[nH]c2c1 ZINC000657351324 1084685190 /nfs/dbraw/zinc/68/51/90/1084685190.db2.gz CJGDQOYOHLQKES-UHFFFAOYSA-N 2 0 351.494 4.097 20 0 FIADRP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)C2)cc1 ZINC000684766509 1084688175 /nfs/dbraw/zinc/68/81/75/1084688175.db2.gz BWDUJFJBPVWIBY-HZCBDIJESA-N 2 0 350.506 4.197 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cccc(Br)c21 ZINC000414145983 1084697957 /nfs/dbraw/zinc/69/79/57/1084697957.db2.gz BNWMMFITUWBTSY-YVEFUNNKSA-N 2 0 356.267 4.435 20 0 FIADRP COCc1csc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000657356894 1084709556 /nfs/dbraw/zinc/70/95/56/1084709556.db2.gz IOGLQZBVELVBLF-IHWFROFDSA-N 2 0 356.535 4.180 20 0 FIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OC ZINC000414162065 1084719033 /nfs/dbraw/zinc/71/90/33/1084719033.db2.gz CUELDBJUFVTVAU-MRXNPFEDSA-N 2 0 353.466 4.373 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000414173485 1084739050 /nfs/dbraw/zinc/73/90/50/1084739050.db2.gz FSFJQVJXAJLVNI-UTKZUKDTSA-N 2 0 357.929 4.340 20 0 FIADRP Brc1ccc([C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)C2CC2)cc1 ZINC000414184200 1084762207 /nfs/dbraw/zinc/76/22/07/1084762207.db2.gz NRGFSBLETVSIIM-SFHVURJKSA-N 2 0 356.267 4.338 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(-c3ccc(OC)cc3)no2)CC1 ZINC000613491607 1084825255 /nfs/dbraw/zinc/82/52/55/1084825255.db2.gz YRKVEWBPADRZDX-UHFFFAOYSA-N 2 0 371.525 4.294 20 0 FIADRP CCC1(C[NH2+]Cc2nccn2C(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000657415172 1084950613 /nfs/dbraw/zinc/95/06/13/1084950613.db2.gz ARXHPJGAOCWAKG-UHFFFAOYSA-N 2 0 354.542 4.246 20 0 FIADRP Cc1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)nn1C ZINC000414272822 1084952964 /nfs/dbraw/zinc/95/29/64/1084952964.db2.gz OCKNCOOXGKOFKM-UHFFFAOYSA-N 2 0 374.532 4.281 20 0 FIADRP Fc1cc(F)cc(O[C@@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000582563171 1085147197 /nfs/dbraw/zinc/14/71/97/1085147197.db2.gz ZAIJWNANIBPKSN-LEWJYISDSA-N 2 0 364.480 4.261 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000684954695 1085298782 /nfs/dbraw/zinc/29/87/82/1085298782.db2.gz CRLMXRLSXFZDRM-PGRDOPGGSA-N 2 0 368.496 4.323 20 0 FIADRP Fc1cncc([C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000684955566 1085300933 /nfs/dbraw/zinc/30/09/33/1085300933.db2.gz QABUXRGNORKVOL-XMSQKQJNSA-N 2 0 353.485 4.174 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651720625 1085412634 /nfs/dbraw/zinc/41/26/34/1085412634.db2.gz GKRSYZYIHYXSFU-ZCNNSNEGSA-N 2 0 367.537 4.289 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000075007838 1085510113 /nfs/dbraw/zinc/51/01/13/1085510113.db2.gz RJXPFDBTWWXDLQ-INIZCTEOSA-N 2 0 370.484 4.172 20 0 FIADRP C[C@H](CC[N@@H+]1CC[C@@H](CC(F)(F)F)C1)[NH+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444707421 1085550023 /nfs/dbraw/zinc/55/00/23/1085550023.db2.gz PPINBRFXOFPQKG-RDBSUJKOSA-N 2 0 360.386 4.314 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657611680 1085689816 /nfs/dbraw/zinc/68/98/16/1085689816.db2.gz CIRYGPNTXRUSFD-UHFFFAOYSA-N 2 0 361.489 4.343 20 0 FIADRP CC(C)COc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613641 1085698075 /nfs/dbraw/zinc/69/80/75/1085698075.db2.gz OVNSATBRDAANAL-UHFFFAOYSA-N 2 0 367.537 4.118 20 0 FIADRP c1ccc(-c2cccc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)c2)nc1 ZINC000657613704 1085699382 /nfs/dbraw/zinc/69/93/82/1085699382.db2.gz PMYRWGASITXCDJ-UHFFFAOYSA-N 2 0 372.516 4.145 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000657613758 1085699514 /nfs/dbraw/zinc/69/95/14/1085699514.db2.gz QXYMURGGOSPTDM-HXUWFJFHSA-N 2 0 369.940 4.094 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)cc1 ZINC000652187149 1085748216 /nfs/dbraw/zinc/74/82/16/1085748216.db2.gz DCDDUHMIZZHTFS-GOTSBHOMSA-N 2 0 370.512 4.269 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c(C)n1 ZINC000164501520 1085797951 /nfs/dbraw/zinc/79/79/51/1085797951.db2.gz GPOSJPJAGNEDMH-MRXNPFEDSA-N 2 0 364.493 4.169 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)c1ccccc1Cl ZINC000582927143 1085929804 /nfs/dbraw/zinc/92/98/04/1085929804.db2.gz STEYOLCBUXAFST-LNKGRISISA-N 2 0 351.966 4.041 20 0 FIADRP Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000663097538 1085990610 /nfs/dbraw/zinc/99/06/10/1085990610.db2.gz ZZDBXPQZFIENGO-QFIPXVFZSA-N 2 0 352.526 4.052 20 0 FIADRP C[C@@](O)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000248880234 1086177947 /nfs/dbraw/zinc/17/79/47/1086177947.db2.gz KLYRBXOUCDBINF-BXXSPATCSA-N 2 0 356.554 4.103 20 0 FIADRP Clc1cccc(-c2cnc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)o2)c1 ZINC000662295141 1086398290 /nfs/dbraw/zinc/39/82/90/1086398290.db2.gz TWTWWPBVFAGCIL-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295711 1086398434 /nfs/dbraw/zinc/39/84/34/1086398434.db2.gz HYEVVSGHLTXEBF-PBHICJAKSA-N 2 0 374.916 4.163 20 0 FIADRP COc1ccc([C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]CC3)c2ccccc2)cc1 ZINC000662298350 1086400896 /nfs/dbraw/zinc/40/08/96/1086400896.db2.gz BIJBUVAGEDADNU-XMMPIXPASA-N 2 0 358.485 4.220 20 0 FIADRP CC(C)c1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000663323974 1086413222 /nfs/dbraw/zinc/41/32/22/1086413222.db2.gz LNHUPCRNVBFHPX-HSZRJFAPSA-N 2 0 352.522 4.057 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC[N@@H+]1C ZINC000165550767 1086536806 /nfs/dbraw/zinc/53/68/06/1086536806.db2.gz LYBXJEPTPYGUER-AUSIDOKSSA-N 2 0 374.532 4.171 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCSc3ccc(Br)cc32)C1 ZINC000663451758 1086553393 /nfs/dbraw/zinc/55/33/93/1086553393.db2.gz UQHXDAKJKDYQOY-BJJXKVORSA-N 2 0 369.372 4.306 20 0 FIADRP Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000663466727 1086568589 /nfs/dbraw/zinc/56/85/89/1086568589.db2.gz XHSBAJAZPWSXRM-DXIQSLLYSA-N 2 0 360.517 4.005 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COc2cccnc2)C1 ZINC001167825851 1086613438 /nfs/dbraw/zinc/61/34/38/1086613438.db2.gz UBNAKYHAQBIZLI-VWPQPMDRSA-N 2 0 359.558 4.073 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2ccc(F)cc2F)CC1 ZINC001167826589 1086617447 /nfs/dbraw/zinc/61/74/47/1086617447.db2.gz QZEXGMIEIRIVGN-INIZCTEOSA-N 2 0 354.485 4.319 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCc2ncnc(-c3ccccc3)c2CC1 ZINC001167828074 1086635458 /nfs/dbraw/zinc/63/54/58/1086635458.db2.gz VYQUYTBLCXGJJY-IBGZPJMESA-N 2 0 366.553 4.055 20 0 FIADRP CCc1ccccc1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000150974383 1086666170 /nfs/dbraw/zinc/66/61/70/1086666170.db2.gz ZBMTZWWWONIITO-UHFFFAOYSA-N 2 0 351.538 4.069 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@H]1c1cccc(OC)c1 ZINC001167833646 1086670941 /nfs/dbraw/zinc/67/09/41/1086670941.db2.gz CUQOQHKAGRFKSK-XLIONFOSSA-N 2 0 350.572 4.296 20 0 FIADRP CCOc1ccc(NC2CC[NH+]([C@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167834696 1086688042 /nfs/dbraw/zinc/68/80/42/1086688042.db2.gz LYJWTDISBCSZER-LJQANCHMSA-N 2 0 361.574 4.472 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@H](C5CC5)C4)[C@@H]3C2)cc1 ZINC000583456812 1086701153 /nfs/dbraw/zinc/70/11/53/1086701153.db2.gz ZWMQYRXFGQDGHF-JTKSJCOOSA-N 2 0 368.565 4.224 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)n1nc(C2CC[NH2+]CC2)c2ccc(F)cc21 ZINC001167838703 1086713956 /nfs/dbraw/zinc/71/39/56/1086713956.db2.gz WFUCTNVINPQFDV-MRXNPFEDSA-N 2 0 360.521 4.325 20 0 FIADRP COc1ccccc1[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)C1CCCC1 ZINC000432407068 1086728843 /nfs/dbraw/zinc/72/88/43/1086728843.db2.gz JYTXBMDEGLXHNT-XMSQKQJNSA-N 2 0 360.542 4.017 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167841369 1086735730 /nfs/dbraw/zinc/73/57/30/1086735730.db2.gz LMOCSOPUWNDZIS-UPVQGACJSA-N 3 0 371.613 4.485 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001167841742 1086739250 /nfs/dbraw/zinc/73/92/50/1086739250.db2.gz PZHOLNHBJFOKKR-RBUKOAKNSA-N 2 0 369.594 4.076 20 0 FIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](Cc2ccccc2F)c2ccccc2)CCCO1 ZINC000432427657 1086757552 /nfs/dbraw/zinc/75/75/52/1086757552.db2.gz DEAAFLUMQFXEHA-AUSIDOKSSA-N 2 0 370.512 4.200 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](CCCc3c(Cl)cccc3Cl)C2)C1 ZINC000650708694 1086767416 /nfs/dbraw/zinc/76/74/16/1086767416.db2.gz JBQZGCCPFXZOMI-KHYOSLBOSA-N 2 0 371.352 4.144 20 0 FIADRP c1csc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[NH+]2CCCC2)c1 ZINC000512118894 1086787878 /nfs/dbraw/zinc/78/78/78/1086787878.db2.gz ACMVFRNYWURLQW-UHFFFAOYSA-N 2 0 366.534 4.176 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657773414 1086834494 /nfs/dbraw/zinc/83/44/94/1086834494.db2.gz RMLHAPMZEVZWDJ-QFIPXVFZSA-N 2 0 366.553 4.164 20 0 FIADRP Cc1c([C@@H](C)NCc2ccc(C[NH3+])cc2F)cnn1-c1cccc(Cl)c1 ZINC000650753282 1086954701 /nfs/dbraw/zinc/95/47/01/1086954701.db2.gz KNTLWAPJLQURQF-CYBMUJFWSA-N 2 0 372.875 4.283 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(OC(F)(F)F)cc1 ZINC000650756310 1086967161 /nfs/dbraw/zinc/96/71/61/1086967161.db2.gz ZGUCWYIOKHHPLL-KRWDZBQOSA-N 2 0 356.363 4.424 20 0 FIADRP CC[N@H+](Cc1c[nH]nc1-c1ccc(F)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000583899441 1087020492 /nfs/dbraw/zinc/02/04/92/1087020492.db2.gz PGJFIXPMXUZYFF-UHFFFAOYSA-N 2 0 366.484 4.300 20 0 FIADRP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@H](CNc4cccc(C)[nH+]4)C3)s2)o1 ZINC000092813394 1087105573 /nfs/dbraw/zinc/10/55/73/1087105573.db2.gz HBZGNCAZWKYAHU-MRXNPFEDSA-N 2 0 368.506 4.349 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cncc(Br)c1 ZINC000657838499 1087250035 /nfs/dbraw/zinc/25/00/35/1087250035.db2.gz BRWLJCREZFLJAT-XHSDSOJGSA-N 2 0 368.363 4.253 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C/C(C)=C/c2ccccc2OC(F)F)CC1 ZINC000584320623 1087265035 /nfs/dbraw/zinc/26/50/35/1087265035.db2.gz DUXTUNCWTKULBD-JQIJEIRASA-N 2 0 352.469 4.403 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657841630 1087278888 /nfs/dbraw/zinc/27/88/88/1087278888.db2.gz PXTGCWTVAXBEPX-OAHLLOKOSA-N 2 0 355.507 4.088 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000584378422 1087313425 /nfs/dbraw/zinc/31/34/25/1087313425.db2.gz JKEMZOMKHQTEEX-IFMALSPDSA-N 2 0 350.506 4.278 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)CCc2ccc(Br)cc2)CC1 ZINC001207382552 1087345626 /nfs/dbraw/zinc/34/56/26/1087345626.db2.gz OEJSXGHTKCSEHZ-UHFFFAOYSA-N 2 0 353.348 4.044 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc3cc(OC)c(OC)cc3c2)CC1 ZINC000657873264 1087513627 /nfs/dbraw/zinc/51/36/27/1087513627.db2.gz WJILQYOHHQCJHC-MRXNPFEDSA-N 2 0 356.510 4.240 20 0 FIADRP CC[C@H](C)Oc1cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000685463111 1087575769 /nfs/dbraw/zinc/57/57/69/1087575769.db2.gz GRWNLPSEMQBHSN-FXAWDEMLSA-N 2 0 360.542 4.036 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)cc1O ZINC000685645202 1087655477 /nfs/dbraw/zinc/65/54/77/1087655477.db2.gz XKNUWCSDVZKODC-SFHVURJKSA-N 2 0 368.521 4.484 20 0 FIADRP CCSc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067788 1087710041 /nfs/dbraw/zinc/71/00/41/1087710041.db2.gz QTCLMCFJIMRPMH-QGZVFWFLSA-N 2 0 362.583 4.340 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658068581 1087710585 /nfs/dbraw/zinc/71/05/85/1087710585.db2.gz GOTCVUNNFCJAMI-GOSISDBHSA-N 2 0 360.542 4.015 20 0 FIADRP CC(C)C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(F)cc1 ZINC000658071536 1087711238 /nfs/dbraw/zinc/71/12/38/1087711238.db2.gz XKTUYAUMUMZZIH-JOCHJYFZSA-N 2 0 362.533 4.394 20 0 FIADRP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658071078 1087711344 /nfs/dbraw/zinc/71/13/44/1087711344.db2.gz SVTBFOCCUWGQSV-IRXDYDNUSA-N 2 0 364.961 4.313 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(F)cc1 ZINC000658142490 1087735280 /nfs/dbraw/zinc/73/52/80/1087735280.db2.gz ZNCFVNOYZLQGNA-PKTZIBPZSA-N 2 0 370.512 4.269 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]C(c3ccccc3)c3ccccc3)cc2)C1 ZINC000658137496 1087742348 /nfs/dbraw/zinc/74/23/48/1087742348.db2.gz HHCKDYHZJLMLMJ-XMMPIXPASA-N 2 0 372.512 4.132 20 0 FIADRP CC1(C)CC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c2ccccc21 ZINC000658138410 1087744175 /nfs/dbraw/zinc/74/41/75/1087744175.db2.gz MXSKEEOFZTZICA-NFBKMPQASA-N 2 0 364.533 4.156 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@H]1CCC12CCOCC2)C1CCCCC1 ZINC000548860833 1087747388 /nfs/dbraw/zinc/74/73/88/1087747388.db2.gz XZMGOWOIKOLVOR-QFIPXVFZSA-N 2 0 356.554 4.500 20 0 FIADRP CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164298 1087759098 /nfs/dbraw/zinc/75/90/98/1087759098.db2.gz CLUAWTAFKKJETP-PKTZIBPZSA-N 2 0 363.549 4.466 20 0 FIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(OC)cc1 ZINC000658165808 1087759797 /nfs/dbraw/zinc/75/97/97/1087759797.db2.gz LYUZOHFMQLQFAR-HSZRJFAPSA-N 2 0 367.537 4.433 20 0 FIADRP C[C@H](CCc1ccc(F)cc1F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165104 1087760126 /nfs/dbraw/zinc/76/01/26/1087760126.db2.gz PNVJPAQLFVEDPD-QGZVFWFLSA-N 2 0 373.491 4.183 20 0 FIADRP Cc1ccc(C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658167860 1087765146 /nfs/dbraw/zinc/76/51/46/1087765146.db2.gz UNPPZUQXAXBYEJ-DEOSSOPVSA-N 2 0 363.549 4.213 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H](Cc2ccncc2)c2cccs2)c1 ZINC000424258281 1087876891 /nfs/dbraw/zinc/87/68/91/1087876891.db2.gz LMTPJDXYVMOVHC-HXUWFJFHSA-N 2 0 351.519 4.278 20 0 FIADRP C[C@@H]1CC2(C[N@@H+]1Cc1nc(-c3c(F)cccc3F)cs1)CC[NH2+]CC2 ZINC000424296631 1087902100 /nfs/dbraw/zinc/90/21/00/1087902100.db2.gz SCSUQQWVJLXXII-CYBMUJFWSA-N 2 0 363.477 4.052 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414803489 1088111630 /nfs/dbraw/zinc/11/16/30/1088111630.db2.gz CXLHYPHZZHFLTK-AWEZNQCLSA-N 2 0 354.885 4.144 20 0 FIADRP C[C@H]([NH3+])c1ccc(CNCc2cc(Cl)ccc2Br)cc1 ZINC000414808156 1088178479 /nfs/dbraw/zinc/17/84/79/1088178479.db2.gz KKFWCVCUVSHYDR-NSHDSACASA-N 2 0 353.691 4.412 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000414810346 1088200948 /nfs/dbraw/zinc/20/09/48/1088200948.db2.gz HXWRXNBWFNJYCY-LSDHHAIUSA-N 2 0 359.901 4.175 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414810468 1088201565 /nfs/dbraw/zinc/20/15/65/1088201565.db2.gz OERVQEYCAAWZPH-DLBZAZTESA-N 2 0 353.510 4.337 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OCCC(C)C ZINC000414811241 1088209474 /nfs/dbraw/zinc/20/94/74/1088209474.db2.gz PKMYILZNDNAMKZ-QGZVFWFLSA-N 2 0 356.510 4.430 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OC ZINC000414813586 1088215100 /nfs/dbraw/zinc/21/51/00/1088215100.db2.gz UAVKVYWTBXLPMY-CQSZACIVSA-N 2 0 362.901 4.447 20 0 FIADRP Clc1ccc(Cl)c(-c2csc(C[NH2+]CC[C@@H]3CC[NH2+]C3)n2)c1 ZINC000414824159 1088310032 /nfs/dbraw/zinc/31/00/32/1088310032.db2.gz AIOMCUHPLDPLTI-NSHDSACASA-N 2 0 356.322 4.206 20 0 FIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000513826827 1088425412 /nfs/dbraw/zinc/42/54/12/1088425412.db2.gz CKMGJTNGKUGMJI-AZUAARDMSA-N 2 0 360.542 4.160 20 0 FIADRP CC(C)c1ccc([C@@H]([NH3+])CNC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000414842679 1088497822 /nfs/dbraw/zinc/49/78/22/1088497822.db2.gz IYPBFRHGMAXXIZ-QHCPKHFHSA-N 2 0 351.538 4.064 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000514237808 1088930317 /nfs/dbraw/zinc/93/03/17/1088930317.db2.gz NTPGWIGGHURUTM-UHFFFAOYSA-N 2 0 352.400 4.397 20 0 FIADRP COc1cc(C[NH2+][C@H](C)CCC[NH3+])ccc1OCc1ccc(Cl)cc1 ZINC000415023431 1089060635 /nfs/dbraw/zinc/06/06/35/1089060635.db2.gz MVJGLPPCCLOTOA-OAHLLOKOSA-N 2 0 362.901 4.145 20 0 FIADRP COc1cc(C[NH2+][C@@H](C)CCC[NH3+])ccc1OCc1ccc(Cl)cc1 ZINC000415023430 1089061281 /nfs/dbraw/zinc/06/12/81/1089061281.db2.gz MVJGLPPCCLOTOA-HNNXBMFYSA-N 2 0 362.901 4.145 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415033663 1089072280 /nfs/dbraw/zinc/07/22/80/1089072280.db2.gz JCTAPKNMWFXJNG-UYAOXDASSA-N 2 0 360.505 4.065 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415044863 1089091703 /nfs/dbraw/zinc/09/17/03/1089091703.db2.gz BGGVIQNDQVIHLZ-GHTZIAJQSA-N 2 0 353.510 4.090 20 0 FIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415045252 1089092116 /nfs/dbraw/zinc/09/21/16/1089092116.db2.gz BGGVIQNDQVIHLZ-RXVVDRJESA-N 2 0 353.510 4.090 20 0 FIADRP C[C@H](CC(=O)Nc1cccc(Cl)c1)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415057606 1089092938 /nfs/dbraw/zinc/09/29/38/1089092938.db2.gz RTWUPNPNYHSRKC-BEFAXECRSA-N 2 0 359.901 4.127 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000415059373 1089094477 /nfs/dbraw/zinc/09/44/77/1089094477.db2.gz WTXIQLRFNYGQDB-UNMCSNQZSA-N 2 0 350.506 4.326 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1 ZINC000415060459 1089094530 /nfs/dbraw/zinc/09/45/30/1089094530.db2.gz WVDTZHPNZIKDRB-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1OCC ZINC000414857895 1089132790 /nfs/dbraw/zinc/13/27/90/1089132790.db2.gz QKUDYQVAFHDUDS-ZBFHGGJFSA-N 2 0 354.922 4.005 20 0 FIADRP c1ccc(-c2ccccc2OCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000415079098 1089135141 /nfs/dbraw/zinc/13/51/41/1089135141.db2.gz HFUKDONYDNWVRZ-YPAWHYETSA-N 2 0 350.506 4.243 20 0 FIADRP C[C@H](C[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000415116475 1089175844 /nfs/dbraw/zinc/17/58/44/1089175844.db2.gz BJSLARBBAWLQMZ-NIKGAXFTSA-N 2 0 370.459 4.027 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C3CCC(C[NH3+])CC3)s2)cc1 ZINC000415116769 1089176576 /nfs/dbraw/zinc/17/65/76/1089176576.db2.gz VECSTMMONCLOGH-BZOOQXSSSA-N 2 0 359.539 4.295 20 0 FIADRP Cc1ccc(-c2ccc(C[NH+]3CCC([C@H]4C[C@@H]([NH3+])CCO4)CC3)s2)cc1 ZINC000415127313 1089180889 /nfs/dbraw/zinc/18/08/89/1089180889.db2.gz QXJOAKCAPGGWQE-PZJWPPBQSA-N 2 0 370.562 4.442 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](CC3CCC(c4ccccc4)CC3)CC2)C1 ZINC000415121251 1089182079 /nfs/dbraw/zinc/18/20/79/1089182079.db2.gz HVRWTORUPAWDFC-SCMVOWPKSA-N 2 0 356.554 4.179 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000415139378 1089200163 /nfs/dbraw/zinc/20/01/63/1089200163.db2.gz ZNFMHMQEYFVUBI-PZJWPPBQSA-N 2 0 374.525 4.273 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc3c2OCC[C@@H]3[NH+](C)C)C1 ZINC000435041287 1089217338 /nfs/dbraw/zinc/21/73/38/1089217338.db2.gz IPQWDEMQFGRQMK-LZNRXBQRSA-N 2 0 365.521 4.319 20 0 FIADRP COc1ccccc1CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000505602598 1089271727 /nfs/dbraw/zinc/27/17/27/1089271727.db2.gz NJFPZQGVRGCFLN-NRFANRHFSA-N 2 0 352.522 4.082 20 0 FIADRP COc1ccccc1CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000505602610 1089272327 /nfs/dbraw/zinc/27/23/27/1089272327.db2.gz NJFPZQGVRGCFLN-OAQYLSRUSA-N 2 0 352.522 4.082 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549235994 1089315128 /nfs/dbraw/zinc/31/51/28/1089315128.db2.gz TYVMBANGISUOPS-HCUBDLJJSA-N 2 0 364.533 4.059 20 0 FIADRP Cc1oc2ccccc2c1CN(Cc1nccs1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435424666 1089640258 /nfs/dbraw/zinc/64/02/58/1089640258.db2.gz WPFIOSAAFHWPKX-LJQANCHMSA-N 2 0 367.518 4.342 20 0 FIADRP COc1cc(Cl)c(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000514971767 1089696216 /nfs/dbraw/zinc/69/62/16/1089696216.db2.gz DLVSQUMSACXGJA-AWEZNQCLSA-N 2 0 357.325 4.166 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H]1C(=O)Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC001625891373 1089758407 /nfs/dbraw/zinc/75/84/07/1089758407.db2.gz HGGKQQIHKCNGEN-WIYYLYMNSA-N 2 0 357.542 4.120 20 0 FIADRP Cn1cncc1CCC[N@@H+]1CCSC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000515178299 1089857197 /nfs/dbraw/zinc/85/71/97/1089857197.db2.gz LLYBXPKOSJCMHI-QGZVFWFLSA-N 2 0 369.456 4.162 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000378613940 1090444149 /nfs/dbraw/zinc/44/41/49/1090444149.db2.gz ALWKKKNHTLHEBX-FQEVSTJZSA-N 2 0 351.425 4.074 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)C[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000431896019 1090482511 /nfs/dbraw/zinc/48/25/11/1090482511.db2.gz KBKFVKJVPCZQJD-NRFANRHFSA-N 2 0 353.510 4.160 20 0 FIADRP Cc1cc(Br)c(C[NH2+]Cc2ccccc2-n2ccnc2)s1 ZINC001648926894 1090617927 /nfs/dbraw/zinc/61/79/27/1090617927.db2.gz BSUXGJQAHBASKO-UHFFFAOYSA-N 2 0 362.296 4.295 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nsc2ccccc21 ZINC000660166339 1090721888 /nfs/dbraw/zinc/72/18/88/1090721888.db2.gz OIHSPJYXSZPBQZ-UHFFFAOYSA-N 2 0 366.534 4.430 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000584830510 1090925543 /nfs/dbraw/zinc/92/55/43/1090925543.db2.gz SCNYSZSGPKYBQG-RBUKOAKNSA-N 2 0 370.459 4.044 20 0 FIADRP Clc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000388315466 1090985106 /nfs/dbraw/zinc/98/51/06/1090985106.db2.gz KTHFLOKFQRVZBV-SFHVURJKSA-N 2 0 365.908 4.500 20 0 FIADRP COCC[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000651453556 1090989536 /nfs/dbraw/zinc/98/95/36/1090989536.db2.gz NCMNXGUJLHONFQ-KBXCAEBGSA-N 2 0 358.448 4.103 20 0 FIADRP COCC[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000651453558 1090989642 /nfs/dbraw/zinc/98/96/42/1090989642.db2.gz NCMNXGUJLHONFQ-KSSFIOAISA-N 2 0 358.448 4.103 20 0 FIADRP Cc1ccccc1C1CC([N@H+](CCCN2CC[NH+](C(C)C)CC2)C2CC2)C1 ZINC000500095036 1091034281 /nfs/dbraw/zinc/03/42/81/1091034281.db2.gz XJBVAKVOBVSTLS-UHFFFAOYSA-N 2 0 369.597 4.122 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000500098524 1091036258 /nfs/dbraw/zinc/03/62/58/1091036258.db2.gz MPKREJSHPISINB-RTBURBONSA-N 2 0 365.993 4.180 20 0 FIADRP CC(C)(C)[C@@H](Cn1ccnc1)[NH2+][C@H]1CCc2ccc(Br)cc21 ZINC000319351075 1091117725 /nfs/dbraw/zinc/11/77/25/1091117725.db2.gz MUBZAYWLCKKPLW-DLBZAZTESA-N 2 0 362.315 4.337 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000390525823 1091182259 /nfs/dbraw/zinc/18/22/59/1091182259.db2.gz IYXDJGQIIOCBCY-QPPBQGQZSA-N 2 0 365.565 4.009 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000512265242 1091983771 /nfs/dbraw/zinc/98/37/71/1091983771.db2.gz PCOSJWYRRWWPLF-UHFFFAOYSA-N 2 0 370.541 4.113 20 0 FIADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCO1 ZINC000512286056 1092009405 /nfs/dbraw/zinc/00/94/05/1092009405.db2.gz ADOCEWMLFDBZRI-MRKXFKPJSA-N 2 0 370.581 4.470 20 0 FIADRP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](CCCCC4CCOCC4)C3)C2)cc1 ZINC000512291456 1092014675 /nfs/dbraw/zinc/01/46/75/1092014675.db2.gz JSKOZQCSWLRXFF-HSZRJFAPSA-N 2 0 356.554 4.181 20 0 FIADRP COc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1F ZINC000432663793 1092040923 /nfs/dbraw/zinc/04/09/23/1092040923.db2.gz KQQOKSQOIQJKDZ-IBGZPJMESA-N 2 0 360.498 4.040 20 0 FIADRP CCc1nc(C)c(CN2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)o1 ZINC000428218574 1092267754 /nfs/dbraw/zinc/26/77/54/1092267754.db2.gz MPVGHVZXEDMQPJ-JOCHJYFZSA-N 2 0 353.510 4.034 20 0 FIADRP C[C@H]1CC([NH+]2C(C)(C)CC([NH3+])CC2(C)C)C[C@H](C)N1Cc1ccccc1 ZINC001168012463 1092338986 /nfs/dbraw/zinc/33/89/86/1092338986.db2.gz ANVXJIAWGSJMRN-ROUUACIJSA-N 2 0 357.586 4.408 20 0 FIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000665271636 1092420913 /nfs/dbraw/zinc/42/09/13/1092420913.db2.gz PMMPUFPVFVSJGG-QVGHQYEOSA-N 2 0 361.533 4.146 20 0 FIADRP FC(F)(F)c1ccc([C@H]2CC[C@@H]([NH2+]CCCC[NH+]3CCOCC3)C2)cc1 ZINC000442710437 1092734411 /nfs/dbraw/zinc/73/44/11/1092734411.db2.gz CAQSWIBRSGPAPN-PKOBYXMFSA-N 2 0 370.459 4.044 20 0 FIADRP C[C@@H](CCc1cccc(F)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000521636478 1092810976 /nfs/dbraw/zinc/81/09/76/1092810976.db2.gz NTKBTXRSIVBFIR-SFHVURJKSA-N 2 0 370.512 4.410 20 0 FIADRP COCCC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000442865499 1092811986 /nfs/dbraw/zinc/81/19/86/1092811986.db2.gz UCMCIGGDJAAAAT-OFNKIYASSA-N 2 0 370.512 4.405 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CCC[NH+](C2CCCC2)CC1 ZINC000512557439 1092914624 /nfs/dbraw/zinc/91/46/24/1092914624.db2.gz RCRWIAIUXWIGKH-UHFFFAOYSA-N 2 0 357.586 4.095 20 0 FIADRP O[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000245687122 1092948556 /nfs/dbraw/zinc/94/85/56/1092948556.db2.gz JSNSZOWWXUAFAC-LRSLUSHPSA-N 2 0 370.924 4.159 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4noc5c4CCCC5)C3)CC2)cc1 ZINC000645007020 1093059919 /nfs/dbraw/zinc/05/99/19/1093059919.db2.gz HKMUQPRNWUNNLL-UHFFFAOYSA-N 2 0 365.521 4.042 20 0 FIADRP O[C@@H]1CCCC[C@@H]1CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512653314 1093080272 /nfs/dbraw/zinc/08/02/72/1093080272.db2.gz DOQNHDSYJJHESN-KEJFTWOCSA-N 2 0 370.581 4.208 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)c1 ZINC000474053077 1093153708 /nfs/dbraw/zinc/15/37/08/1093153708.db2.gz NZOMOBUGMBNGOI-YTFSRNRJSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2ccc(-n3cccn3)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168018031 1093163989 /nfs/dbraw/zinc/16/39/89/1093163989.db2.gz YLYQWKPQAPNLAA-WOJBJXKFSA-N 2 0 374.532 4.404 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)cc1 ZINC000474061514 1093174879 /nfs/dbraw/zinc/17/48/79/1093174879.db2.gz SKSIIRDIKCEQST-YMPZKCBVSA-N 2 0 374.569 4.092 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)cc1 ZINC000474061512 1093175295 /nfs/dbraw/zinc/17/52/95/1093175295.db2.gz SKSIIRDIKCEQST-MDNUFGMLSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)C1CCC(F)(F)CC1 ZINC000474073817 1093188740 /nfs/dbraw/zinc/18/87/40/1093188740.db2.gz PKKFIISLUWYLJI-CVEARBPZSA-N 2 0 351.485 4.411 20 0 FIADRP C[C@@H](C[NH+]1CCC(C)CC1)NC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168020206 1093201425 /nfs/dbraw/zinc/20/14/25/1093201425.db2.gz LJSFXNJUKPNKCN-ACRUOGEOSA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H](C[NH+]1CCC(C)CC1)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168020213 1093203150 /nfs/dbraw/zinc/20/31/50/1093203150.db2.gz LJSFXNJUKPNKCN-QXUYBEEESA-N 2 0 357.586 4.138 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCOc2cccc(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020864 1093225682 /nfs/dbraw/zinc/22/56/82/1093225682.db2.gz OATYXMAMMGDFNN-RMFSNUHRSA-N 2 0 356.485 4.236 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCC(=O)OC(C)(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020866 1093226278 /nfs/dbraw/zinc/22/62/78/1093226278.db2.gz OBAPDSYVDKRPCQ-OPVJXMOQSA-N 2 0 360.542 4.140 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001168021913 1093255125 /nfs/dbraw/zinc/25/51/25/1093255125.db2.gz QXZBNNVFXNGRBW-QZTJIDSGSA-N 2 0 365.521 4.176 20 0 FIADRP CCc1noc(C)c1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433118662 1093268591 /nfs/dbraw/zinc/26/85/91/1093268591.db2.gz YDHZYDVCCQNCKX-UHFFFAOYSA-N 2 0 353.510 4.034 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168022653 1093313921 /nfs/dbraw/zinc/31/39/21/1093313921.db2.gz AVOOOVGUTFYMBP-VXZSXMOLSA-N 2 0 355.570 4.033 20 0 FIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC000648416171 1093339890 /nfs/dbraw/zinc/33/98/90/1093339890.db2.gz ZAPAOMSNCMALDR-FGZHOGPDSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000389082514 1093347360 /nfs/dbraw/zinc/34/73/60/1093347360.db2.gz DMSRXISUTXJOCV-SIKLNZKXSA-N 2 0 352.522 4.215 20 0 FIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)Cn1cc(-c2ccc(C)cc2)cn1 ZINC000727425965 1093356242 /nfs/dbraw/zinc/35/62/42/1093356242.db2.gz FVSVYHYEQUWYAN-UHFFFAOYSA-N 2 0 362.521 4.400 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3[C@@H]2O)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168023863 1093368028 /nfs/dbraw/zinc/36/80/28/1093368028.db2.gz YLNJTDWMRZWJHR-NHJQUPGMSA-N 2 0 364.533 4.066 20 0 FIADRP C[C@H]1CC(n2cc(CC[NH3+])c3c[nH+]ccc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024460 1093394651 /nfs/dbraw/zinc/39/46/51/1093394651.db2.gz GYHITWIVXDWGDC-ROUUACIJSA-N 3 0 362.521 4.152 20 0 FIADRP Fc1cc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)ccc1C(F)F ZINC000895346545 1093405591 /nfs/dbraw/zinc/40/55/91/1093405591.db2.gz IIWKULIQLAUQQJ-UHFFFAOYSA-N 2 0 363.427 4.160 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C2CC(C)(c3ccccc3)C2)cc1 ZINC000500922798 1093532021 /nfs/dbraw/zinc/53/20/21/1093532021.db2.gz UJYBCPPBIYULFD-UHFFFAOYSA-N 2 0 352.522 4.227 20 0 FIADRP C[NH+](C)Cc1ccccc1C(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000433316168 1093570546 /nfs/dbraw/zinc/57/05/46/1093570546.db2.gz FAGLXOOWWROGSF-UHFFFAOYSA-N 2 0 365.521 4.029 20 0 FIADRP C[C@H](Cc1cccc(O)c1)[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168031386 1093623661 /nfs/dbraw/zinc/62/36/61/1093623661.db2.gz YVXHRYACVWMSIA-QYZOEREBSA-N 2 0 352.522 4.354 20 0 FIADRP C[C@@H]1C[C@@H](N[C@@H]2CC[NH+](C3CCCCC3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032305 1093652660 /nfs/dbraw/zinc/65/26/60/1093652660.db2.gz HLWKHISNHNHDLT-IRMYBRCSSA-N 2 0 369.597 4.425 20 0 FIADRP C[C@@H]1CC([NH2+]CC2(c3ccc(F)cn3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032148 1093656172 /nfs/dbraw/zinc/65/61/72/1093656172.db2.gz FOUIWGDMTPTRGO-QZTJIDSGSA-N 2 0 367.512 4.284 20 0 FIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000513019862 1093665275 /nfs/dbraw/zinc/66/52/75/1093665275.db2.gz INYIQCBNHFAVCB-IOSWFWLXSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@@H]1CC([NH2+]C[C@H]2COc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032956 1093680146 /nfs/dbraw/zinc/68/01/46/1093680146.db2.gz JEIIHMPSACKTBV-SBHAEUEKSA-N 2 0 364.533 4.269 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H](CCC[NH3+])C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168033468 1093721538 /nfs/dbraw/zinc/72/15/38/1093721538.db2.gz LAJZBMGCRQMCDC-KGSLCBSSSA-N 3 0 357.586 4.269 20 0 FIADRP Cc1cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc(C)c1OCc1ccccn1 ZINC000237051458 1093765818 /nfs/dbraw/zinc/76/58/18/1093765818.db2.gz DVYQCSDJTPJQBM-UNMCSNQZSA-N 2 0 367.537 4.240 20 0 FIADRP [NH3+][C@@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)c1ccccc1 ZINC000178818022 1093770703 /nfs/dbraw/zinc/77/07/03/1093770703.db2.gz RRQRSLSIDVNWGD-NRFANRHFSA-N 2 0 351.494 4.091 20 0 FIADRP CC[NH+](CC)[C@H](CNC1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1)c1ccco1 ZINC000513073785 1093776999 /nfs/dbraw/zinc/77/69/99/1093776999.db2.gz FTWYJEJJIBTFSP-CEWLAPEOSA-N 2 0 361.574 4.295 20 0 FIADRP COc1ccc(CC[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1F ZINC000513080901 1093783235 /nfs/dbraw/zinc/78/32/35/1093783235.db2.gz GNDZLEVDRDSSFH-PXNSSMCTSA-N 2 0 356.485 4.020 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc3ccccc3n2)cc1 ZINC000614387533 1093805731 /nfs/dbraw/zinc/80/57/31/1093805731.db2.gz JXSJPGACGIUQMB-SFHVURJKSA-N 2 0 360.505 4.294 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000474479509 1093815034 /nfs/dbraw/zinc/81/50/34/1093815034.db2.gz RMNSUAZRLLOYPP-MOPGFXCFSA-N 2 0 362.558 4.298 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N(CC[NH+](C)C)c2ccccc2)cc1 ZINC000509908770 1093888411 /nfs/dbraw/zinc/88/84/11/1093888411.db2.gz GRTHKCBXFLUMJE-UHFFFAOYSA-N 2 0 367.537 4.127 20 0 FIADRP Clc1cccc(Br)c1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204734731 1093974475 /nfs/dbraw/zinc/97/44/75/1093974475.db2.gz CYLNZUQBCOKMAV-UHFFFAOYSA-N 2 0 357.723 4.068 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000500979019 1093985645 /nfs/dbraw/zinc/98/56/45/1093985645.db2.gz ABZUHIQZIXQILX-QFIPXVFZSA-N 2 0 361.549 4.063 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000513350411 1094073278 /nfs/dbraw/zinc/07/32/78/1094073278.db2.gz HSWGNYLHCNHDKB-DWQJTFDBSA-N 2 0 369.597 4.282 20 0 FIADRP c1ccc(C[C@H]([NH2+]CCCCC[NH+]2CCCCC2)c2cccnc2)nc1 ZINC000513353112 1094074421 /nfs/dbraw/zinc/07/44/21/1094074421.db2.gz HKENLVSTDUUHHI-QFIPXVFZSA-N 2 0 352.526 4.006 20 0 FIADRP CCCn1nc(C)c(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1C ZINC000513495465 1094162188 /nfs/dbraw/zinc/16/21/88/1094162188.db2.gz QDVPEQAMTKNFJO-GCJKJVERSA-N 2 0 368.569 4.300 20 0 FIADRP Cc1cccn2c(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cnc12 ZINC000513494990 1094162353 /nfs/dbraw/zinc/16/23/53/1094162353.db2.gz LCXVTFDYKCMLMS-FPOVZHCZSA-N 2 0 362.521 4.033 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cnc(-c3ccccc3)[nH]2)C[N@@H+]1Cc1ccccc1 ZINC000513494783 1094162851 /nfs/dbraw/zinc/16/28/51/1094162851.db2.gz JRLNZVOTHZLVBI-PZJWPPBQSA-N 2 0 374.532 4.467 20 0 FIADRP CC(=O)Nc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513500015 1094172790 /nfs/dbraw/zinc/17/27/90/1094172790.db2.gz KKGFZXOORXKSNV-XMSQKQJNSA-N 2 0 365.521 4.035 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2csc(C3CC3)n2)C[N@@H+]1Cc1ccccc1 ZINC000513500803 1094174123 /nfs/dbraw/zinc/17/41/23/1094174123.db2.gz OWWKLFCPPUTEMA-WMZOPIPTSA-N 2 0 355.551 4.411 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H](Cc2ccccn2)c2cccnc2)C1 ZINC000513524799 1094197758 /nfs/dbraw/zinc/19/77/58/1094197758.db2.gz ICGRAOSTCBLBHQ-ZRCGQRJVSA-N 2 0 366.553 4.108 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cnn(C(C)(C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000513544976 1094205603 /nfs/dbraw/zinc/20/56/03/1094205603.db2.gz NNUDMEJHNGOFQJ-AZUAARDMSA-N 2 0 354.542 4.028 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCSc3ccc(Br)cc32)CC1 ZINC000513679086 1094277463 /nfs/dbraw/zinc/27/74/63/1094277463.db2.gz UNFMRLQCXKBCLP-ZBCRRDGASA-N 2 0 369.372 4.448 20 0 FIADRP Fc1cc2cccnc2c(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC001648965876 1094342364 /nfs/dbraw/zinc/34/23/64/1094342364.db2.gz VPJPQDXIYMFIJV-LJQANCHMSA-N 2 0 363.480 4.376 20 0 FIADRP COC[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000513697689 1094364933 /nfs/dbraw/zinc/36/49/33/1094364933.db2.gz QPADGZRMJSTAAV-VNXZQDSDSA-N 2 0 352.522 4.407 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474596997 1094376131 /nfs/dbraw/zinc/37/61/31/1094376131.db2.gz IHBMSHGEOMAMJQ-XMTFNYHQSA-N 2 0 352.950 4.311 20 0 FIADRP C[NH+]1CCN(CCC[NH2+][C@@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000500992690 1094409532 /nfs/dbraw/zinc/40/95/32/1094409532.db2.gz OQKUMFORAQJWIU-OAQYLSRUSA-N 2 0 363.977 4.189 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000474607384 1094411434 /nfs/dbraw/zinc/41/14/34/1094411434.db2.gz YDZGHTWFPBOVDX-QZTJIDSGSA-N 2 0 374.569 4.440 20 0 FIADRP C[N@@H+](Cc1ccccc1Br)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501044179 1094451095 /nfs/dbraw/zinc/45/10/95/1094451095.db2.gz HUBFMWOHIHVBKM-UHFFFAOYSA-N 2 0 374.326 4.193 20 0 FIADRP CC[C@H](C)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501055089 1094466881 /nfs/dbraw/zinc/46/68/81/1094466881.db2.gz PZWPCXBCPGFBBL-GHTZIAJQSA-N 2 0 365.993 4.433 20 0 FIADRP C[N@@H+](Cc1ccc(Br)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501053915 1094484618 /nfs/dbraw/zinc/48/46/18/1094484618.db2.gz SMFFUVMDCCTGFW-UHFFFAOYSA-N 2 0 374.326 4.193 20 0 FIADRP Cc1ccncc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000474713133 1094536066 /nfs/dbraw/zinc/53/60/66/1094536066.db2.gz ONWCWETWQWGDGE-UHFFFAOYSA-N 2 0 351.538 4.215 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000501390334 1094674727 /nfs/dbraw/zinc/67/47/27/1094674727.db2.gz VRJYTFNWOFCKMZ-AOHZBQACSA-N 2 0 363.549 4.262 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000513716544 1094755181 /nfs/dbraw/zinc/75/51/81/1094755181.db2.gz DBHNNCNMSVEOOT-SFHVURJKSA-N 2 0 356.432 4.499 20 0 FIADRP [NH3+]CC[C@@H]1CCC[N@@H+]([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000420315024 1094876456 /nfs/dbraw/zinc/87/64/56/1094876456.db2.gz RKSPEYBYAUNEJJ-JTSKRJEESA-N 2 0 361.489 4.153 20 0 FIADRP Cc1nc([C@@H](C)[NH+]2CCC3(CC[NH2+]C3)CC2)oc1-c1ccc(Cl)cc1 ZINC000420345131 1094887953 /nfs/dbraw/zinc/88/79/53/1094887953.db2.gz VIPMKTZJAGSLAK-OAHLLOKOSA-N 2 0 359.901 4.440 20 0 FIADRP NC[C@H]([NH2+]CCOC(c1ccccc1)c1ccccc1)C1CCCCC1 ZINC000420381722 1094905909 /nfs/dbraw/zinc/90/59/09/1094905909.db2.gz ZHWICZUUOMRNKE-QFIPXVFZSA-N 2 0 352.522 4.290 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2Oc2cccnc2)CC1 ZINC000501778859 1094921286 /nfs/dbraw/zinc/92/12/86/1094921286.db2.gz VWJQMAMFKPWVCO-UHFFFAOYSA-N 2 0 353.510 4.428 20 0 FIADRP CC1CC[NH+](Cc2ccc(-c3noc(C45CCC[NH+]4CCC5)n3)cc2)CC1 ZINC000420477763 1094929873 /nfs/dbraw/zinc/92/98/73/1094929873.db2.gz AMCYQQOIGINKEN-UHFFFAOYSA-N 2 0 366.509 4.053 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)CC1 ZINC000502239549 1095244373 /nfs/dbraw/zinc/24/43/73/1095244373.db2.gz CPTUGMWNTCTTHO-QFIPXVFZSA-N 2 0 356.554 4.357 20 0 FIADRP Fc1cc2cccnc2c(C[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000502330574 1095369641 /nfs/dbraw/zinc/36/96/41/1095369641.db2.gz FYYCWEHQIGWKJU-KRWDZBQOSA-N 2 0 364.468 4.286 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(C2CCCC2)c1 ZINC000502458553 1095487275 /nfs/dbraw/zinc/48/72/75/1095487275.db2.gz CXQQBSQIXWNWTF-UYAOXDASSA-N 2 0 352.526 4.171 20 0 FIADRP Clc1ccc2c(c1)OCCC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000421344740 1095536657 /nfs/dbraw/zinc/53/66/57/1095536657.db2.gz UPUOLIRZWNSBJB-LJQANCHMSA-N 2 0 357.885 4.207 20 0 FIADRP C[NH+](C)C1CCC([NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000421375559 1095575850 /nfs/dbraw/zinc/57/58/50/1095575850.db2.gz QIZFJPJFLJQSGS-UHFFFAOYSA-N 2 0 355.309 4.232 20 0 FIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000421380668 1095580868 /nfs/dbraw/zinc/58/08/68/1095580868.db2.gz YXHLGBKEGCPBDA-UHFFFAOYSA-N 2 0 373.928 4.276 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1ccc(Br)cc1 ZINC000444005981 1095603994 /nfs/dbraw/zinc/60/39/94/1095603994.db2.gz ZUWYREATNAPHDN-ZDUSSCGKSA-N 2 0 371.282 4.189 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4occc43)cc2)C[C@H](C)O1 ZINC000192636748 1095695411 /nfs/dbraw/zinc/69/54/11/1095695411.db2.gz VSHGXZQVUSGJPW-LLGFUMIMSA-N 2 0 354.494 4.056 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H]3CCCc4occc43)cc2)C[C@@H](C)O1 ZINC000192636782 1095695609 /nfs/dbraw/zinc/69/56/09/1095695609.db2.gz VSHGXZQVUSGJPW-CBGDNZLLSA-N 2 0 354.494 4.056 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)oc1C ZINC000502699452 1095723344 /nfs/dbraw/zinc/72/33/44/1095723344.db2.gz YYVOKKWCZDKNPE-FGTMMUONSA-N 2 0 356.510 4.356 20 0 FIADRP COCC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000502720314 1095744034 /nfs/dbraw/zinc/74/40/34/1095744034.db2.gz ATCGIPRWRFFNMM-GHTZIAJQSA-N 2 0 364.961 4.347 20 0 FIADRP COCC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000502720317 1095744429 /nfs/dbraw/zinc/74/44/29/1095744429.db2.gz ATCGIPRWRFFNMM-WIYYLYMNSA-N 2 0 364.961 4.347 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccncc2Cl)cc1 ZINC000421823398 1095937223 /nfs/dbraw/zinc/93/72/23/1095937223.db2.gz ZKIWFUJUBQHQAV-MRXNPFEDSA-N 2 0 361.917 4.306 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccncc3Cl)CC2)cc1 ZINC000421825578 1095938462 /nfs/dbraw/zinc/93/84/62/1095938462.db2.gz OGQGEGASZMXOIO-INIZCTEOSA-N 2 0 373.928 4.306 20 0 FIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000421838993 1095963616 /nfs/dbraw/zinc/96/36/16/1095963616.db2.gz WBXKGZDDZFEOFR-ZDUSSCGKSA-N 2 0 350.865 4.400 20 0 FIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCOc3c(Br)cccc32)CC1 ZINC000421881705 1095974182 /nfs/dbraw/zinc/97/41/82/1095974182.db2.gz RLXJZJZKRUAPAP-MQBCKMQZSA-N 2 0 367.331 4.125 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000414663885 1096375595 /nfs/dbraw/zinc/37/55/95/1096375595.db2.gz SEDVPKAIYSUEGC-RTBURBONSA-N 2 0 360.505 4.017 20 0 FIADRP COc1cc([C@H](C)[NH2+]C2CCC(C[NH3+])CC2)ccc1OCc1ccccc1 ZINC000422716302 1096468751 /nfs/dbraw/zinc/46/87/51/1096468751.db2.gz JXXMEJXBRUVNDH-XPQZIERPSA-N 2 0 368.521 4.442 20 0 FIADRP CC(C)CC(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422720772 1096470277 /nfs/dbraw/zinc/47/02/77/1096470277.db2.gz MVBZRXKFRSTJTH-QHAWAJNXSA-N 2 0 357.542 4.072 20 0 FIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(OCc2ccccn2)cc1 ZINC000422718949 1096470492 /nfs/dbraw/zinc/47/04/92/1096470492.db2.gz LQSFANYTFFQQKH-UYAOXDASSA-N 2 0 353.510 4.061 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)CCc1ccc(OC(C)C)cc1 ZINC000422722130 1096471036 /nfs/dbraw/zinc/47/10/36/1096471036.db2.gz OWQJSDHMBPOSJL-IRXDYDNUSA-N 2 0 355.526 4.308 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000422736268 1096476153 /nfs/dbraw/zinc/47/61/53/1096476153.db2.gz GEEWHJCEEHIFFU-VHBSBENZSA-N 2 0 355.345 4.092 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000422766540 1096484889 /nfs/dbraw/zinc/48/48/89/1096484889.db2.gz RTRODTFAEAUVPM-SUMDDJOVSA-N 2 0 371.491 4.195 20 0 FIADRP C[C@H]([NH2+]C[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl)C1C[NH2+]C1 ZINC000422765557 1096485037 /nfs/dbraw/zinc/48/50/37/1096485037.db2.gz QKOBTRQJQFELAT-KSSFIOAISA-N 2 0 353.897 4.151 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000422769361 1096486753 /nfs/dbraw/zinc/48/67/53/1096486753.db2.gz OTEVTTPRTZLNCV-OZWPHOJSSA-N 2 0 362.517 4.472 20 0 FIADRP CC[C@H]1C[C@@H](C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CCO1 ZINC000503591392 1096487571 /nfs/dbraw/zinc/48/75/71/1096487571.db2.gz HRQVRWZBSCYLIL-RXVVDRJESA-N 2 0 356.510 4.206 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)oc21 ZINC000422780949 1096488841 /nfs/dbraw/zinc/48/88/41/1096488841.db2.gz HZOXIBAMRDQXPA-HIFRSBDPSA-N 2 0 353.466 4.405 20 0 FIADRP COc1ccc([C@@H](Cc2ccccc2C)[NH2+][C@H](C)CCC[NH3+])cc1OC ZINC000422795111 1096492556 /nfs/dbraw/zinc/49/25/56/1096492556.db2.gz ZLRZLYYRPZFSCI-YLJYHZDGSA-N 2 0 356.510 4.013 20 0 FIADRP FC(F)(F)COCc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422805127 1096494506 /nfs/dbraw/zinc/49/45/06/1096494506.db2.gz GIGGAULDEYSCEZ-GBESFXJTSA-N 2 0 370.459 4.166 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1OC(F)F ZINC000422809899 1096497099 /nfs/dbraw/zinc/49/70/99/1096497099.db2.gz SQWVPFXEQCKPCU-AVBTWRTFSA-N 2 0 374.431 4.195 20 0 FIADRP COc1ccc2ccccc2c1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422813548 1096498340 /nfs/dbraw/zinc/49/83/40/1096498340.db2.gz ZNPNXIVIPIJCSO-XUZZJYLKSA-N 2 0 374.484 4.194 20 0 FIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(-c2cccnc2)cc1 ZINC000422813886 1096498359 /nfs/dbraw/zinc/49/83/59/1096498359.db2.gz YUXJCKNCBBWYPL-ISKFKSNPSA-N 2 0 371.484 4.094 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)c(Oc2ccccc2)c1 ZINC000422864715 1096508263 /nfs/dbraw/zinc/50/82/63/1096508263.db2.gz NVULFOFWKCHQPQ-BHDDXSALSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000422879571 1096511364 /nfs/dbraw/zinc/51/13/64/1096511364.db2.gz MOZCNRSVMCZAIJ-YHJVDBJQSA-N 2 0 360.860 4.386 20 0 FIADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000422880082 1096511380 /nfs/dbraw/zinc/51/13/80/1096511380.db2.gz NEGURYPXOUQIQW-KBXCAEBGSA-N 2 0 371.352 4.019 20 0 FIADRP c1ccc(Sc2ccccc2C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422891738 1096512010 /nfs/dbraw/zinc/51/20/10/1096512010.db2.gz WHQBWQPZMRKFKQ-PCCBWWKXSA-N 2 0 368.546 4.085 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000422891340 1096514785 /nfs/dbraw/zinc/51/47/85/1096514785.db2.gz KGZFOHFNBYHEMK-KRWDZBQOSA-N 2 0 361.489 4.279 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000422900884 1096519400 /nfs/dbraw/zinc/51/94/00/1096519400.db2.gz KGCOVIXZNHIREX-CHWSQXEVSA-N 2 0 367.415 4.202 20 0 FIADRP c1c2ccccc2sc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422902785 1096520787 /nfs/dbraw/zinc/52/07/87/1096520787.db2.gz NOYUNSWYBKUXSW-NQIIRXRSSA-N 2 0 350.487 4.247 20 0 FIADRP CC(C)COc1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422894687 1096524661 /nfs/dbraw/zinc/52/46/61/1096524661.db2.gz CVUDGQQNIBORIU-FYYLOGMGSA-N 2 0 366.505 4.067 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000422927660 1096527329 /nfs/dbraw/zinc/52/73/29/1096527329.db2.gz ZMVFZAWVVZCADL-APWZRJJASA-N 2 0 367.320 4.426 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422934566 1096529132 /nfs/dbraw/zinc/52/91/32/1096529132.db2.gz CPBASQXEYVOMFR-HOTGVXAUSA-N 2 0 371.525 4.448 20 0 FIADRP CC(C)(C)c1ccc(C2(C[NH2+][C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422945128 1096534909 /nfs/dbraw/zinc/53/49/09/1096534909.db2.gz MOSZHARRPGHZQR-BHDDXSALSA-N 2 0 370.581 4.153 20 0 FIADRP Clc1ccc(CCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422950203 1096536724 /nfs/dbraw/zinc/53/67/24/1096536724.db2.gz XIKNQUFNEVPPAD-PZJWPPBQSA-N 2 0 356.897 4.118 20 0 FIADRP c1ccc(Sc2ccc(C[NH2+][C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)cc2)cc1 ZINC000423001719 1096546576 /nfs/dbraw/zinc/54/65/76/1096546576.db2.gz XNXMKDUORYIMNP-YPAWHYETSA-N 2 0 368.546 4.085 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000423038640 1096556965 /nfs/dbraw/zinc/55/69/65/1096556965.db2.gz OTEVTTPRTZLNCV-OUPRXKBMSA-N 2 0 362.517 4.472 20 0 FIADRP CC(C)N1CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@H]1c1ccc(Cl)c(F)c1 ZINC000423043159 1096558312 /nfs/dbraw/zinc/55/83/12/1096558312.db2.gz NNVPEBRAWYAWSK-MDASCCDHSA-N 2 0 355.929 4.110 20 0 FIADRP C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CC[NH2+]C1 ZINC000423060774 1096560800 /nfs/dbraw/zinc/56/08/00/1096560800.db2.gz IWKSTLCEKACMIJ-VHRBIJSZSA-N 2 0 354.338 4.287 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000423060134 1096561039 /nfs/dbraw/zinc/56/10/39/1096561039.db2.gz NSJNHAGBFXFHPB-ONGXEEELSA-N 2 0 354.317 4.085 20 0 FIADRP Fc1ccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423086986 1096569504 /nfs/dbraw/zinc/56/95/04/1096569504.db2.gz OMDJNTGSBWDJCY-FAHLNCGFSA-N 2 0 366.480 4.307 20 0 FIADRP Fc1ccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423086988 1096569866 /nfs/dbraw/zinc/56/98/66/1096569866.db2.gz OMDJNTGSBWDJCY-QXPQREGVSA-N 2 0 366.480 4.307 20 0 FIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000423093230 1096572270 /nfs/dbraw/zinc/57/22/70/1096572270.db2.gz GQNYMIZQFNBVMG-KFZJALRRSA-N 2 0 355.295 4.084 20 0 FIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)c1 ZINC000423092002 1096572340 /nfs/dbraw/zinc/57/23/40/1096572340.db2.gz ACUYERBTVRUBHS-DKWQAAHISA-N 2 0 370.443 4.056 20 0 FIADRP FC(F)(F)c1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCOCC2)c1 ZINC000423101173 1096575576 /nfs/dbraw/zinc/57/55/76/1096575576.db2.gz IFWYPPPNVHTHQT-ZZJWQFMZSA-N 2 0 368.443 4.046 20 0 FIADRP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]C1CCC(c2ccc(C(C)(C)C)cc2)CC1 ZINC000423115670 1096577648 /nfs/dbraw/zinc/57/76/48/1096577648.db2.gz YGUUZKOJTFJWEU-RTKLAUHFSA-N 2 0 358.570 4.352 20 0 FIADRP CCSc1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423129462 1096581283 /nfs/dbraw/zinc/58/12/83/1096581283.db2.gz LXLUFLNCBZEPBL-TZIWHRDSSA-N 2 0 354.519 4.144 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)N[C@H](C[NH3+])C1CCCC1)C1CCCCC1 ZINC000414718277 1096583330 /nfs/dbraw/zinc/58/33/30/1096583330.db2.gz VOUVHWUKEIEOMQ-OAQYLSRUSA-N 2 0 372.557 4.090 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423113086 1096585808 /nfs/dbraw/zinc/58/58/08/1096585808.db2.gz YIVXSSRVGYSJLT-LHSJRXKWSA-N 2 0 373.928 4.321 20 0 FIADRP Clc1cccc(CC2([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000423154810 1096589810 /nfs/dbraw/zinc/58/98/10/1096589810.db2.gz JXFAJDITCNMGTQ-KNQAVFIVSA-N 2 0 368.908 4.261 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1OC(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503909253 1096593243 /nfs/dbraw/zinc/59/32/43/1096593243.db2.gz LEIKDJJSYKQBRF-JCHJZTRSSA-N 2 0 352.469 4.037 20 0 FIADRP c1c2ccccc2sc1CC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423140924 1096594904 /nfs/dbraw/zinc/59/49/04/1096594904.db2.gz ZSOZLXJNTJVRDP-UGKGYDQZSA-N 2 0 364.514 4.289 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Br)cc1C(F)(F)F ZINC000423186406 1096597213 /nfs/dbraw/zinc/59/72/13/1096597213.db2.gz NZGQCTIBBYSDPK-AWEZNQCLSA-N 2 0 365.237 4.261 20 0 FIADRP COc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccc1OCc1ccccc1 ZINC000503942147 1096604255 /nfs/dbraw/zinc/60/42/55/1096604255.db2.gz BWUQPNJBHYDGTL-UHFFFAOYSA-N 2 0 368.521 4.096 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@H]1CCC[NH2+]C1 ZINC000423209411 1096608865 /nfs/dbraw/zinc/60/88/65/1096608865.db2.gz FFQDULLZEDMYJW-QRTARXTBSA-N 2 0 359.514 4.304 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423228493 1096623639 /nfs/dbraw/zinc/62/36/39/1096623639.db2.gz ZVQIKBCKOFEJQV-WDEREUQCSA-N 2 0 368.344 4.269 20 0 FIADRP [NH3+]C1CCC([NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000423233436 1096625582 /nfs/dbraw/zinc/62/55/82/1096625582.db2.gz OIHCYZBLYSFARY-LADRWXRNSA-N 2 0 359.311 4.398 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253300 1096630732 /nfs/dbraw/zinc/63/07/32/1096630732.db2.gz VSAWDNYXDZIKCE-CJNGLKHVSA-N 2 0 361.942 4.430 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccc(F)c(F)c2)c1 ZINC000423254778 1096631456 /nfs/dbraw/zinc/63/14/56/1096631456.db2.gz ZJWGRDYDWKSCRZ-JLTOFOAXSA-N 2 0 362.489 4.365 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423256435 1096631864 /nfs/dbraw/zinc/63/18/64/1096631864.db2.gz DZZVBFLCSOVHKV-JXFKEZNVSA-N 2 0 360.448 4.357 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC[C@H]3CCC[NH2+]C3)s2)cc1 ZINC000423258370 1096632686 /nfs/dbraw/zinc/63/26/86/1096632686.db2.gz LZBQWRRWGVHNPZ-GOEBONIOSA-N 2 0 359.539 4.167 20 0 FIADRP COC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccc(C(F)(F)F)c1 ZINC000423290086 1096636275 /nfs/dbraw/zinc/63/62/75/1096636275.db2.gz CIMPJJZPXHLTTE-FZKQIMNGSA-N 2 0 352.400 4.202 20 0 FIADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000423308098 1096640440 /nfs/dbraw/zinc/64/04/40/1096640440.db2.gz XJFMCUGXTIBKLF-ZDUSSCGKSA-N 2 0 361.283 4.111 20 0 FIADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000423308095 1096640497 /nfs/dbraw/zinc/64/04/97/1096640497.db2.gz XJFMCUGXTIBKLF-CYBMUJFWSA-N 2 0 361.283 4.111 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423295961 1096644736 /nfs/dbraw/zinc/64/47/36/1096644736.db2.gz XXQBIBLDAVIURI-SBUREZEXSA-N 2 0 361.489 4.184 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423330286 1096648709 /nfs/dbraw/zinc/64/87/09/1096648709.db2.gz BSYDENMKJKQAQB-MRXNPFEDSA-N 2 0 359.926 4.350 20 0 FIADRP C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc(C[NH+]3CCC(C)CC3)cc2)cc1 ZINC000423333180 1096649972 /nfs/dbraw/zinc/64/99/72/1096649972.db2.gz OCHIZHLFQKOACL-QGZVFWFLSA-N 2 0 351.494 4.191 20 0 FIADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423359231 1096656080 /nfs/dbraw/zinc/65/60/80/1096656080.db2.gz URWVPXAZXNVRFL-YCSHWKNNSA-N 2 0 361.533 4.431 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cnn1-c1cccc(Cl)c1 ZINC000423376829 1096668438 /nfs/dbraw/zinc/66/84/38/1096668438.db2.gz JCQTXHZRLBQSHS-CQSZACIVSA-N 2 0 366.896 4.288 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423420210 1096669486 /nfs/dbraw/zinc/66/94/86/1096669486.db2.gz AFHZRQLNFQDUCC-KNXALSJPSA-N 2 0 363.299 4.234 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)cc(Br)c1 ZINC000423402164 1096671346 /nfs/dbraw/zinc/67/13/46/1096671346.db2.gz WIXPNCQSOAEPHE-GOSISDBHSA-N 2 0 363.274 4.432 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccco2)cc1 ZINC000423470845 1096693200 /nfs/dbraw/zinc/69/32/00/1096693200.db2.gz DMKGCVHBEAZBEA-FUHWJXTLSA-N 2 0 363.299 4.253 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)CCC3)cc1 ZINC000423472142 1096694351 /nfs/dbraw/zinc/69/43/51/1096694351.db2.gz MQNZYRYYOPQCEJ-QILLFSRXSA-N 2 0 371.550 4.303 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cc2cc(Br)ccc2o1 ZINC000423477992 1096697304 /nfs/dbraw/zinc/69/73/04/1096697304.db2.gz SUMSXKNDLRENLR-YWPYICTPSA-N 2 0 351.288 4.363 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000423480960 1096698144 /nfs/dbraw/zinc/69/81/44/1096698144.db2.gz WJOFPABBMQXNAV-HQLNMQRFSA-N 2 0 374.544 4.379 20 0 FIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cc(Br)ccc1F ZINC000423454001 1096700005 /nfs/dbraw/zinc/70/00/05/1096700005.db2.gz LFYSXRFTMWYMBA-ACJLOTCBSA-N 2 0 365.290 4.395 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(-c2cccs2)cc1 ZINC000423506027 1096702588 /nfs/dbraw/zinc/70/25/88/1096702588.db2.gz IHBASXZADNEFID-MDMXATFFSA-N 2 0 369.578 4.282 20 0 FIADRP NC1(C[NH2+][C@@H]2CCCC23CCCCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000423523845 1096713104 /nfs/dbraw/zinc/71/31/04/1096713104.db2.gz IUMXWOJPHJGGBD-OAQYLSRUSA-N 2 0 355.570 4.073 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21)c1ccccc1 ZINC000423524477 1096713209 /nfs/dbraw/zinc/71/32/09/1096713209.db2.gz XBBBVLSNVCKOJZ-YADHBBJMSA-N 2 0 360.505 4.320 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)C2)cc1 ZINC000423542148 1096717475 /nfs/dbraw/zinc/71/74/75/1096717475.db2.gz LRWDPOOLWAKQTB-NZKYLMMGSA-N 2 0 352.444 4.319 20 0 FIADRP COc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccccc2Cl)c1 ZINC000423542234 1096717507 /nfs/dbraw/zinc/71/75/07/1096717507.db2.gz MEUXNVLJQQEPPS-FBAVSBLXSA-N 2 0 370.924 4.416 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H]4C[NH2+]C[C@@H]4C2)CCC3)cc1 ZINC000423547818 1096718710 /nfs/dbraw/zinc/71/87/10/1096718710.db2.gz QGRRWKNNMFVPBQ-CYGHRXIMSA-N 2 0 371.525 4.304 20 0 FIADRP Fc1cc(Br)ccc1[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000423548999 1096719451 /nfs/dbraw/zinc/71/94/51/1096719451.db2.gz RPLQZWWRUCQGFW-ZFHGCVPZSA-N 2 0 367.306 4.017 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(F)cc(Br)c1 ZINC000423553215 1096720295 /nfs/dbraw/zinc/72/02/95/1096720295.db2.gz VZBOEKNHEGVAKZ-ZPUIDXCVSA-N 2 0 355.295 4.017 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc3ccccc32)CC1 ZINC000533243841 1098900857 /nfs/dbraw/zinc/90/08/57/1098900857.db2.gz HNDILNFQHFLRSN-GOSISDBHSA-N 2 0 367.537 4.221 20 0 FIADRP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C1 ZINC000436292356 1098907989 /nfs/dbraw/zinc/90/79/89/1098907989.db2.gz NACOURMXBPEFQM-XMSQKQJNSA-N 2 0 356.554 4.181 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)cc1OC ZINC000436296610 1098909973 /nfs/dbraw/zinc/90/99/73/1098909973.db2.gz VFUZGRDKELLIDE-YLJYHZDGSA-N 2 0 360.542 4.022 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436296566 1098910219 /nfs/dbraw/zinc/91/02/19/1098910219.db2.gz UYJKUPRRHYLOGV-WDSOQIARSA-N 2 0 356.485 4.363 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@H](C)C1 ZINC000436302386 1098915742 /nfs/dbraw/zinc/91/57/42/1098915742.db2.gz UEADMBQOXNCXAC-DWIQEWEKSA-N 2 0 364.961 4.313 20 0 FIADRP C[C@H]1OCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000533362463 1098980721 /nfs/dbraw/zinc/98/07/21/1098980721.db2.gz XDUKHRVGQRRYRX-JPYJTQIMSA-N 2 0 350.506 4.216 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000436402232 1098991362 /nfs/dbraw/zinc/99/13/62/1098991362.db2.gz UUDUNPQTOLPFFS-QDSKXPNFSA-N 2 0 364.533 4.069 20 0 FIADRP Cc1ccc2c(CC[NH2+]Cc3cc(-n4ccnc4)cs3)cn(C)c2c1 ZINC000436413113 1098996367 /nfs/dbraw/zinc/99/63/67/1098996367.db2.gz UAAHZRJHWAMZPR-UHFFFAOYSA-N 2 0 350.491 4.066 20 0 FIADRP FC(F)(F)COc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533534556 1099162374 /nfs/dbraw/zinc/16/23/74/1099162374.db2.gz XKJSPPFOYHAONC-QFBILLFUSA-N 2 0 368.443 4.076 20 0 FIADRP Cc1cn2c(n1)[C@@H](C[NH2+]Cc1ccc(-c3ccncc3)cc1F)CCC2 ZINC000533565360 1099176241 /nfs/dbraw/zinc/17/62/41/1099176241.db2.gz QHKJYHGEQJRCOY-LJQANCHMSA-N 2 0 350.441 4.060 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)ccc1OC(C)C ZINC000459388603 1099348987 /nfs/dbraw/zinc/34/89/87/1099348987.db2.gz LVUHQJIOEPDPLC-QGZVFWFLSA-N 2 0 369.509 4.197 20 0 FIADRP CC[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cccc(Cl)c1F ZINC000161980983 1099563558 /nfs/dbraw/zinc/56/35/58/1099563558.db2.gz LGPCVFRFAONPCX-KRWDZBQOSA-N 2 0 365.880 4.055 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000162277038 1099672267 /nfs/dbraw/zinc/67/22/67/1099672267.db2.gz HTKAYFOLCTTZKV-HOTGVXAUSA-N 2 0 360.473 4.187 20 0 FIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000162520852 1099815183 /nfs/dbraw/zinc/81/51/83/1099815183.db2.gz QLPAFCMDQCNWAY-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)cc1O ZINC000437350641 1099820017 /nfs/dbraw/zinc/82/00/17/1099820017.db2.gz WHSKDSNIMSRXHC-FXAWDEMLSA-N 2 0 360.542 4.109 20 0 FIADRP C[C@H]([NH2+]CCc1nc2ccccc2s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508691806 1099824462 /nfs/dbraw/zinc/82/44/62/1099824462.db2.gz QEPKUATUQSQHRB-PKOBYXMFSA-N 2 0 365.546 4.339 20 0 FIADRP C[C@H](NCCC[N@H+](C)Cc1ccccc1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508701305 1099842046 /nfs/dbraw/zinc/84/20/46/1099842046.db2.gz WNIYKKAQWZLLAT-URXFXBBRSA-N 2 0 365.565 4.009 20 0 FIADRP C[C@H](COc1ccc(F)cc1F)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508702510 1099855213 /nfs/dbraw/zinc/85/52/13/1099855213.db2.gz ZILSBGHWGDQPLV-LMMKCTJWSA-N 2 0 374.475 4.232 20 0 FIADRP C[C@H](O)C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000508703605 1099858387 /nfs/dbraw/zinc/85/83/87/1099858387.db2.gz ZACGRANPGKTFFA-NVXDSCFRSA-N 2 0 366.549 4.041 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)ccc1SC ZINC000162578090 1099887567 /nfs/dbraw/zinc/88/75/67/1099887567.db2.gz JFEAMMIFDVSUKT-INIZCTEOSA-N 2 0 374.550 4.208 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000508708939 1099888760 /nfs/dbraw/zinc/88/87/60/1099888760.db2.gz FCXQGUBSRIBUKA-KSEOMHKRSA-N 2 0 369.553 4.163 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508711060 1099902438 /nfs/dbraw/zinc/90/24/38/1099902438.db2.gz OBHACPIRMGCZSK-CNNODRBYSA-N 2 0 352.522 4.126 20 0 FIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2ccccc21 ZINC000516890979 1099912694 /nfs/dbraw/zinc/91/26/94/1099912694.db2.gz YGKHHFYYAWEJHJ-FCHUYYIVSA-N 2 0 367.537 4.386 20 0 FIADRP CCOc1ccc(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)cc1OC ZINC000506055013 1099943223 /nfs/dbraw/zinc/94/32/23/1099943223.db2.gz GVNGJQTZCUNMCV-UHFFFAOYSA-N 2 0 356.510 4.178 20 0 FIADRP CC(C)C[C@@H](C)Oc1cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)ccn1 ZINC000459404531 1100111907 /nfs/dbraw/zinc/11/19/07/1100111907.db2.gz DADZOWKAIKFPMG-GOSISDBHSA-N 2 0 368.525 4.049 20 0 FIADRP c1ccc(C[NH+]2CCC([C@H]3CCCCC[N@@H+]3Cc3ncccn3)CC2)cc1 ZINC000459531386 1100281716 /nfs/dbraw/zinc/28/17/16/1100281716.db2.gz VPYMLMLOPKZMBZ-JOCHJYFZSA-N 2 0 364.537 4.133 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cnccc2C)CC1 ZINC000536775411 1100297436 /nfs/dbraw/zinc/29/74/36/1100297436.db2.gz IJSRHGRYZFTWJE-QZTJIDSGSA-N 2 0 370.516 4.083 20 0 FIADRP C[C@H](Cc1cc(Br)ccc1F)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000536829683 1100328256 /nfs/dbraw/zinc/32/82/56/1100328256.db2.gz YNMCOXXXKDYIBA-CYBMUJFWSA-N 2 0 371.338 4.372 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCOC3(CCSCC3)C2)CC1 ZINC000536851256 1100365329 /nfs/dbraw/zinc/36/53/29/1100365329.db2.gz KJSZXNWYDSNYLX-RLLQIKCJSA-N 2 0 366.615 4.064 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536857651 1100372440 /nfs/dbraw/zinc/37/24/40/1100372440.db2.gz LSVBYFLMPRIDOD-OAGGEKHMSA-N 2 0 358.448 4.245 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536857655 1100373107 /nfs/dbraw/zinc/37/31/07/1100373107.db2.gz LSVBYFLMPRIDOD-OWCLPIDISA-N 2 0 358.448 4.245 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2Cl)[C@@H](C)C1 ZINC000536875030 1100397199 /nfs/dbraw/zinc/39/71/99/1100397199.db2.gz GPVBCVYDKCMWIM-YJBOKZPZSA-N 2 0 373.368 4.263 20 0 FIADRP Cc1noc(C2CCC([NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)n1 ZINC000517472079 1100397534 /nfs/dbraw/zinc/39/75/34/1100397534.db2.gz WHTUZMBRSXHEKT-UHFFFAOYSA-N 2 0 368.525 4.180 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]C/C=C\c3ccccc3)cc2)C[C@@H](C)O1 ZINC000517538997 1100460737 /nfs/dbraw/zinc/46/07/37/1100460737.db2.gz VWIZDOLSTSJFHP-ZNIXBBRXSA-N 2 0 350.506 4.099 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C/C=C/c3ccccc3)CC2)c1 ZINC000517540654 1100463298 /nfs/dbraw/zinc/46/32/98/1100463298.db2.gz DRFDYBZNAZEASK-XYOKQWHBSA-N 2 0 363.549 4.200 20 0 FIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc(Cl)c1OC ZINC000517537186 1100475613 /nfs/dbraw/zinc/47/56/13/1100475613.db2.gz KLXCKSXYLDVOSS-HOTGVXAUSA-N 2 0 368.949 4.205 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000425956285 1100478058 /nfs/dbraw/zinc/47/80/58/1100478058.db2.gz WFVZYNQPOODBDW-MRXNPFEDSA-N 2 0 356.485 4.494 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC000426022152 1100677413 /nfs/dbraw/zinc/67/74/13/1100677413.db2.gz NGBUQOWFMIPSDA-COPCDDAFSA-N 2 0 364.533 4.053 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1O ZINC000426159746 1100929699 /nfs/dbraw/zinc/92/96/99/1100929699.db2.gz IOMKZJIHUAIFEI-KRWDZBQOSA-N 2 0 360.542 4.109 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cccc(C)c2C)CC1 ZINC000518274378 1101057051 /nfs/dbraw/zinc/05/70/51/1101057051.db2.gz YVIHWFVEVIXKAA-LJQANCHMSA-N 2 0 369.528 4.435 20 0 FIADRP CC(C)COc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000518277619 1101061084 /nfs/dbraw/zinc/06/10/84/1101061084.db2.gz ZATHUHSRXURPDK-HSZRJFAPSA-N 2 0 366.549 4.376 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)s1 ZINC000439146571 1101200094 /nfs/dbraw/zinc/20/00/94/1101200094.db2.gz NCKPQBPJXULECY-DVOMOZLQSA-N 2 0 355.345 4.178 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCN(c4ccccc4F)C3)CC2)C1 ZINC000426302860 1101236716 /nfs/dbraw/zinc/23/67/16/1101236716.db2.gz VGKSQWOEOSBDNV-RLLQIKCJSA-N 2 0 359.533 4.037 20 0 FIADRP C[C@@H](C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1)CN1CC[NH+](C)CC1 ZINC000467383477 1101285494 /nfs/dbraw/zinc/28/54/94/1101285494.db2.gz TYVNWNUEQWRWPM-LAUBAEHRSA-N 2 0 363.977 4.044 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000459723640 1101344713 /nfs/dbraw/zinc/34/47/13/1101344713.db2.gz AIMFSMCNOYNHKS-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1O ZINC000426354250 1101348978 /nfs/dbraw/zinc/34/89/78/1101348978.db2.gz YQTLQYPBWXTSJL-GOSISDBHSA-N 2 0 370.537 4.352 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000537013766 1101394228 /nfs/dbraw/zinc/39/42/28/1101394228.db2.gz QODUNEOYGMFSCH-ZLNRFVROSA-N 2 0 374.544 4.415 20 0 FIADRP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCc2cccnc2)cc1 ZINC000537024565 1101402285 /nfs/dbraw/zinc/40/22/85/1101402285.db2.gz PVUUPHVVHNLJAW-WIYYLYMNSA-N 2 0 353.510 4.186 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000537104859 1101451787 /nfs/dbraw/zinc/45/17/87/1101451787.db2.gz XQFAYWSPEYLCGO-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)C1 ZINC000414998962 1101460974 /nfs/dbraw/zinc/46/09/74/1101460974.db2.gz REUJRKLOLOYQIL-YGRLFVJLSA-N 2 0 365.237 4.075 20 0 FIADRP CC(C)[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccnc1 ZINC000537095637 1101461929 /nfs/dbraw/zinc/46/19/29/1101461929.db2.gz IXWYEADVMWRBJZ-HSZRJFAPSA-N 2 0 367.537 4.086 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1O ZINC000426406222 1101505940 /nfs/dbraw/zinc/50/59/40/1101505940.db2.gz ORUYPKGRRPRDGP-SFHVURJKSA-N 2 0 368.521 4.108 20 0 FIADRP Cc1cccc(CC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000537160153 1101506096 /nfs/dbraw/zinc/50/60/96/1101506096.db2.gz DXCSDFXYWIGVHP-NRFANRHFSA-N 2 0 350.506 4.115 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1O ZINC000426406221 1101506238 /nfs/dbraw/zinc/50/62/38/1101506238.db2.gz ORUYPKGRRPRDGP-GOSISDBHSA-N 2 0 368.521 4.108 20 0 FIADRP COc1cccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1OC(C)C ZINC000518763515 1101518545 /nfs/dbraw/zinc/51/85/45/1101518545.db2.gz RTFMRJUAGMCLAY-OALUTQOASA-N 2 0 362.558 4.330 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000518765496 1101522079 /nfs/dbraw/zinc/52/20/79/1101522079.db2.gz FSGAPDSSKCCEET-IAGOWNOFSA-N 2 0 372.475 4.475 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2)C2CCCCC2)CC1 ZINC000537193198 1101527188 /nfs/dbraw/zinc/52/71/88/1101527188.db2.gz VLUGPMJSRORYHB-YTFSRNRJSA-N 2 0 356.554 4.275 20 0 FIADRP Cn1cnc2cc(CN3CC[C@@H]4[C@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc21 ZINC000537202874 1101555569 /nfs/dbraw/zinc/55/55/69/1101555569.db2.gz CBPXYUQCRYLGNF-FYYLOGMGSA-N 2 0 374.532 4.060 20 0 FIADRP CCO[C@H]1C[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C12CCCCC2 ZINC000537294007 1101613038 /nfs/dbraw/zinc/61/30/38/1101613038.db2.gz PZTRJNABXWTFRV-SFTDATJTSA-N 2 0 357.542 4.016 20 0 FIADRP CC[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CCO1 ZINC000648446707 1101705969 /nfs/dbraw/zinc/70/59/69/1101705969.db2.gz PQTKYSUARUHPTN-RBUKOAKNSA-N 2 0 350.934 4.099 20 0 FIADRP COc1cccc(CC2([NH3+])CC[NH+]([C@H](C)Cc3ccc(Cl)cc3)CC2)c1 ZINC001168169178 1101853523 /nfs/dbraw/zinc/85/35/23/1101853523.db2.gz XLORNGCMMUNFPW-QGZVFWFLSA-N 2 0 372.940 4.316 20 0 FIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]C2CCC3(CCCO3)CC2)CC1 ZINC000519047553 1101860659 /nfs/dbraw/zinc/86/06/59/1101860659.db2.gz ACMBXOIYXRTXHE-UHFFFAOYSA-N 2 0 356.554 4.500 20 0 FIADRP CO[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC001168170300 1101890538 /nfs/dbraw/zinc/89/05/38/1101890538.db2.gz JHKVAUHEZZTYSH-MTNREXPMSA-N 2 0 372.940 4.150 20 0 FIADRP CSc1cccc([C@@H]([NH2+]CC2CC[NH2+]CC2)c2ccc(F)c(F)c2)c1 ZINC000519138373 1101949838 /nfs/dbraw/zinc/94/98/38/1101949838.db2.gz YJTQRCUMHIBYQA-HXUWFJFHSA-N 2 0 362.489 4.365 20 0 FIADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000519189551 1101986456 /nfs/dbraw/zinc/98/64/56/1101986456.db2.gz DJYYZIVJQXDJFF-AKIFATBCSA-N 2 0 370.581 4.474 20 0 FIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)cc1 ZINC000061000068 1102187153 /nfs/dbraw/zinc/18/71/53/1102187153.db2.gz MFMBVGBNUNFDOC-OALUTQOASA-N 2 0 352.522 4.463 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000467399101 1102230440 /nfs/dbraw/zinc/23/04/40/1102230440.db2.gz CYLUZKLHCNGIGD-VQIMIIECSA-N 2 0 372.475 4.240 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000120582919 1102234737 /nfs/dbraw/zinc/23/47/37/1102234737.db2.gz CCUNYXMXTUPKRI-QGZVFWFLSA-N 2 0 356.510 4.396 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000120581382 1102235712 /nfs/dbraw/zinc/23/57/12/1102235712.db2.gz YYDSBKPIZCKXKO-QGZVFWFLSA-N 2 0 354.494 4.150 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC)c(OC)c1 ZINC000120890811 1102262970 /nfs/dbraw/zinc/26/29/70/1102262970.db2.gz USSKAQOMDSRTCN-LJQANCHMSA-N 2 0 360.473 4.145 20 0 FIADRP COc1cc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)ccc1OCc1cccs1 ZINC000415022977 1102264084 /nfs/dbraw/zinc/26/40/84/1102264084.db2.gz JXYBQHWYIPDZJC-QAQDUYKDSA-N 2 0 374.550 4.190 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc(OC(F)F)c1 ZINC000120894317 1102295132 /nfs/dbraw/zinc/29/51/32/1102295132.db2.gz REJPXUNEHCSFFC-CYBMUJFWSA-N 2 0 352.400 4.340 20 0 FIADRP CN1CC[C@H]([NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000550796835 1102328224 /nfs/dbraw/zinc/32/82/24/1102328224.db2.gz CXTJJYSDAPWWDG-GPJHCHHRSA-N 2 0 350.506 4.189 20 0 FIADRP CC(C)C[NH+]1CCC(N[C@@H](C)c2cc(Br)ccc2F)CC1 ZINC000532451934 1102343026 /nfs/dbraw/zinc/34/30/26/1102343026.db2.gz ZWSPQUGSENFICW-ZDUSSCGKSA-N 2 0 357.311 4.359 20 0 FIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532454382 1102345674 /nfs/dbraw/zinc/34/56/74/1102345674.db2.gz VIVGQSSUVKDAMS-QHCPKHFHSA-N 2 0 350.506 4.458 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1O ZINC000519542232 1102375934 /nfs/dbraw/zinc/37/59/34/1102375934.db2.gz IHWAEIDDQXCUSZ-HNNXBMFYSA-N 2 0 360.523 4.025 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Br)c2)[C@H](C)C1 ZINC000537635824 1102381597 /nfs/dbraw/zinc/38/15/97/1102381597.db2.gz ZDQLHQXDHLTUPY-DAYGRLMNSA-N 2 0 353.348 4.215 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CC1 ZINC000121695833 1102439817 /nfs/dbraw/zinc/43/98/17/1102439817.db2.gz RDYJCIPMALHZBX-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)C1CCOCC1 ZINC000532514565 1102449541 /nfs/dbraw/zinc/44/95/41/1102449541.db2.gz WMOKQMDBZVLXOS-NRFANRHFSA-N 2 0 364.961 4.347 20 0 FIADRP Cc1ccc(Cl)c(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1F ZINC001167973076 1102525442 /nfs/dbraw/zinc/52/54/42/1102525442.db2.gz FSRUZONOXKUMDX-ALOPSCKCSA-N 2 0 350.909 4.325 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Cl ZINC000122312621 1102566016 /nfs/dbraw/zinc/56/60/16/1102566016.db2.gz UJWGQXKOAMCCSU-OAHLLOKOSA-N 2 0 362.901 4.140 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cccc(C(F)(F)F)n2)CC1 ZINC000550857308 1102577334 /nfs/dbraw/zinc/57/73/34/1102577334.db2.gz REGLPBHHCNWWOC-MAUKXSAKSA-N 2 0 369.475 4.276 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(C(F)(F)F)c1 ZINC000122364290 1102579052 /nfs/dbraw/zinc/57/90/52/1102579052.db2.gz CACIYSNCDLLOPT-HNNXBMFYSA-N 2 0 366.427 4.497 20 0 FIADRP FC(F)(F)c1cccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000550858275 1102625187 /nfs/dbraw/zinc/62/51/87/1102625187.db2.gz PVCQNIYEVUGDTJ-UHFFFAOYSA-N 2 0 355.448 4.030 20 0 FIADRP CCOc1cccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1OC(F)F ZINC000537647480 1102647779 /nfs/dbraw/zinc/64/77/79/1102647779.db2.gz HGBAMZRZKBBESU-UHFFFAOYSA-N 2 0 370.484 4.241 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000550881721 1102653656 /nfs/dbraw/zinc/65/36/56/1102653656.db2.gz BFOHWTZCDGSBII-LRDDRELGSA-N 2 0 373.766 4.310 20 0 FIADRP CC[C@@H]1CN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC[C@@H]1[NH3+] ZINC000666657047 1102675832 /nfs/dbraw/zinc/67/58/32/1102675832.db2.gz KSJBPMYHIWELGI-XLIONFOSSA-N 2 0 372.557 4.042 20 0 FIADRP COc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168257636 1102682486 /nfs/dbraw/zinc/68/24/86/1102682486.db2.gz OTGXORYLWXCAKO-VABKMULXSA-N 2 0 364.533 4.243 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21)C1CC[NH+](C)CC1 ZINC000537649686 1102683389 /nfs/dbraw/zinc/68/33/89/1102683389.db2.gz VOCWBGUMCAFOHV-VXKWHMMOSA-N 2 0 373.610 4.077 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cn(C)nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000537652431 1102728401 /nfs/dbraw/zinc/72/84/01/1102728401.db2.gz UXRWEUPQOAIUMZ-AZUAARDMSA-N 2 0 368.569 4.108 20 0 FIADRP COc1cccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)c1 ZINC001167979028 1102746970 /nfs/dbraw/zinc/74/69/70/1102746970.db2.gz SODZPBKKAZKMSF-FRIKZZABSA-N 2 0 368.565 4.403 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)CC[NH+](C)CC1 ZINC000519569834 1102779242 /nfs/dbraw/zinc/77/92/42/1102779242.db2.gz AYQQUDOPUQXXDE-QGZVFWFLSA-N 2 0 368.974 4.279 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(Cl)oc3ccccc32)CC1 ZINC000537660048 1102784072 /nfs/dbraw/zinc/78/40/72/1102784072.db2.gz VGTOFDFLPWRYJA-UHFFFAOYSA-N 2 0 364.917 4.409 20 0 FIADRP c1cc(N2CCC(Nc3ccc(CC[NH+]4CCCCC4)cc3)CC2)cc[nH+]1 ZINC000459350620 1102889513 /nfs/dbraw/zinc/88/95/13/1102889513.db2.gz VSPRQPRVUBMNAO-UHFFFAOYSA-N 2 0 364.537 4.191 20 0 FIADRP CC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000459372198 1102998828 /nfs/dbraw/zinc/99/88/28/1102998828.db2.gz UGPRDCGTYBXEES-SFHVURJKSA-N 2 0 361.436 4.393 20 0 FIADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551263641 1103021860 /nfs/dbraw/zinc/02/18/60/1103021860.db2.gz DDUREAVJZFVRRR-DENIHFKCSA-N 2 0 356.554 4.084 20 0 FIADRP C[NH+](C)CC1CCC([NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000532727302 1103150777 /nfs/dbraw/zinc/15/07/77/1103150777.db2.gz BMYHMROYLCIWFS-UHFFFAOYSA-N 2 0 369.336 4.479 20 0 FIADRP Cc1ccccc1[C@H](C)[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)CC(C)C ZINC000551428897 1103220693 /nfs/dbraw/zinc/22/06/93/1103220693.db2.gz WAZHZEPTFXLKSR-FQEVSTJZSA-N 2 0 373.585 4.003 20 0 FIADRP Cc1ccc(-c2ncc(C[N@H+]3CC[C@H](C4CC[NH+](C)CC4)C3)s2)cc1 ZINC000514693201 1103272883 /nfs/dbraw/zinc/27/28/83/1103272883.db2.gz KCVNMDDQTHJFFV-IBGZPJMESA-N 2 0 355.551 4.282 20 0 FIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1Cl ZINC000551778470 1103624458 /nfs/dbraw/zinc/62/44/58/1103624458.db2.gz ITGDRIZJWDDVMX-IRXDYDNUSA-N 2 0 368.949 4.279 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)[C@H](C)C2 ZINC000551813394 1103695620 /nfs/dbraw/zinc/69/56/20/1103695620.db2.gz LQTACXRLENFTTQ-HOYKHHGWSA-N 2 0 364.533 4.491 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(-c3ccccc3)nc3ccccn32)[C@@H](C)C1 ZINC000440688625 1103888829 /nfs/dbraw/zinc/88/88/29/1103888829.db2.gz GSRRJAVXKIBUAJ-ICSRJNTNSA-N 2 0 362.521 4.163 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3c2ccc(OC)c3F)cc1 ZINC000519841022 1103894910 /nfs/dbraw/zinc/89/49/10/1103894910.db2.gz BTLBJEPPXGEWLW-HXUWFJFHSA-N 2 0 356.485 4.453 20 0 FIADRP Cn1cnc2cc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)ccc21 ZINC000538304487 1104125211 /nfs/dbraw/zinc/12/52/11/1104125211.db2.gz KRMQLOQIFQAIBU-UHFFFAOYSA-N 2 0 374.532 4.061 20 0 FIADRP CN(C)c1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000520233890 1104191038 /nfs/dbraw/zinc/19/10/38/1104191038.db2.gz PBCDZRUNSYFILC-UHFFFAOYSA-N 2 0 371.956 4.408 20 0 FIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441419132 1104399676 /nfs/dbraw/zinc/39/96/76/1104399676.db2.gz JJURSYUUAFFQPX-SIKLNZKXSA-N 2 0 350.506 4.167 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(F)c1 ZINC000188445463 1104463304 /nfs/dbraw/zinc/46/33/04/1104463304.db2.gz VRWZETWYIYLZKB-YADHBBJMSA-N 2 0 356.485 4.023 20 0 FIADRP Fc1ccc2c(c1)c1c(n2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC[NH2+]C1 ZINC001167994949 1104486364 /nfs/dbraw/zinc/48/63/64/1104486364.db2.gz RHPUJDLQOXGGAA-JWTNVVGKSA-N 2 0 353.485 4.004 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000152296447 1104509636 /nfs/dbraw/zinc/50/96/36/1104509636.db2.gz CIUJAMKDMXNHML-NRSPTQNISA-N 2 0 359.558 4.049 20 0 FIADRP c1ccc2cc(OCC[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441425126 1104563722 /nfs/dbraw/zinc/56/37/22/1104563722.db2.gz WOHDMGVPPHCSHQ-OFNKIYASSA-N 2 0 350.506 4.167 20 0 FIADRP c1ccc2cc(OCC[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441425124 1104563777 /nfs/dbraw/zinc/56/37/77/1104563777.db2.gz WOHDMGVPPHCSHQ-NZQKXSOJSA-N 2 0 350.506 4.167 20 0 FIADRP COC(=O)c1cccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001168002182 1104971176 /nfs/dbraw/zinc/97/11/76/1104971176.db2.gz PQAJXIHYALOVSH-IUPYZPJSSA-N 2 0 368.521 4.016 20 0 FIADRP c1ccc2c(c1)CCC1(CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC1)O2 ZINC001168003615 1105002391 /nfs/dbraw/zinc/00/23/91/1105002391.db2.gz PSKWQZKYPQCWAC-CBQGHPETSA-N 2 0 366.549 4.252 20 0 FIADRP COc1cccc(CC[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168005042 1105063366 /nfs/dbraw/zinc/06/33/66/1105063366.db2.gz FEUGNBFBUIWKMZ-HATOLVCRSA-N 2 0 352.522 4.269 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1Br ZINC000216502488 1105144887 /nfs/dbraw/zinc/14/48/87/1105144887.db2.gz LLKYVBGRSSGASD-GFCCVEGCSA-N 2 0 369.347 4.418 20 0 FIADRP C[NH+](C)C[C@H](N[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000530227492 1106915869 /nfs/dbraw/zinc/91/58/69/1106915869.db2.gz YIIOKMROTDVRQC-FHWLQOOXSA-N 2 0 364.320 4.331 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530241450 1106923406 /nfs/dbraw/zinc/92/34/06/1106923406.db2.gz PYMVBWRJEYAYQM-CJNGLKHVSA-N 2 0 357.325 4.145 20 0 FIADRP CCOc1cc2[nH+]ccc(NC3CC[NH+](C4CC4)CC3)c2cc1OCC ZINC000301152379 1106948242 /nfs/dbraw/zinc/94/82/42/1106948242.db2.gz BFMFKKMONOJSRC-UHFFFAOYSA-N 2 0 355.482 4.071 20 0 FIADRP Cc1cc(NCc2ccccc2CN2CCOCC2)c2cc(F)ccc2[nH+]1 ZINC000301694019 1107112653 /nfs/dbraw/zinc/11/26/53/1107112653.db2.gz XYCMSTORGZFJDM-UHFFFAOYSA-N 2 0 365.452 4.127 20 0 FIADRP COc1cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c(-c2ccccc2)cc1OC ZINC000530675902 1107248684 /nfs/dbraw/zinc/24/86/84/1107248684.db2.gz ZQPVHMQHOCPZDL-PMACEKPBSA-N 2 0 368.521 4.333 20 0 FIADRP CCc1c(C)[nH+]c2ccccc2c1NC1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000302043161 1107273836 /nfs/dbraw/zinc/27/38/36/1107273836.db2.gz OJAXMEKMWJMLSA-KRWDZBQOSA-N 2 0 353.510 4.018 20 0 FIADRP Cc1ccc2[nH+]ccc(NCc3ccccc3C[N@@H+]3CCC[C@H]3CO)c2c1 ZINC000302906189 1107485042 /nfs/dbraw/zinc/48/50/42/1107485042.db2.gz WOFBIGYJBBYFLC-FQEVSTJZSA-N 2 0 361.489 4.112 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCS2 ZINC000152441200 1107644859 /nfs/dbraw/zinc/64/48/59/1107644859.db2.gz VWIAIXUZTJBYFR-BLLLJJGKSA-N 2 0 367.356 4.060 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000152455052 1107719926 /nfs/dbraw/zinc/71/99/26/1107719926.db2.gz RVWISXDVBIFTQH-HOCLYGCPSA-N 2 0 371.550 4.262 20 0 FIADRP C[C@H](Cc1ccc(Br)cc1F)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475573333 1107768664 /nfs/dbraw/zinc/76/86/64/1107768664.db2.gz HQZAWHMJNQYTTN-NVPAJSRCSA-N 2 0 369.322 4.126 20 0 FIADRP C[NH+](C)Cc1ccc(-c2noc(-c3cccc(C[NH+]4CCCC4)c3)n2)cc1 ZINC000531348247 1107788844 /nfs/dbraw/zinc/78/88/44/1107788844.db2.gz BTQWHEPIHMXGGJ-UHFFFAOYSA-N 2 0 362.477 4.061 20 0 FIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1OCc1ccccc1 ZINC000531389922 1107841070 /nfs/dbraw/zinc/84/10/70/1107841070.db2.gz XTHAOBUTPZRSHP-RTWAWAEBSA-N 2 0 368.521 4.237 20 0 FIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000531705511 1108083458 /nfs/dbraw/zinc/08/34/58/1108083458.db2.gz CZEWRWWHWABVMI-ZHRRBRCNSA-N 2 0 356.485 4.179 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H]3CCc4ccccc43)CC2)cc1 ZINC000531738322 1108106852 /nfs/dbraw/zinc/10/68/52/1108106852.db2.gz JVQSUDARVUVZTK-DEOSSOPVSA-N 2 0 364.533 4.335 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccsc1 ZINC000453102385 1108170627 /nfs/dbraw/zinc/17/06/27/1108170627.db2.gz PLDHVGYOULKSPE-DNVCBOLYSA-N 2 0 361.530 4.441 20 0 FIADRP Clc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCC2)cc1 ZINC000453112608 1108181210 /nfs/dbraw/zinc/18/12/10/1108181210.db2.gz QYPTWSTVPOJNGQ-KKSFZXQISA-N 2 0 362.945 4.272 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c2sccc21 ZINC000453197022 1108267613 /nfs/dbraw/zinc/26/76/13/1108267613.db2.gz MSFCCULGYPBWHB-BSIFCXSSSA-N 2 0 370.562 4.433 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2sccc21 ZINC000453231171 1108305181 /nfs/dbraw/zinc/30/51/81/1108305181.db2.gz QDVHROIPFYFQFS-QAPCUYQASA-N 2 0 359.539 4.202 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531941961 1108384277 /nfs/dbraw/zinc/38/42/77/1108384277.db2.gz ALBCRHFLPJMWRT-KRWDZBQOSA-N 2 0 363.505 4.018 20 0 FIADRP Cc1ncsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453310467 1108396313 /nfs/dbraw/zinc/39/63/13/1108396313.db2.gz QTUGEHDIVYSSFK-XUVXKRRUSA-N 2 0 355.551 4.027 20 0 FIADRP C[N@H+](Cc1ccccc1)C1(CN[C@@H]2CC[NH+]3CCC[C@@H]3C2)CCCCC1 ZINC000714226701 1108401858 /nfs/dbraw/zinc/40/18/58/1108401858.db2.gz OAWUAYHBLAJUKD-FGZHOGPDSA-N 2 0 355.570 4.038 20 0 FIADRP CC(C)[C@H]1C[C@H](C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000453313934 1108402511 /nfs/dbraw/zinc/40/25/11/1108402511.db2.gz DYMKUZNZCHRMJW-WYZYGFAWSA-N 2 0 358.570 4.470 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)CCc3ccco3)CC2)c1 ZINC000531945336 1108415432 /nfs/dbraw/zinc/41/54/32/1108415432.db2.gz FYVDPXVLSMOZGS-OAQYLSRUSA-N 2 0 369.553 4.101 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Br)cc2)CCC1 ZINC000531956394 1108445573 /nfs/dbraw/zinc/44/55/73/1108445573.db2.gz GVHXFIUSJUPEFV-RKVPGOIHSA-N 2 0 365.359 4.189 20 0 FIADRP C[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc2ccccc2c1 ZINC000531965312 1108460630 /nfs/dbraw/zinc/46/06/30/1108460630.db2.gz VJJRDJMNDNEXRZ-NLFFAJNJSA-N 2 0 373.544 4.479 20 0 FIADRP C[C@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453386516 1108472548 /nfs/dbraw/zinc/47/25/48/1108472548.db2.gz VETLZMGKGSNRRU-AVRDEDQJSA-N 2 0 367.537 4.249 20 0 FIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000531989147 1108474440 /nfs/dbraw/zinc/47/44/40/1108474440.db2.gz HUXKTHPFDDYRJR-HSZRJFAPSA-N 2 0 350.506 4.458 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CC(C)(C)OC1(C)C ZINC000531980900 1108495363 /nfs/dbraw/zinc/49/53/63/1108495363.db2.gz FZBHREFOYWYALR-FQEVSTJZSA-N 2 0 356.510 4.347 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cnn1-c1cccc(Cl)c1 ZINC000453399235 1108502595 /nfs/dbraw/zinc/50/25/95/1108502595.db2.gz LEJOORHYANPUBE-OAHLLOKOSA-N 2 0 360.933 4.359 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000523862377 1108612451 /nfs/dbraw/zinc/61/24/51/1108612451.db2.gz QJYUEXPZSLRERB-QGZVFWFLSA-N 2 0 356.938 4.203 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000532210181 1108712879 /nfs/dbraw/zinc/71/28/79/1108712879.db2.gz WHMHEZPZUWNPKY-KRWDZBQOSA-N 2 0 372.557 4.085 20 0 FIADRP COc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(OC(F)F)c1 ZINC000524457900 1109020596 /nfs/dbraw/zinc/02/05/96/1109020596.db2.gz LAYFRJZDLLSBAO-IYBDPMFKSA-N 2 0 370.484 4.144 20 0 FIADRP C[NH+](C)Cc1cccc(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)c1 ZINC000524976909 1109226060 /nfs/dbraw/zinc/22/60/60/1109226060.db2.gz SMZGSHFLFFUZDI-UHFFFAOYSA-N 2 0 365.521 4.029 20 0 FIADRP Cc1cc(N2CCC[N@@H+](C(C)(C)C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000525362975 1109352784 /nfs/dbraw/zinc/35/27/84/1109352784.db2.gz IRUGKNIOTCFBQN-UHFFFAOYSA-N 2 0 363.452 4.455 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446840377 1109361858 /nfs/dbraw/zinc/36/18/58/1109361858.db2.gz FURKFYZYBHIPTB-MRXNPFEDSA-N 2 0 359.739 4.485 20 0 FIADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Br)cc1Cl ZINC000446938954 1109395005 /nfs/dbraw/zinc/39/50/05/1109395005.db2.gz YQIZHXZRLMUOFC-INIZCTEOSA-N 2 0 357.723 4.405 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000525820780 1109526174 /nfs/dbraw/zinc/52/61/74/1109526174.db2.gz YOBSYJGERLEUKD-UHFFFAOYSA-N 2 0 374.447 4.016 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OC ZINC000447550143 1109567574 /nfs/dbraw/zinc/56/75/74/1109567574.db2.gz HAOLASZPTUSWHK-KRWDZBQOSA-N 2 0 360.542 4.399 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000447571195 1109578030 /nfs/dbraw/zinc/57/80/30/1109578030.db2.gz IXURNIXELYZVCY-SFHVURJKSA-N 2 0 351.332 4.364 20 0 FIADRP CCOC(=O)c1oc2c(c1C)[C@H]([NH2+]CCCCNc1ccccn1)CCC2 ZINC000447563017 1109582842 /nfs/dbraw/zinc/58/28/42/1109582842.db2.gz NLZNBGHFRCBCFT-MRXNPFEDSA-N 2 0 371.481 4.019 20 0 FIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000447566421 1109585044 /nfs/dbraw/zinc/58/50/44/1109585044.db2.gz SVTVPGKCBMMODT-JOCHJYFZSA-N 2 0 369.940 4.483 20 0 FIADRP CC(C)(C)c1cnc(CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000447933707 1109681880 /nfs/dbraw/zinc/68/18/80/1109681880.db2.gz XSOYCLNYOTXKIC-GOSISDBHSA-N 2 0 357.567 4.095 20 0 FIADRP COc1cccc([C@H](C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)OC)c1 ZINC000527732912 1109814098 /nfs/dbraw/zinc/81/40/98/1109814098.db2.gz BOGCHZXLPSRYPP-AAIMPIBUSA-N 2 0 368.521 4.025 20 0 FIADRP CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000527860805 1109841244 /nfs/dbraw/zinc/84/12/44/1109841244.db2.gz YDHXBEGPGXYEST-QHCPKHFHSA-N 2 0 366.549 4.144 20 0 FIADRP Cc1cccc([C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C(C)C)c1 ZINC000527865453 1109843529 /nfs/dbraw/zinc/84/35/29/1109843529.db2.gz GUADCPRXDBGDEM-DEOSSOPVSA-N 2 0 366.549 4.439 20 0 FIADRP Cc1cccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)C(C)C)c1 ZINC000527889061 1109850482 /nfs/dbraw/zinc/85/04/82/1109850482.db2.gz XYYBNONKNGXQDI-GOTSBHOMSA-N 2 0 352.522 4.049 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)OC)c1 ZINC000527921011 1109855965 /nfs/dbraw/zinc/85/59/65/1109855965.db2.gz PPARYOWNHPMQPH-XJABCFGWSA-N 2 0 360.542 4.015 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)OC)c1 ZINC000527917380 1109861900 /nfs/dbraw/zinc/86/19/00/1109861900.db2.gz CXLSBWYPBOSTQA-WTOYTKOKSA-N 2 0 360.542 4.015 20 0 FIADRP Cc1ccccc1C[NH+]1CCC(NCc2ccnn2C2CCCC2)CC1 ZINC000449089291 1109977811 /nfs/dbraw/zinc/97/78/11/1109977811.db2.gz JTXPJWCLGGYMSQ-UHFFFAOYSA-N 2 0 352.526 4.061 20 0 FIADRP CCc1nc(CC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)sc1C ZINC000449117673 1109979675 /nfs/dbraw/zinc/97/96/75/1109979675.db2.gz VLZVVULMEFMUBW-QGZVFWFLSA-N 2 0 371.594 4.242 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H](NCc2cc3ccccc3cc2OC)[C@@H](C)C1 ZINC000449139406 1109983765 /nfs/dbraw/zinc/98/37/65/1109983765.db2.gz KYPIRVMERINKIL-PGRDOPGGSA-N 2 0 370.537 4.075 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449214472 1109996957 /nfs/dbraw/zinc/99/69/57/1109996957.db2.gz WTOVJMALVMAZEM-JTHBVZDNSA-N 2 0 371.613 4.040 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC(NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000449219040 1109999832 /nfs/dbraw/zinc/99/98/32/1109999832.db2.gz MCTFMFSQFBUYTE-RXVVDRJESA-N 2 0 371.594 4.036 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCC(=O)N2CCCCCC2)CC1 ZINC000449224081 1110001690 /nfs/dbraw/zinc/00/16/90/1110001690.db2.gz ZPSQJVWYUPDWSP-UHFFFAOYSA-N 2 0 365.606 4.048 20 0 FIADRP Cc1csc([C@@H](C)C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)n1 ZINC000449239611 1110008942 /nfs/dbraw/zinc/00/89/42/1110008942.db2.gz WGAQVWMJMMSPBK-WMZOPIPTSA-N 2 0 357.567 4.240 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccc2n[nH]cc2c1 ZINC000449316965 1110030824 /nfs/dbraw/zinc/03/08/24/1110030824.db2.gz APKUFBXLNGLNQG-ZWKOTPCHSA-N 2 0 362.521 4.309 20 0 FIADRP CSCC1CCC([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC1 ZINC000449314071 1110031003 /nfs/dbraw/zinc/03/10/03/1110031003.db2.gz YOIRPSQEYNCTNG-UHFFFAOYSA-N 2 0 362.583 4.171 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1[C@H](C)[C@H](CC(F)(F)F)C[C@@H]1C ZINC000449366469 1110042998 /nfs/dbraw/zinc/04/29/98/1110042998.db2.gz WKOFHMXEIPRBDQ-CFVMTHIKSA-N 2 0 352.404 4.127 20 0 FIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000449528206 1110100124 /nfs/dbraw/zinc/10/01/24/1110100124.db2.gz NVHCEOXXFOHXAT-UHFFFAOYSA-N 2 0 368.447 4.101 20 0 FIADRP COc1cccc([C@H]2C[C@H]([NH2+]C3CCN(Cc4ccccc4)CC3)C2)c1 ZINC000449619491 1110127420 /nfs/dbraw/zinc/12/74/20/1110127420.db2.gz PIIRARQZAGNMDF-AQYVVDRMSA-N 2 0 350.506 4.195 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CC/C=C\c3ccccc3)CC2)CC1 ZINC000450477338 1110302805 /nfs/dbraw/zinc/30/28/05/1110302805.db2.gz WAZGPCAJJKOHDH-POHAHGRESA-N 2 0 369.597 4.218 20 0 FIADRP CCc1cc(CCC[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)on1 ZINC000450651174 1110324883 /nfs/dbraw/zinc/32/48/83/1110324883.db2.gz RVOHORRADPNTQC-UHFFFAOYSA-N 2 0 367.537 4.158 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OC)cc2Br)CC1 ZINC000538396707 1111123034 /nfs/dbraw/zinc/12/30/34/1111123034.db2.gz VJZCAQMPUMTEMD-CQSZACIVSA-N 2 0 369.347 4.230 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC2=Cc3ccccc3OC2)CC1 ZINC000538738986 1111272273 /nfs/dbraw/zinc/27/22/73/1111272273.db2.gz GPBWFOYRPVOPNI-UHFFFAOYSA-N 2 0 362.517 4.306 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]C2CC[NH+](C(C)(C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000539041601 1111395118 /nfs/dbraw/zinc/39/51/18/1111395118.db2.gz LQUNITVZDOPVOM-CTNGQTDRSA-N 3 0 357.586 4.140 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]C2CC[NH+](C(C)(C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000539041606 1111395204 /nfs/dbraw/zinc/39/52/04/1111395204.db2.gz LQUNITVZDOPVOM-TZIWHRDSSA-N 3 0 357.586 4.140 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000539056877 1111403625 /nfs/dbraw/zinc/40/36/25/1111403625.db2.gz DDVKZOODWLPXMP-TZYHBYERSA-N 2 0 374.569 4.140 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCc1cccc(F)c1)c1ccccc1O2 ZINC000539395543 1111542323 /nfs/dbraw/zinc/54/23/23/1111542323.db2.gz QQECWBSPZITUEF-NRFANRHFSA-N 2 0 368.496 4.336 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000643522274 1111542547 /nfs/dbraw/zinc/54/25/47/1111542547.db2.gz KTPOTPZSFLMIBB-WFASDCNBSA-N 2 0 367.324 4.280 20 0 FIADRP CC1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000552062515 1111562781 /nfs/dbraw/zinc/56/27/81/1111562781.db2.gz ZZXNOASOXDEVDS-BHDDXSALSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C[C@@H]4CCC5(CCCC5)O4)C3)C2)cc1 ZINC000552156931 1111595826 /nfs/dbraw/zinc/59/58/26/1111595826.db2.gz CJWDRZLQARPWLJ-FCHUYYIVSA-N 2 0 354.538 4.076 20 0 FIADRP COc1cc(OC)c([C@H](C)NCC(C)(C)C[NH+]2CCCC2)cc1Cl ZINC000477936152 1111606901 /nfs/dbraw/zinc/60/69/01/1111606901.db2.gz KVNXZCJHOVYBNJ-AWEZNQCLSA-N 2 0 354.922 4.130 20 0 FIADRP CC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552247505 1111637548 /nfs/dbraw/zinc/63/75/48/1111637548.db2.gz RXKMWARPJAPIJN-GOSISDBHSA-N 2 0 374.447 4.127 20 0 FIADRP CCC[NH+]1CCC([NH2+]C[C@H](CCCOC)c2ccc(Cl)cc2)CC1 ZINC000552322506 1111668955 /nfs/dbraw/zinc/66/89/55/1111668955.db2.gz PLPWXMHBWMTJHQ-SFHVURJKSA-N 2 0 352.950 4.314 20 0 FIADRP C[C@@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ncc(Br)cc1F ZINC000927039686 1111691909 /nfs/dbraw/zinc/69/19/09/1111691909.db2.gz VQRIYCVPAZUJBU-RFSCMCKOSA-N 2 0 370.310 4.041 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc(F)ccc1F ZINC000479055245 1111937928 /nfs/dbraw/zinc/93/79/28/1111937928.db2.gz GXTOKFXUXLOGOY-QINHECLXSA-N 2 0 354.485 4.141 20 0 FIADRP CCC(CC)(CN[C@H]1CCCc2nn(C)cc21)[NH2+][C@@H](C)c1ccccc1 ZINC000479057299 1111938311 /nfs/dbraw/zinc/93/83/11/1111938311.db2.gz HUSJKUJEQAKIGJ-PXNSSMCTSA-N 2 0 354.542 4.297 20 0 FIADRP CC1(C)CC(N[C@@H]2CCCc3nn(-c4ccccc4)cc32)CC(C)(C)[NH2+]1 ZINC000479327787 1111993486 /nfs/dbraw/zinc/99/34/86/1111993486.db2.gz RJDJWGBRMWQNKH-LJQANCHMSA-N 2 0 352.526 4.149 20 0 FIADRP CC(C)C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(Br)c1 ZINC000479406617 1112017311 /nfs/dbraw/zinc/01/73/11/1112017311.db2.gz JHHYRSXYKRAGCC-GOSISDBHSA-N 2 0 351.332 4.388 20 0 FIADRP CC(C)C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(Br)c1 ZINC000479406618 1112017609 /nfs/dbraw/zinc/01/76/09/1112017609.db2.gz JHHYRSXYKRAGCC-SFHVURJKSA-N 2 0 351.332 4.388 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000479441354 1112024542 /nfs/dbraw/zinc/02/45/42/1112024542.db2.gz BFFLLMVLAPRKMJ-ZJSXRUAMSA-N 2 0 364.533 4.128 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479460995 1112032267 /nfs/dbraw/zinc/03/22/67/1112032267.db2.gz AGNNTGHITLJLQP-GHTZIAJQSA-N 2 0 354.469 4.151 20 0 FIADRP COC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC(C)CC1 ZINC000479487205 1112041722 /nfs/dbraw/zinc/04/17/22/1112041722.db2.gz FZRSQFHFWPWOCN-KHBUQGBSSA-N 2 0 356.554 4.367 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000479553112 1112069731 /nfs/dbraw/zinc/06/97/31/1112069731.db2.gz PLCSRWOEPWTKDM-HNNXBMFYSA-N 2 0 369.347 4.202 20 0 FIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)cc2c(C)c1 ZINC000479557005 1112070917 /nfs/dbraw/zinc/07/09/17/1112070917.db2.gz RVRUIJLNKCYQFO-UHFFFAOYSA-N 2 0 365.521 4.405 20 0 FIADRP COc1cc2c(NC[C@@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2cc1F ZINC000479846210 1112167738 /nfs/dbraw/zinc/16/77/38/1112167738.db2.gz ATGFNQRPYTUIIQ-SFHVURJKSA-N 2 0 355.413 4.225 20 0 FIADRP COc1cc([C@@H](C)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c(F)cn1 ZINC000554049916 1112175597 /nfs/dbraw/zinc/17/55/97/1112175597.db2.gz YDJVFMZEKIRKSW-DLBZAZTESA-N 2 0 371.500 4.312 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCO[C@@H](C(F)(F)F)C3)cc2)C1 ZINC000554050138 1112176811 /nfs/dbraw/zinc/17/68/11/1112176811.db2.gz FYJNFFHIDYNRFX-AYOQOUSVSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H](CO)c3ccccc3Cl)CC2)C1 ZINC000554087896 1112198212 /nfs/dbraw/zinc/19/82/12/1112198212.db2.gz DSQFTVXWMQUISE-ZIFCJYIRSA-N 2 0 364.961 4.049 20 0 FIADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000554087124 1112198775 /nfs/dbraw/zinc/19/87/75/1112198775.db2.gz UJDROACQUPLQJW-FDFHNCONSA-N 2 0 358.570 4.330 20 0 FIADRP COc1cc(F)c([C@@H](C)NCCC[N@H+](C)Cc2ccccc2)cc1OC ZINC000480167652 1112305590 /nfs/dbraw/zinc/30/55/90/1112305590.db2.gz JPKJGBPYGQPLAU-MRXNPFEDSA-N 2 0 360.473 4.016 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000480160206 1112307956 /nfs/dbraw/zinc/30/79/56/1112307956.db2.gz NTSAAAFMZWLLQV-SUMWQHHRSA-N 2 0 351.332 4.461 20 0 FIADRP CCc1[nH+]c2ccccc2c(N2CCC(OCCC[NH+](C)C)CC2)c1C ZINC000554518324 1112383589 /nfs/dbraw/zinc/38/35/89/1112383589.db2.gz DWIWTKWWFCWJFE-UHFFFAOYSA-N 2 0 355.526 4.043 20 0 FIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1)N1CC[NH+](C)CC1 ZINC000480538643 1112466946 /nfs/dbraw/zinc/46/69/46/1112466946.db2.gz SBFPIQXYYQNOET-GBXCKJPGSA-N 2 0 365.565 4.276 20 0 FIADRP CO[C@H](C)[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000480538334 1112466975 /nfs/dbraw/zinc/46/69/75/1112466975.db2.gz IHXGZOWKHICHEI-RTBURBONSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480615032 1112502314 /nfs/dbraw/zinc/50/23/14/1112502314.db2.gz SWDVXKBRPRGKQP-IAGOWNOFSA-N 2 0 357.542 4.079 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000554811628 1112507686 /nfs/dbraw/zinc/50/76/86/1112507686.db2.gz MHKKEPPCVNEBHA-SFHLNBCPSA-N 2 0 356.554 4.224 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c(C)n1 ZINC000480630942 1112510136 /nfs/dbraw/zinc/51/01/36/1112510136.db2.gz LWEGIYYMBXELAB-SJORKVTESA-N 2 0 352.526 4.319 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000480630799 1112510643 /nfs/dbraw/zinc/51/06/43/1112510643.db2.gz LQSVCEMZENNSIJ-FXAWDEMLSA-N 2 0 351.966 4.043 20 0 FIADRP CC[N@H+](Cc1c(C2CC2)nc2sccn12)Cc1ccc(C[NH+](C)C)cc1 ZINC000554875366 1112541659 /nfs/dbraw/zinc/54/16/59/1112541659.db2.gz BDEDJNLIXXYJKI-UHFFFAOYSA-N 2 0 368.550 4.357 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H]2CCCc3sccc32)CC1 ZINC000480708165 1112556689 /nfs/dbraw/zinc/55/66/89/1112556689.db2.gz RXUNTYVWHGXDHE-NRFANRHFSA-N 2 0 369.578 4.053 20 0 FIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](CC(C)C)c3ccccc3)cn2)CC1 ZINC000480740901 1112580077 /nfs/dbraw/zinc/58/00/77/1112580077.db2.gz QQRBRUYYJZWNER-JOCHJYFZSA-N 2 0 366.553 4.101 20 0 FIADRP CN(Cc1ccccc1)[C@@H](C[NH2+]C1CCC2(CCOCC2)CC1)C1CC1 ZINC000480762090 1112591005 /nfs/dbraw/zinc/59/10/05/1112591005.db2.gz UIPDAJCQZCCYDN-QFIPXVFZSA-N 2 0 356.554 4.226 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cc(COC)cs2)CC1)CC1CC1 ZINC000667758050 1112631177 /nfs/dbraw/zinc/63/11/77/1112631177.db2.gz TXOHQLVSXDDGOR-UHFFFAOYSA-N 2 0 350.572 4.229 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3conc3Cc3ccccc3)CC2)CC1 ZINC000555563583 1112928275 /nfs/dbraw/zinc/92/82/75/1112928275.db2.gz MSZBPQAKUIKOKT-UHFFFAOYSA-N 2 0 367.537 4.398 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000481449392 1112947141 /nfs/dbraw/zinc/94/71/41/1112947141.db2.gz WXMUZUKTWSEGEB-KRWDZBQOSA-N 2 0 372.557 4.228 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCCOc4ccccc43)CC2)cc1 ZINC000481544247 1112976996 /nfs/dbraw/zinc/97/69/96/1112976996.db2.gz LUBJILCLGOKKHS-QFIPXVFZSA-N 2 0 350.506 4.402 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[nH+]ccc2N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000899878433 1113041744 /nfs/dbraw/zinc/04/17/44/1113041744.db2.gz QMZATQHFSRTHIB-CQSZACIVSA-N 2 0 365.399 4.198 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C(F)(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000481710374 1113050216 /nfs/dbraw/zinc/05/02/16/1113050216.db2.gz BOYCPVVQXPZSIQ-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(OC)cc3)CC2)cc1 ZINC000481714226 1113052819 /nfs/dbraw/zinc/05/28/19/1113052819.db2.gz FIQDCUVSNUZCNR-GOSISDBHSA-N 2 0 368.521 4.267 20 0 FIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCCO2 ZINC000481740256 1113063501 /nfs/dbraw/zinc/06/35/01/1113063501.db2.gz SQXHSBHIBYEWPB-NRFANRHFSA-N 2 0 368.521 4.247 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+](C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481957479 1113140895 /nfs/dbraw/zinc/14/08/95/1113140895.db2.gz LWNJHZSETFUZGW-CYBMUJFWSA-N 2 0 369.340 4.480 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCCc1c(Cl)cccc1Cl ZINC000482172175 1113192355 /nfs/dbraw/zinc/19/23/55/1113192355.db2.gz RSCZTRSEVPAJRF-CCKFTAQKSA-N 2 0 371.352 4.110 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(OC)c(OC)cc2F)c1 ZINC000482309657 1113222045 /nfs/dbraw/zinc/22/20/45/1113222045.db2.gz CBSVMUQJNAXIFU-HNNXBMFYSA-N 2 0 360.473 4.145 20 0 FIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)cc1 ZINC000482357219 1113232119 /nfs/dbraw/zinc/23/21/19/1113232119.db2.gz XMXZWLRTDYDOMW-GOSISDBHSA-N 2 0 363.615 4.111 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CCC2 ZINC000482442950 1113257828 /nfs/dbraw/zinc/25/78/28/1113257828.db2.gz ZYHSOWFROUIPPV-GBXCKJPGSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(C(C)(C)C)cs1 ZINC000482541182 1113288426 /nfs/dbraw/zinc/28/84/26/1113288426.db2.gz DZXPGHMBLOFKOT-MJGOQNOKSA-N 2 0 371.594 4.483 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000482543630 1113293502 /nfs/dbraw/zinc/29/35/02/1113293502.db2.gz NJDJYXOHYQYAIB-VGOFRKELSA-N 2 0 367.512 4.224 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000482547645 1113294522 /nfs/dbraw/zinc/29/45/22/1113294522.db2.gz CIQMIXFWUSJNED-KRWDZBQOSA-N 2 0 356.485 4.397 20 0 FIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccccc1 ZINC000482560444 1113295779 /nfs/dbraw/zinc/29/57/79/1113295779.db2.gz AHZXJLLYXVJDMP-UTKZUKDTSA-N 2 0 355.501 4.379 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000482882247 1113391524 /nfs/dbraw/zinc/39/15/24/1113391524.db2.gz AUNZAVKXLNXNRG-QAPCUYQASA-N 2 0 359.341 4.271 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(-c2cccs2)cc1 ZINC000482898712 1113395127 /nfs/dbraw/zinc/39/51/27/1113395127.db2.gz ZLAPUQWUVSUCBJ-PXNSSMCTSA-N 2 0 358.551 4.303 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000486080699 1113500788 /nfs/dbraw/zinc/50/07/88/1113500788.db2.gz LEVPPLUHSVUNRA-QRQLOZEOSA-N 2 0 372.475 4.059 20 0 FIADRP C[NH+](C)CC1CCC([NH2+][C@@H]2CCc3cccc(Br)c3C2)CC1 ZINC000559282408 1113590999 /nfs/dbraw/zinc/59/09/99/1113590999.db2.gz REWMUSQHMCGDKW-BDVYOWHSSA-N 2 0 365.359 4.016 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486708760 1113627192 /nfs/dbraw/zinc/62/71/92/1113627192.db2.gz KHDXSYZFXXNAEB-IIBYNOLFSA-N 2 0 351.469 4.307 20 0 FIADRP Clc1ccc(C2=CC[C@H]([NH2+]C3CCN([C@H]4CCOC4)CC3)CC2)cc1 ZINC000668693817 1113658717 /nfs/dbraw/zinc/65/87/17/1113658717.db2.gz WEOAMXRWAKXCAT-FPOVZHCZSA-N 2 0 360.929 4.119 20 0 FIADRP C[C@@H]1CSCC[NH+](Cc2ccccc2C[N@H+]2CCSC[C@@H](C)C2)C1 ZINC000488157975 1113864636 /nfs/dbraw/zinc/86/46/36/1113864636.db2.gz FVRNLBKSCUONJU-ROUUACIJSA-N 2 0 364.624 4.056 20 0 FIADRP C[C@H]1[C@H](NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000489912909 1114191819 /nfs/dbraw/zinc/19/18/19/1114191819.db2.gz XLDZSBFDLPZACK-WMZHIEFXSA-N 2 0 355.570 4.036 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)[C@H](C)C2 ZINC000491062916 1114368924 /nfs/dbraw/zinc/36/89/24/1114368924.db2.gz BRKYQESZRGAQBW-WZONZLPQSA-N 2 0 352.522 4.349 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(-n3cccn3)cc2)CC1 ZINC000589999439 1114872790 /nfs/dbraw/zinc/87/27/90/1114872790.db2.gz INPFIHFVPKACPY-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP CSC1(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC[NH+](C)CC1 ZINC000573023494 1115001317 /nfs/dbraw/zinc/00/13/17/1115001317.db2.gz RQJJTZQNRUTPFX-UHFFFAOYSA-N 2 0 366.880 4.276 20 0 FIADRP Cc1ccncc1CCC[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000573725763 1115178044 /nfs/dbraw/zinc/17/80/44/1115178044.db2.gz NTLFNMQDYLDYCM-RBBKRZOGSA-N 2 0 351.538 4.213 20 0 FIADRP Cn1cncc1CC[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000574013317 1115230093 /nfs/dbraw/zinc/23/00/93/1115230093.db2.gz ADYJECMHCCZUPB-IBGZPJMESA-N 2 0 370.294 4.104 20 0 FIADRP C[C@@H](C[NH2+]CC1(N2CCCC2)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000574081820 1115285190 /nfs/dbraw/zinc/28/51/90/1115285190.db2.gz NHAAQJIDXVYRNV-INIZCTEOSA-N 2 0 370.459 4.044 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cn(C)nc3-c3cccs3)CC2)CC1 ZINC000093968953 1115497875 /nfs/dbraw/zinc/49/78/75/1115497875.db2.gz SDFUJINYKYWOHQ-UHFFFAOYSA-N 2 0 372.582 4.281 20 0 FIADRP CC(C)C[C@H](CNC(=O)c1ccc([C@H](C)[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000575178044 1115546692 /nfs/dbraw/zinc/54/66/92/1115546692.db2.gz HJGCJRGEQVAAKV-NJNPRVFISA-N 2 0 367.537 4.202 20 0 FIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)CC3 ZINC000658353102 1115580781 /nfs/dbraw/zinc/58/07/81/1115580781.db2.gz BSFLWYRVNOQQPF-LJQANCHMSA-N 2 0 351.538 4.045 20 0 FIADRP [NH3+]C1(Cc2ccc(Cl)cc2)CC[NH+]([C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168415471 1115822299 /nfs/dbraw/zinc/82/22/99/1115822299.db2.gz BQOYBDAHNGKMSU-OAQYLSRUSA-N 2 0 372.915 4.372 20 0 FIADRP COc1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1F ZINC000669708165 1115843216 /nfs/dbraw/zinc/84/32/16/1115843216.db2.gz QHCCTORDSVKVKA-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000606470823 1115948249 /nfs/dbraw/zinc/94/82/49/1115948249.db2.gz YDSZUUDRBPPFQQ-FYYLOGMGSA-N 2 0 352.522 4.128 20 0 FIADRP COc1cc(OC)cc(Oc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000608061472 1116079995 /nfs/dbraw/zinc/07/99/95/1116079995.db2.gz DZYBTZVTNFSIIU-WMZOPIPTSA-N 2 0 370.493 4.068 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000608073234 1116080793 /nfs/dbraw/zinc/08/07/93/1116080793.db2.gz FEMTZWHDECLEFC-KRWDZBQOSA-N 2 0 374.475 4.333 20 0 FIADRP C[C@@H]([NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1)c1ccc([S@@](C)=O)cc1 ZINC000534452304 1116200357 /nfs/dbraw/zinc/20/03/57/1116200357.db2.gz JKUFZCPOBWGPKI-WXTAPIANSA-N 2 0 372.578 4.233 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(c2)ncn3C)CC1 ZINC000539405571 1116332187 /nfs/dbraw/zinc/33/21/87/1116332187.db2.gz CYFXCLGKMPSVNH-SFHVURJKSA-N 2 0 354.542 4.050 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Br)c2)C[C@H]1C ZINC000539821445 1116385439 /nfs/dbraw/zinc/38/54/39/1116385439.db2.gz UKZVOTMMSLJZBD-RKVPGOIHSA-N 2 0 353.348 4.357 20 0 FIADRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)[C@H](C)C1 ZINC000539835169 1116388901 /nfs/dbraw/zinc/38/89/01/1116388901.db2.gz HSUCKNYYWSUSRN-VFNWGFHPSA-N 2 0 374.960 4.305 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1N(C)C ZINC000539860470 1116392005 /nfs/dbraw/zinc/39/20/05/1116392005.db2.gz SKIXWYUKAWVEMQ-KRWDZBQOSA-N 2 0 357.567 4.377 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC000539899551 1117740840 /nfs/dbraw/zinc/74/08/40/1117740840.db2.gz FSVZNYHYQNVTKE-YZGWKJHDSA-N 2 0 356.535 4.099 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC000539899360 1117741350 /nfs/dbraw/zinc/74/13/50/1117741350.db2.gz FSVZNYHYQNVTKE-HOJAQTOUSA-N 2 0 356.535 4.099 20 0 FIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000462789433 1117773225 /nfs/dbraw/zinc/77/32/25/1117773225.db2.gz JWHMMENFGAZQSJ-QGZVFWFLSA-N 2 0 356.485 4.499 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1csc(-c2ccccc2F)n1 ZINC000462802293 1117785924 /nfs/dbraw/zinc/78/59/24/1117785924.db2.gz KRCXEQLPBVYBLZ-CQSZACIVSA-N 2 0 359.514 4.474 20 0 FIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCCO2 ZINC000540137818 1117900854 /nfs/dbraw/zinc/90/08/54/1117900854.db2.gz RZQVCYCQDQDRKJ-JOCHJYFZSA-N 2 0 365.521 4.418 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CCC2)[C@@H](C)C1 ZINC000540159631 1117903626 /nfs/dbraw/zinc/90/36/26/1117903626.db2.gz BFEDEZYJKKXGHY-UNMCSNQZSA-N 2 0 358.570 4.126 20 0 FIADRP C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000540161427 1117904546 /nfs/dbraw/zinc/90/45/46/1117904546.db2.gz UENCKHVRIRFLAG-IFXJQAMLSA-N 2 0 360.885 4.065 20 0 FIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000540165235 1117918398 /nfs/dbraw/zinc/91/83/98/1117918398.db2.gz ZYGNMLLQIWLPAG-TZYHBYERSA-N 2 0 374.569 4.284 20 0 FIADRP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000540258265 1117961785 /nfs/dbraw/zinc/96/17/85/1117961785.db2.gz FVAUDQYNXJYROR-OXQOHEQNSA-N 2 0 359.514 4.475 20 0 FIADRP C[NH+](C)CC[C@@H]([NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C(C)(C)C ZINC000463124173 1117973440 /nfs/dbraw/zinc/97/34/40/1117973440.db2.gz FXPHNGICWFJOQX-HXUWFJFHSA-N 2 0 365.993 4.260 20 0 FIADRP CCC[NH+]1CCC([N@H+](C)CCCCCn2c(C)nc3ccccc32)CC1 ZINC000463103887 1117973591 /nfs/dbraw/zinc/97/35/91/1117973591.db2.gz BGUVXYDACQORPK-UHFFFAOYSA-N 2 0 356.558 4.321 20 0 FIADRP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1 ZINC000540593964 1118138173 /nfs/dbraw/zinc/13/81/73/1118138173.db2.gz CBFUHKSHYDOUOI-RTBURBONSA-N 2 0 371.569 4.228 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000540608781 1118148723 /nfs/dbraw/zinc/14/87/23/1118148723.db2.gz TVYLEBVESWEDQI-QGZVFWFLSA-N 2 0 357.498 4.178 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@@H]1C ZINC000463744322 1118311777 /nfs/dbraw/zinc/31/17/77/1118311777.db2.gz KJHDHKQYVPUFSI-DYXWJJEUSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@H]1C ZINC000463744324 1118311997 /nfs/dbraw/zinc/31/19/97/1118311997.db2.gz KJHDHKQYVPUFSI-SFHLNBCPSA-N 2 0 374.569 4.091 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(F)c1 ZINC000540986674 1118338196 /nfs/dbraw/zinc/33/81/96/1118338196.db2.gz XNGKKOGBLHZIOR-OAQYLSRUSA-N 2 0 362.464 4.392 20 0 FIADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000540992086 1118341973 /nfs/dbraw/zinc/34/19/73/1118341973.db2.gz UVJQBSCUYXWKME-BJKOFHAPSA-N 2 0 366.549 4.447 20 0 FIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000540992650 1118342228 /nfs/dbraw/zinc/34/22/28/1118342228.db2.gz YIULYTOEUVHGRV-PXNSSMCTSA-N 2 0 370.562 4.216 20 0 FIADRP Brc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000541221683 1118433951 /nfs/dbraw/zinc/43/39/51/1118433951.db2.gz LXRFKRBYVKYFNJ-IBGZPJMESA-N 2 0 363.343 4.291 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Br)[C@H](C)C1 ZINC000541281474 1118462501 /nfs/dbraw/zinc/46/25/01/1118462501.db2.gz HUCZHWNKDOUKRQ-CRAIPNDOSA-N 2 0 353.348 4.044 20 0 FIADRP COc1ccc(Oc2ccc(C[NH+]3CCC(C[NH+](C)C)CC3)cc2)cc1 ZINC000541534457 1118552648 /nfs/dbraw/zinc/55/26/48/1118552648.db2.gz QJDCGMQHMRKIBC-UHFFFAOYSA-N 2 0 354.494 4.261 20 0 FIADRP C[C@@H]([NH2+]CCOc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541602839 1118583279 /nfs/dbraw/zinc/58/32/79/1118583279.db2.gz BKNIUIWLKDUNRG-HUUCEWRRSA-N 2 0 354.897 4.101 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(-c2ccccc2)s1 ZINC000541745664 1118629973 /nfs/dbraw/zinc/62/99/73/1118629973.db2.gz OZARVJVFUVRVBL-SFHVURJKSA-N 2 0 357.567 4.093 20 0 FIADRP Clc1cnc(OCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(Cl)c1 ZINC000541910365 1118697434 /nfs/dbraw/zinc/69/74/34/1118697434.db2.gz HDGAHIBIEPSULX-UHFFFAOYSA-N 2 0 372.340 4.154 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000541916101 1118707164 /nfs/dbraw/zinc/70/71/64/1118707164.db2.gz AKVPBNAXBWKNDX-ZEQRLZLVSA-N 2 0 366.549 4.000 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)ccc1SC(F)F ZINC000152467561 1119323081 /nfs/dbraw/zinc/32/30/81/1119323081.db2.gz LJSOIKOKYZOFKG-QWHCGFSZSA-N 2 0 356.482 4.145 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(-c2cnn(C)c2)c1 ZINC000669988634 1119329663 /nfs/dbraw/zinc/32/96/63/1119329663.db2.gz LLZHGZQGWGNCHD-BGYRXZFFSA-N 2 0 368.569 4.243 20 0 FIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000493978390 1119522831 /nfs/dbraw/zinc/52/28/31/1119522831.db2.gz SCVLUNVIKASOER-WMZHIEFXSA-N 2 0 368.521 4.027 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(N2CCCC2=O)c1 ZINC000183183954 1119568219 /nfs/dbraw/zinc/56/82/19/1119568219.db2.gz WUFXWSIDAOHZKB-CMKODMSKSA-N 2 0 369.553 4.117 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000186593089 1119738477 /nfs/dbraw/zinc/73/84/77/1119738477.db2.gz PBXOSGNHDFVXHG-QZTJIDSGSA-N 2 0 365.521 4.263 20 0 FIADRP C[NH+](C)CCOc1ccccc1C[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000186611088 1119739551 /nfs/dbraw/zinc/73/95/51/1119739551.db2.gz YAZOKCFCVFZXTQ-UHFFFAOYSA-N 2 0 358.448 4.085 20 0 FIADRP COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)c1 ZINC000542484503 1119905650 /nfs/dbraw/zinc/90/56/50/1119905650.db2.gz HIPXXFPBPOTRDC-KSFYIVLOSA-N 2 0 362.477 4.167 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cn1 ZINC000190764919 1119948419 /nfs/dbraw/zinc/94/84/19/1119948419.db2.gz RFVIGVFXFIDAMK-IBGZPJMESA-N 2 0 366.553 4.059 20 0 FIADRP CC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](C)c1cc2ccccc2o1 ZINC000191460225 1119978293 /nfs/dbraw/zinc/97/82/93/1119978293.db2.gz HHSVBVYCGTXTQO-LJQANCHMSA-N 2 0 357.542 4.232 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccnn1-c1ccccc1 ZINC000467374496 1119981174 /nfs/dbraw/zinc/98/11/74/1119981174.db2.gz XRAFDDDNGBPDSX-FPOVZHCZSA-N 2 0 360.505 4.045 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000191862546 1119999013 /nfs/dbraw/zinc/99/90/13/1119999013.db2.gz WJDXRPJSEZTMPV-HARLFGEKSA-N 2 0 368.521 4.055 20 0 FIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cnn1C(C)(C)C ZINC000195132438 1120119174 /nfs/dbraw/zinc/11/91/74/1120119174.db2.gz JRXJOOUDBYLEMS-PXNSSMCTSA-N 2 0 354.542 4.119 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCCO2 ZINC000195133142 1120120637 /nfs/dbraw/zinc/12/06/37/1120120637.db2.gz DNRGUGFLOCQUIM-DENIHFKCSA-N 2 0 366.505 4.021 20 0 FIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(Cc2cccc(Cl)c2)CC1 ZINC001168475348 1120434607 /nfs/dbraw/zinc/43/46/07/1120434607.db2.gz XRYOOQRGALLRMC-MRXNPFEDSA-N 2 0 360.904 4.446 20 0 FIADRP Cc1ccccc1[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)C1CCCC1 ZINC000495071109 1120455804 /nfs/dbraw/zinc/45/58/04/1120455804.db2.gz WTPDCTJIUQTTJI-QHCPKHFHSA-N 2 0 367.537 4.352 20 0 FIADRP Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000495077987 1120462703 /nfs/dbraw/zinc/46/27/03/1120462703.db2.gz HAXPCPGZTMLTIU-JTSKRJEESA-N 2 0 360.517 4.290 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc2c(c1)CCCO2 ZINC000153388446 1120582790 /nfs/dbraw/zinc/58/27/90/1120582790.db2.gz UDHAUHODOJHADV-NRFANRHFSA-N 2 0 368.521 4.193 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495434210 1120809829 /nfs/dbraw/zinc/80/98/29/1120809829.db2.gz QSBIOIUUFVFPHA-UEXGIBASSA-N 2 0 350.506 4.278 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000495443815 1120818016 /nfs/dbraw/zinc/81/80/16/1120818016.db2.gz FHZXCRXAFPTHML-ONTIZHBOSA-N 2 0 374.532 4.434 20 0 FIADRP c1cn(Cc2ccccc2C[NH2+]Cc2ccccc2N2CCCCC2)cn1 ZINC000915226880 1120883523 /nfs/dbraw/zinc/88/35/23/1120883523.db2.gz UQXXQDNZXONKLB-UHFFFAOYSA-N 2 0 360.505 4.212 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)c1 ZINC000762612110 1120938362 /nfs/dbraw/zinc/93/83/62/1120938362.db2.gz FRMDZLQEVBBUNM-AABGKKOBSA-N 2 0 362.608 4.142 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cc(Br)ncc1F ZINC000762736736 1120957088 /nfs/dbraw/zinc/95/70/88/1120957088.db2.gz RRFLNDBMTBEWCX-ZIAGYGMSSA-N 2 0 372.326 4.288 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2Cl)C[C@@H](C)O1 ZINC000237413077 1120977042 /nfs/dbraw/zinc/97/70/42/1120977042.db2.gz UJULBFIMMGEXOV-IAGOWNOFSA-N 2 0 358.913 4.239 20 0 FIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)c1 ZINC000237411937 1120977110 /nfs/dbraw/zinc/97/71/10/1120977110.db2.gz HCKLJQABAZGTPX-WOJBJXKFSA-N 2 0 352.522 4.202 20 0 FIADRP c1cn(-c2ccc(-c3noc([C@H]4CC[C@@H](c5ccccc5)[NH2+]C4)n3)cc2)cn1 ZINC001212207291 1120979678 /nfs/dbraw/zinc/97/96/78/1120979678.db2.gz FTTIOBNPPCVPDR-ICSRJNTNSA-N 2 0 371.444 4.131 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)ccc1F ZINC000397560600 1121218657 /nfs/dbraw/zinc/21/86/57/1121218657.db2.gz VXSOIZYDQNPVFR-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CSc2ccccc21 ZINC000398014204 1121334376 /nfs/dbraw/zinc/33/43/76/1121334376.db2.gz FKSMNHSAZSLHGV-YFVAEKQCSA-N 2 0 352.547 4.376 20 0 FIADRP Brc1cccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000166263269 1121461103 /nfs/dbraw/zinc/46/11/03/1121461103.db2.gz CQFCYXARNQDGNX-ZWKOTPCHSA-N 2 0 363.343 4.087 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000108428696 1121541605 /nfs/dbraw/zinc/54/16/05/1121541605.db2.gz BFYRDZRMRHSUSH-QGZVFWFLSA-N 2 0 371.912 4.024 20 0 FIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000542596019 1121586559 /nfs/dbraw/zinc/58/65/59/1121586559.db2.gz PSIUBPWAKMNYFW-HXUWFJFHSA-N 2 0 363.977 4.141 20 0 FIADRP C[C@@H](C[NH2+]C1CC(c2ccc(Br)cc2)C1)C[NH+]1CCCC1 ZINC000062078480 1121596105 /nfs/dbraw/zinc/59/61/05/1121596105.db2.gz CFLYYJTYMISPNV-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(Br)ccc32)c1 ZINC000123603217 1121618378 /nfs/dbraw/zinc/61/83/78/1121618378.db2.gz PSKWUAUNVQRAAS-LJQANCHMSA-N 2 0 359.311 4.288 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[C@@H]2CCC[C@@H]21 ZINC000671740215 1121642867 /nfs/dbraw/zinc/64/28/67/1121642867.db2.gz TXSPYKUIHGZFPZ-RHTUOURWSA-N 2 0 372.397 4.358 20 0 FIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Cl)s1 ZINC000124652433 1121711158 /nfs/dbraw/zinc/71/11/58/1121711158.db2.gz NBQKSCVCMDAKFM-HNNXBMFYSA-N 2 0 355.979 4.002 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c(C)n1 ZINC000126444622 1121955618 /nfs/dbraw/zinc/95/56/18/1121955618.db2.gz LTTZWBIUOPNAKJ-KRWDZBQOSA-N 2 0 352.526 4.176 20 0 FIADRP CCCC[NH+]1CCC(C[NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608796 1121970773 /nfs/dbraw/zinc/97/07/73/1121970773.db2.gz DNXJLCOXCMBZTC-IRLDBZIGSA-N 2 0 360.542 4.017 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2c(F)cccc2F)cc1 ZINC000917008333 1122000312 /nfs/dbraw/zinc/00/03/12/1122000312.db2.gz JQNNPQFWRIUWJD-KKSFZXQISA-N 2 0 374.475 4.162 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccccc1 ZINC000497318812 1122022282 /nfs/dbraw/zinc/02/22/82/1122022282.db2.gz CEPODQUPWSNGHU-IBGZPJMESA-N 2 0 365.521 4.179 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)CCO2)cc1 ZINC001168616016 1122099642 /nfs/dbraw/zinc/09/96/42/1122099642.db2.gz QEERKWQTBIGAJH-GMAHTHKFSA-N 2 0 372.553 4.160 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CCOCC2CCC2)cc1C[NH+]1CCCCC1 ZINC000765812732 1122104232 /nfs/dbraw/zinc/10/42/32/1122104232.db2.gz XSPPETBQPITHNT-GOSISDBHSA-N 2 0 360.542 4.148 20 0 FIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616171 1122107229 /nfs/dbraw/zinc/10/72/29/1122107229.db2.gz QODCVAMIOVCXGE-ZKNLVJASSA-N 2 0 360.542 4.158 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([NH2+]CC3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168618150 1122154550 /nfs/dbraw/zinc/15/45/50/1122154550.db2.gz WPRWWVFAFPZVFT-UNMCSNQZSA-N 2 0 374.569 4.263 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497518964 1122269343 /nfs/dbraw/zinc/26/93/43/1122269343.db2.gz AEJDLARQJVIUKY-NRFANRHFSA-N 2 0 357.542 4.137 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000262664765 1122412930 /nfs/dbraw/zinc/41/29/30/1122412930.db2.gz ISWTVRMLBVHAOU-HMFYCAOWSA-N 2 0 365.521 4.193 20 0 FIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cn1 ZINC000497806251 1122420625 /nfs/dbraw/zinc/42/06/25/1122420625.db2.gz AZBFZKYBWLJOHQ-HXUWFJFHSA-N 2 0 361.530 4.481 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCc3sc(Br)cc32)cc1 ZINC000556052078 1122624964 /nfs/dbraw/zinc/62/49/64/1122624964.db2.gz BPXBVYYSRJTTSS-OAHLLOKOSA-N 2 0 365.340 4.349 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000556058720 1122627954 /nfs/dbraw/zinc/62/79/54/1122627954.db2.gz NNBDCXFKGGSJKO-GOSISDBHSA-N 2 0 357.517 4.047 20 0 FIADRP CN1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)cc3)C2)C[C@@H]1c1ccccc1 ZINC000556131842 1122678298 /nfs/dbraw/zinc/67/82/98/1122678298.db2.gz XPFRXZPGHLNBNT-TUNNFDKTSA-N 2 0 369.940 4.344 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(=O)OC)cc1 ZINC000556178780 1122717840 /nfs/dbraw/zinc/71/78/40/1122717840.db2.gz ISLFBGVYDQMBFL-UGKGYDQZSA-N 2 0 366.505 4.036 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)[C@H](C)C1 ZINC000556216729 1122735025 /nfs/dbraw/zinc/73/50/25/1122735025.db2.gz JGGIOVATYXMTOU-VQIMIIECSA-N 2 0 354.485 4.025 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cc(C(F)(F)F)ccn2)CC1 ZINC000556233358 1122751607 /nfs/dbraw/zinc/75/16/07/1122751607.db2.gz NRIWHJSECBUIIC-DNVCBOLYSA-N 2 0 369.475 4.276 20 0 FIADRP Cc1ccc2nc(CNCc3ccccc3C[N@H+]3CCC[C@@H](C)C3)cn2c1 ZINC000556405408 1122867089 /nfs/dbraw/zinc/86/70/89/1122867089.db2.gz YLKXZAMQMSLKSU-GOSISDBHSA-N 2 0 362.521 4.164 20 0 FIADRP C[NH2+]C1CCC([N@H+](C)Cc2cc(Br)c(Cl)cc2F)CC1 ZINC001236214474 1123062856 /nfs/dbraw/zinc/06/28/56/1123062856.db2.gz FVJDJCCIQIAAOT-UHFFFAOYSA-N 2 0 363.702 4.204 20 0 FIADRP Cc1sc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)nc1-c1ccccc1 ZINC000556887165 1123165022 /nfs/dbraw/zinc/16/50/22/1123165022.db2.gz RXDDFFCFEUTNPK-IPMKNSEASA-N 2 0 355.551 4.123 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556889551 1123175656 /nfs/dbraw/zinc/17/56/56/1123175656.db2.gz JHGPPIBXELTJMA-HQRMLTQVSA-N 2 0 374.569 4.186 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556889554 1123176328 /nfs/dbraw/zinc/17/63/28/1123176328.db2.gz JHGPPIBXELTJMA-XKGZKEIXSA-N 2 0 374.569 4.186 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1OC ZINC000556890728 1123176532 /nfs/dbraw/zinc/17/65/32/1123176532.db2.gz VMCZYFFMKBSXIF-BZSNNMDCSA-N 2 0 360.542 4.316 20 0 FIADRP COc1cccc(C2([NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000556912146 1123204022 /nfs/dbraw/zinc/20/40/22/1123204022.db2.gz QVZYXTVQDPAKMQ-QUCCMNQESA-N 2 0 350.506 4.185 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+]CC4(c5ccccn5)CCC4)[C@@H]3C2)cc1 ZINC000556925574 1123226583 /nfs/dbraw/zinc/22/65/83/1123226583.db2.gz VGDWAZLWPUJYIH-BDTNDASRSA-N 2 0 361.533 4.004 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)c1ccc2n[nH]cc2c1 ZINC000556923529 1123232963 /nfs/dbraw/zinc/23/29/63/1123232963.db2.gz KWIJFDYDYRLPFL-DTPUHQDNSA-N 2 0 360.505 4.124 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1cccc(C)c1C ZINC000073737107 1123242315 /nfs/dbraw/zinc/24/23/15/1123242315.db2.gz LSODBHKWEGCYAB-IBGZPJMESA-N 2 0 367.537 4.262 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N(C)c1ccccc1 ZINC000499141001 1123283534 /nfs/dbraw/zinc/28/35/34/1123283534.db2.gz IYKOJDCQSDIOSP-RXOYHEDQSA-N 2 0 363.549 4.297 20 0 FIADRP CC(C)(CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCCC1 ZINC000499149338 1123292435 /nfs/dbraw/zinc/29/24/35/1123292435.db2.gz UZFXQVLLUNZXPR-DKUWSORSSA-N 2 0 355.570 4.036 20 0 FIADRP Cc1ccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499151778 1123294785 /nfs/dbraw/zinc/29/47/85/1123294785.db2.gz ZBMILAWXCJPVER-KOUNCHBCSA-N 2 0 350.506 4.159 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c2ccccc21 ZINC000132751788 1123356171 /nfs/dbraw/zinc/35/61/71/1123356171.db2.gz RYHSKKOQXRFNAY-KOSHJBKYSA-N 2 0 364.533 4.372 20 0 FIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCCC2 ZINC000132980228 1123394241 /nfs/dbraw/zinc/39/42/41/1123394241.db2.gz TWRDHVRXXZWWRN-KKSFZXQISA-N 2 0 362.945 4.198 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)C1 ZINC000920181373 1123397994 /nfs/dbraw/zinc/39/79/94/1123397994.db2.gz UDIROUXUTWJUSJ-LJQANCHMSA-N 2 0 356.485 4.226 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCOC1 ZINC000133428388 1123486164 /nfs/dbraw/zinc/48/61/64/1123486164.db2.gz STIZAVCPOXSMJG-AUSIDOKSSA-N 2 0 364.533 4.464 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCCSc1ccccc1Br ZINC000133458573 1123489125 /nfs/dbraw/zinc/48/91/25/1123489125.db2.gz VBLVQKOUDJUULH-HOCLYGCPSA-N 2 0 371.388 4.251 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)CCCC[NH+]3CCCC3)cc2)C1 ZINC000920768925 1123517632 /nfs/dbraw/zinc/51/76/32/1123517632.db2.gz MBHNAFSSQYFKGP-IBGZPJMESA-N 2 0 357.542 4.123 20 0 FIADRP CC[C@H]1CCC[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C1 ZINC000237074065 1123592925 /nfs/dbraw/zinc/59/29/25/1123592925.db2.gz HTUVPGWDTOABBD-PZJWPPBQSA-N 2 0 374.569 4.235 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000237067598 1123593377 /nfs/dbraw/zinc/59/33/77/1123593377.db2.gz FMSVCZGGMADMDW-UHFFFAOYSA-N 2 0 374.532 4.279 20 0 FIADRP Cc1cccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000237632924 1123646446 /nfs/dbraw/zinc/64/64/46/1123646446.db2.gz OUBHTIINDRLLOY-UHFFFAOYSA-N 2 0 352.522 4.156 20 0 FIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cccc4[nH]ccc43)cc2)C[C@H](C)O1 ZINC000237781249 1124074977 /nfs/dbraw/zinc/07/49/77/1124074977.db2.gz WWUDQVPUDANEND-ROUUACIJSA-N 2 0 363.505 4.067 20 0 FIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000245601465 1124134090 /nfs/dbraw/zinc/13/40/90/1124134090.db2.gz MMROEJMQVDPKEK-SJLPKXTDSA-N 2 0 374.916 4.054 20 0 FIADRP OCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCCCC1 ZINC000245637115 1124155164 /nfs/dbraw/zinc/15/51/64/1124155164.db2.gz ABHHSDSSSPMOLG-BXXSPATCSA-N 2 0 356.554 4.103 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)C1CCC(C(F)(F)F)CC1 ZINC000474473562 1124172193 /nfs/dbraw/zinc/17/21/93/1124172193.db2.gz QKLKYGUBGRXEGU-FAEJEUNOSA-N 2 0 372.475 4.474 20 0 FIADRP c1cn(-c2ccccc2C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000245660194 1124176384 /nfs/dbraw/zinc/17/63/84/1124176384.db2.gz FNGHYUBVYGYYLZ-WBDAEOGXSA-N 2 0 372.516 4.158 20 0 FIADRP COCc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245701917 1124209837 /nfs/dbraw/zinc/20/98/37/1124209837.db2.gz LUSKAFARPHUPBC-WBDAEOGXSA-N 2 0 350.506 4.118 20 0 FIADRP CO[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000245701837 1124210225 /nfs/dbraw/zinc/21/02/25/1124210225.db2.gz LTTQEEFKZGSJQS-BJESRGMDSA-N 2 0 368.496 4.298 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245787516 1124249485 /nfs/dbraw/zinc/24/94/85/1124249485.db2.gz ZTFCWXHYBCZSPS-XXTHSBEZSA-N 3 0 357.586 4.282 20 0 FIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000542846876 1124447372 /nfs/dbraw/zinc/44/73/72/1124447372.db2.gz OBFFACOVUNWAMK-YADARESESA-N 2 0 366.549 4.303 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[NH+]1CCCCCC1 ZINC000303718024 1124460178 /nfs/dbraw/zinc/46/01/78/1124460178.db2.gz RCGSDDWOSPZGRU-IBGZPJMESA-N 2 0 357.542 4.122 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC(C)(C)Cc1ccccc1 ZINC000246516941 1124520399 /nfs/dbraw/zinc/52/03/99/1124520399.db2.gz UKFRRUZGNZTQOW-DENIHFKCSA-N 2 0 351.538 4.151 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCCCCc1ccccc1 ZINC000247100986 1124589845 /nfs/dbraw/zinc/58/98/45/1124589845.db2.gz SGQSGWPLVGDHCV-NFBKMPQASA-N 2 0 351.538 4.295 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cnn(C2CCC2)c1 ZINC000921775749 1124594617 /nfs/dbraw/zinc/59/46/17/1124594617.db2.gz YUQROXKXUZGKLC-UHFFFAOYSA-N 2 0 364.493 4.123 20 0 FIADRP Cc1cccc([C@H]2CCCN2CCC[N@H+]2CCC[C@@H]2c2cccc(C)n2)n1 ZINC000140296264 1124595341 /nfs/dbraw/zinc/59/53/41/1124595341.db2.gz SUAYZNDOVMSQPE-DHIUTWEWSA-N 2 0 364.537 4.458 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCSc2ccc(Cl)cc21 ZINC000247957051 1124733765 /nfs/dbraw/zinc/73/37/65/1124733765.db2.gz FRBRNFXSXMRKSB-FUHWJXTLSA-N 2 0 368.974 4.094 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000248433984 1124768605 /nfs/dbraw/zinc/76/86/05/1124768605.db2.gz DOBCUQBQPQNCNM-JZWVFAODSA-N 2 0 364.533 4.290 20 0 FIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168678338 1124769284 /nfs/dbraw/zinc/76/92/84/1124769284.db2.gz VOIGMRFGKOYVKD-IFMALSPDSA-N 2 0 360.542 4.112 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCCc2ccccc21 ZINC000248449838 1124770372 /nfs/dbraw/zinc/77/03/72/1124770372.db2.gz OQWAVMKLSZQMEQ-LADGPHEKSA-N 2 0 364.533 4.201 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(F)c1 ZINC000248456015 1124773013 /nfs/dbraw/zinc/77/30/13/1124773013.db2.gz RVSIXBIHWINTOM-KNQAVFIVSA-N 2 0 374.475 4.018 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1csc(Cl)c1 ZINC000248676009 1124801055 /nfs/dbraw/zinc/80/10/55/1124801055.db2.gz AEWWCYJONUAALL-KDOFPFPSSA-N 2 0 364.942 4.209 20 0 FIADRP CC(C)Oc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000062426556 1124809021 /nfs/dbraw/zinc/80/90/21/1124809021.db2.gz FSLOUNLZMSFGJW-JOCHJYFZSA-N 2 0 352.522 4.476 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)CC1 ZINC000521917911 1124828115 /nfs/dbraw/zinc/82/81/15/1124828115.db2.gz LKBQGEKZKMENIQ-UGAUIIJPSA-N 2 0 369.597 4.455 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4occc43)cc2)C[C@H](C)O1 ZINC000249044961 1124838713 /nfs/dbraw/zinc/83/87/13/1124838713.db2.gz VSHGXZQVUSGJPW-FVJLSDCUSA-N 2 0 354.494 4.056 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cc2ccccc2s1 ZINC000249192996 1124849677 /nfs/dbraw/zinc/84/96/77/1124849677.db2.gz PBGLPAFLCDRNNL-ZYSHUDEJSA-N 2 0 358.551 4.320 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc2ccccc2s1 ZINC000249210564 1124851084 /nfs/dbraw/zinc/85/10/84/1124851084.db2.gz XUCAOQDJHDBBGP-OXQOHEQNSA-N 2 0 366.530 4.319 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000249452143 1124858381 /nfs/dbraw/zinc/85/83/81/1124858381.db2.gz COAPLIBVVAIELN-LRDDRELGSA-N 2 0 357.361 4.283 20 0 FIADRP Clc1cc2c(c(Br)c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000089695973 1124928177 /nfs/dbraw/zinc/92/81/77/1124928177.db2.gz MRZYOKLTNGDNGM-APPDUMDISA-N 2 0 369.734 4.164 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc(-c3ccccc3)nc2)CC1 ZINC000542942579 1124934954 /nfs/dbraw/zinc/93/49/54/1124934954.db2.gz TTXDQHJEQPUILR-UHFFFAOYSA-N 2 0 366.553 4.478 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2cc(C)ccc2C)CC1 ZINC000542947852 1124947245 /nfs/dbraw/zinc/94/72/45/1124947245.db2.gz JNIXWMXOOHOOAF-UHFFFAOYSA-N 2 0 359.558 4.076 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000090525573 1125001314 /nfs/dbraw/zinc/00/13/14/1125001314.db2.gz HHWHUUWGPOANML-KYNGSXCRSA-N 2 0 370.459 4.124 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000090525734 1125001848 /nfs/dbraw/zinc/00/18/48/1125001848.db2.gz XHRBLSPFXMVTCQ-ZRBLBEILSA-N 2 0 358.570 4.001 20 0 FIADRP C[C@@H]([NH2+]C1(c2ccc(Br)cc2)CCC1)C1CC[NH+](C)CC1 ZINC000679015117 1125003470 /nfs/dbraw/zinc/00/34/70/1125003470.db2.gz DMDSRSTXGUUOFG-CQSZACIVSA-N 2 0 351.332 4.148 20 0 FIADRP CC(C)[NH+](C/C=C/C[N@H+](Cc1ccccn1)C(C)C)Cc1ccccn1 ZINC000064629190 1125037674 /nfs/dbraw/zinc/03/76/74/1125037674.db2.gz VSVQKLWYVHEUTJ-MDZDMXLPSA-N 2 0 352.526 4.154 20 0 FIADRP Fc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000091343527 1125066830 /nfs/dbraw/zinc/06/68/30/1125066830.db2.gz GPQFBWPNINIGDL-JTSKRJEESA-N 2 0 360.517 4.148 20 0 FIADRP Fc1ccc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000091343526 1125067147 /nfs/dbraw/zinc/06/71/47/1125067147.db2.gz GPQFBWPNINIGDL-HTAPYJJXSA-N 2 0 360.517 4.148 20 0 FIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000182376696 1125440099 /nfs/dbraw/zinc/44/00/99/1125440099.db2.gz QSEHEKCIXZMVOZ-SCLBCKFNSA-N 2 0 352.494 4.453 20 0 FIADRP CCc1cnccc1[C@H](C)[NH2+]CC(C)C[NH2+][C@@H](C)c1ccncc1CC ZINC000543051360 1125565923 /nfs/dbraw/zinc/56/59/23/1125565923.db2.gz AKHQHVRSRVRASY-ROUUACIJSA-N 2 0 354.542 4.239 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CCc2nccs2)cc1C[NH+]1CCCCC1 ZINC000182694688 1125601329 /nfs/dbraw/zinc/60/13/29/1125601329.db2.gz JZTKIAMLJOJWLC-INIZCTEOSA-N 2 0 359.539 4.031 20 0 FIADRP Fc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000152765614 1125648573 /nfs/dbraw/zinc/64/85/73/1125648573.db2.gz QNWKHKQDYZTTGD-GOSISDBHSA-N 2 0 359.533 4.039 20 0 FIADRP CC[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1cccc(Br)c1 ZINC000152811770 1125659275 /nfs/dbraw/zinc/65/92/75/1125659275.db2.gz NCKNSJGBHANCAH-KRWDZBQOSA-N 2 0 362.315 4.265 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC001648785950 1079583421 /nfs/dbraw/zinc/58/34/21/1079583421.db2.gz NCEKPRJJHFRPGE-QZTJIDSGSA-N 2 0 356.485 4.033 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)s1 ZINC000643548327 1079680390 /nfs/dbraw/zinc/68/03/90/1079680390.db2.gz NWNINSVZBIBDBG-IUODEOHRSA-N 2 0 355.345 4.226 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274808426 1080162031 /nfs/dbraw/zinc/16/20/31/1080162031.db2.gz XGECVZSNQFFGFO-LSUHJGNXSA-N 2 0 364.533 4.407 20 0 FIADRP COc1cccc([C@H]([NH2+]CC2CC[NH+](C)CC2)c2ccccc2Cl)c1 ZINC000180459976 1080501791 /nfs/dbraw/zinc/50/17/91/1080501791.db2.gz JGZUOSASKKYYIM-NRFANRHFSA-N 2 0 358.913 4.369 20 0 FIADRP COc1cc(F)cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC001648792773 1080625373 /nfs/dbraw/zinc/62/53/73/1080625373.db2.gz UXKGYYZTMNJVNH-KRWDZBQOSA-N 2 0 356.485 4.356 20 0 FIADRP COc1ccc2nc(N3Cc4ccccc4C4(CC[NH2+]CC4)C3)cc(C)c2c1 ZINC001167159572 1080766277 /nfs/dbraw/zinc/76/62/77/1080766277.db2.gz DDWBSSKPSKUHER-UHFFFAOYSA-N 2 0 373.500 4.193 20 0 FIADRP c1ccc([C@H]2C[C@@H]2C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000236654499 1080884808 /nfs/dbraw/zinc/88/48/08/1080884808.db2.gz DGGPFUWEAJDUKC-FYYLOGMGSA-N 2 0 350.506 4.055 20 0 FIADRP C[C@@H](C[NH2+]C1CCN(C[C@H]2CCCO2)CC1)c1c(Cl)cccc1Cl ZINC000655705177 1081125107 /nfs/dbraw/zinc/12/51/07/1081125107.db2.gz YIKWJUZFMPQBLT-GOEBONIOSA-N 2 0 371.352 4.330 20 0 FIADRP Cc1nn(-c2ccc(C)cc2)cc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000655704767 1081126365 /nfs/dbraw/zinc/12/63/65/1081126365.db2.gz KHMJLZQJJOKTQK-UHFFFAOYSA-N 2 0 374.532 4.375 20 0 FIADRP Cc1nn(-c2ccc(C)cc2)cc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000655709050 1081128062 /nfs/dbraw/zinc/12/80/62/1081128062.db2.gz XKOQPUKVWNYQFX-UHFFFAOYSA-N 2 0 374.532 4.375 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(-c3ccc(C)cc3)nc2C)c1 ZINC000655730282 1081145464 /nfs/dbraw/zinc/14/54/64/1081145464.db2.gz RCZVBSYMIUMIBU-UHFFFAOYSA-N 2 0 362.521 4.231 20 0 FIADRP Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CC2 ZINC000655751689 1081169163 /nfs/dbraw/zinc/16/91/63/1081169163.db2.gz QESOJOWMLPHGGX-DHIUTWEWSA-N 2 0 364.533 4.037 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H](C2CC2)[C@@H]2CCCCO2)C3)cc1 ZINC000655788836 1081201419 /nfs/dbraw/zinc/20/14/19/1081201419.db2.gz PYZDMZDNWMKKNY-MFKCLSPESA-N 2 0 354.538 4.119 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000655805586 1081210782 /nfs/dbraw/zinc/21/07/82/1081210782.db2.gz JEVOAWOBGIUQNO-BLIXFSHQSA-N 2 0 356.485 4.396 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000655806448 1081214742 /nfs/dbraw/zinc/21/47/42/1081214742.db2.gz WEBLYRYIRQFMNA-XOKHGSTOSA-N 2 0 359.514 4.256 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCC3(CCCC3)O2)CC1 ZINC000655851245 1081259858 /nfs/dbraw/zinc/25/98/58/1081259858.db2.gz CPDTVCHVGUKXQV-SIKLNZKXSA-N 2 0 356.554 4.163 20 0 FIADRP CC(C)c1ccc([C@@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397580730 1081262393 /nfs/dbraw/zinc/26/23/93/1081262393.db2.gz FCEDYGGNPNUSBJ-HXUWFJFHSA-N 2 0 366.549 4.488 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(Cl)cc3c2OCC3)c1 ZINC001648827009 1081263401 /nfs/dbraw/zinc/26/34/01/1081263401.db2.gz ZVKQISLYODXOTM-UHFFFAOYSA-N 2 0 358.913 4.407 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CCC4(CCCC4)O2)C3)cc1 ZINC000655853730 1081265995 /nfs/dbraw/zinc/26/59/95/1081265995.db2.gz YBNKJZLNIKMXEM-YUMYIRISSA-N 2 0 354.538 4.263 20 0 FIADRP CCSc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccn1 ZINC000547979460 1081316886 /nfs/dbraw/zinc/31/68/86/1081316886.db2.gz QYUKPSSLLQGEJC-PXNSSMCTSA-N 2 0 355.551 4.194 20 0 FIADRP CC(C)Cc1ccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397623153 1081328095 /nfs/dbraw/zinc/32/80/95/1081328095.db2.gz WYEZPKMUZVJEEW-UHFFFAOYSA-N 2 0 366.549 4.002 20 0 FIADRP C[C@@H](C[NH2+]CC(C)(C)c1ccc(Br)cc1)N1CCCCC1 ZINC001648889267 1081344523 /nfs/dbraw/zinc/34/45/23/1081344523.db2.gz OJGBPAOYQGHPOS-HNNXBMFYSA-N 2 0 353.348 4.191 20 0 FIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@H](C)Cc2ccccc2F)CC1 ZINC001648898390 1081355020 /nfs/dbraw/zinc/35/50/20/1081355020.db2.gz MVCNHOMQZPYUPP-LJQANCHMSA-N 2 0 369.528 4.079 20 0 FIADRP c1cc(C[N@@H+](CCc2noc3ccccc32)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000655938836 1081365016 /nfs/dbraw/zinc/36/50/16/1081365016.db2.gz FHJTYZVCYADOCJ-HXUWFJFHSA-N 2 0 367.518 4.076 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]Cc3ccc(Cn4ccnc4)cc3)C2)c1 ZINC000580005124 1081384252 /nfs/dbraw/zinc/38/42/52/1081384252.db2.gz VOGVOLWDEAYYFJ-UHFFFAOYSA-N 2 0 353.416 4.245 20 0 FIADRP COc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)CC3 ZINC000123347499 1081473576 /nfs/dbraw/zinc/47/35/76/1081473576.db2.gz FGWRWBWUJMDOPI-KRWDZBQOSA-N 2 0 367.537 4.030 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](N[C@H]2CC[NH+](C)[C@H](c3ccccc3)C2)C1 ZINC000580101776 1081594170 /nfs/dbraw/zinc/59/41/70/1081594170.db2.gz IOHVVGLHWMYKDE-DLTYFMDKSA-N 2 0 363.549 4.247 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CCC(F)(F)CC1 ZINC000656201597 1081910840 /nfs/dbraw/zinc/91/08/40/1081910840.db2.gz SDYIYIOIEGDKAO-YJLNNSPDSA-N 2 0 350.453 4.046 20 0 FIADRP Cc1cc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)ccc1Oc1cccnc1 ZINC000580483651 1081970671 /nfs/dbraw/zinc/97/06/71/1081970671.db2.gz OPBCYJSMHOUWQX-CTNGQTDRSA-N 2 0 351.494 4.098 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(CO)c1 ZINC000580501589 1081985417 /nfs/dbraw/zinc/98/54/17/1081985417.db2.gz LYLXFPRDHJTMJB-KNQAVFIVSA-N 2 0 352.522 4.132 20 0 FIADRP COc1ccsc1[C@H](C)[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000471613956 1082098950 /nfs/dbraw/zinc/09/89/50/1082098950.db2.gz SRKXUHDMKNVTQW-SFHVURJKSA-N 2 0 373.566 4.010 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(OC)ccc1Br ZINC000087787279 1082125950 /nfs/dbraw/zinc/12/59/50/1082125950.db2.gz NUJMEIWBEUKTJW-AWEZNQCLSA-N 2 0 357.336 4.058 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(OC)ccc1Br ZINC000087787277 1082126182 /nfs/dbraw/zinc/12/61/82/1082126182.db2.gz NUJMEIWBEUKTJW-CQSZACIVSA-N 2 0 357.336 4.058 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000127562545 1082225921 /nfs/dbraw/zinc/22/59/21/1082225921.db2.gz LJNILNBFIGFADB-QUCCMNQESA-N 2 0 360.542 4.160 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000128079306 1082295658 /nfs/dbraw/zinc/29/56/58/1082295658.db2.gz MUMSLNUMWDOWPN-IEIRFRATSA-N 2 0 369.597 4.107 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000581103912 1082317591 /nfs/dbraw/zinc/31/75/91/1082317591.db2.gz ZGOKMWPWQKTYJA-ZUUPMSEOSA-N 2 0 350.453 4.107 20 0 FIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000430549275 1082436409 /nfs/dbraw/zinc/43/64/09/1082436409.db2.gz IHWAUFRWJKKWCA-QUCCMNQESA-N 2 0 360.505 4.099 20 0 FIADRP C[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+]1CCCCCC1 ZINC000510389888 1082477556 /nfs/dbraw/zinc/47/75/56/1082477556.db2.gz UHKABTCRXCCKQB-RBUKOAKNSA-N 2 0 357.542 4.264 20 0 FIADRP Clc1ccc2c(CC[NH2+]C3CCN(c4cc[nH+]cc4)CC3)c[nH]c2c1 ZINC000656493786 1082483700 /nfs/dbraw/zinc/48/37/00/1082483700.db2.gz STKZDIGRUGQLNN-UHFFFAOYSA-N 2 0 354.885 4.017 20 0 FIADRP CSC1(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)CC[NH+](C)CC1 ZINC000581518053 1082633493 /nfs/dbraw/zinc/63/34/93/1082633493.db2.gz JPAXWIYEIPDGKU-UHFFFAOYSA-N 2 0 362.514 4.311 20 0 FIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc([C@H](C)[NH3+])cc1)c1ccccc1Cl ZINC000581544906 1082653585 /nfs/dbraw/zinc/65/35/85/1082653585.db2.gz KGQGYDMSHKJKPM-YWZLYKJASA-N 2 0 373.928 4.173 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cncc(Br)c2)c1 ZINC000581618454 1082714982 /nfs/dbraw/zinc/71/49/82/1082714982.db2.gz CMMHIAKPLABCDP-CQSZACIVSA-N 2 0 362.315 4.147 20 0 FIADRP CO[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000684378135 1082793796 /nfs/dbraw/zinc/79/37/96/1082793796.db2.gz ZBNCPVHJRHBYKW-RTBURBONSA-N 2 0 350.934 4.099 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cccc(F)c1 ZINC000090971342 1083097503 /nfs/dbraw/zinc/09/75/03/1083097503.db2.gz LXKVULDITHTVQJ-SFHVURJKSA-N 2 0 367.512 4.209 20 0 FIADRP C[NH+](C)CCC1CC[NH+](Cc2sccc2NC(=O)OC(C)(C)C)CC1 ZINC000891776224 1083145260 /nfs/dbraw/zinc/14/52/60/1083145260.db2.gz XXTKSNKIWINFKQ-UHFFFAOYSA-N 2 0 367.559 4.259 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000430758104 1083146564 /nfs/dbraw/zinc/14/65/64/1083146564.db2.gz YZBXQAQJWXFOCM-WNLTYMPLSA-N 2 0 369.322 4.153 20 0 FIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000510683517 1083237367 /nfs/dbraw/zinc/23/73/67/1083237367.db2.gz GPHOIBASIVVDAW-HNNXBMFYSA-N 2 0 354.460 4.491 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC000510748415 1083292358 /nfs/dbraw/zinc/29/23/58/1083292358.db2.gz IEUDDIOAANQOLM-LJQANCHMSA-N 2 0 363.343 4.433 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1)C(C)C ZINC000510774429 1083306666 /nfs/dbraw/zinc/30/66/66/1083306666.db2.gz RUVANHVQOQABJU-HXUWFJFHSA-N 2 0 373.566 4.011 20 0 FIADRP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000658264541 1083378487 /nfs/dbraw/zinc/37/84/87/1083378487.db2.gz GWSLNTMNNKYINC-DMKPSLHHSA-N 2 0 352.469 4.246 20 0 FIADRP Cn1ncc(C2CCC2)c1C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000658269992 1083389716 /nfs/dbraw/zinc/38/97/16/1083389716.db2.gz ZNUZYTDDBHGDDW-UHFFFAOYSA-N 2 0 366.553 4.220 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCc4cccnc43)C3(CCC3)C2)cc1 ZINC000658318716 1083406820 /nfs/dbraw/zinc/40/68/20/1083406820.db2.gz SJLVZDQOFSVSEW-FCHUYYIVSA-N 2 0 361.533 4.351 20 0 FIADRP C[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483455 1083468434 /nfs/dbraw/zinc/46/84/34/1083468434.db2.gz NWTPQWMMTMQUPL-HKUYNNGSSA-N 2 0 371.594 4.483 20 0 FIADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000537935121 1083647497 /nfs/dbraw/zinc/64/74/97/1083647497.db2.gz VKLWGKBMZOVSOV-JOCHJYFZSA-N 2 0 355.501 4.294 20 0 FIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000535777581 1083652315 /nfs/dbraw/zinc/65/23/15/1083652315.db2.gz MWYHGGHRHLGTAW-WTIAFYNJSA-N 2 0 363.549 4.122 20 0 FIADRP C[NH+](C)CCN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)C1CCCCC1 ZINC000511351305 1083790332 /nfs/dbraw/zinc/79/03/32/1083790332.db2.gz BLIIKDMCFYSVRB-UHFFFAOYSA-N 2 0 371.569 4.009 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+][C@@H]3CCc4nc(C(C)(C)C)cn4C3)cc2c1C ZINC000472035388 1084125468 /nfs/dbraw/zinc/12/54/68/1084125468.db2.gz QBRPXMSICBADJA-MRXNPFEDSA-N 2 0 350.510 4.383 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3c(C4CCC4)cnn3C)cc2)C1 ZINC000657309186 1084379376 /nfs/dbraw/zinc/37/93/76/1084379376.db2.gz BMHKSLZJJHZGRN-GOSISDBHSA-N 2 0 366.553 4.209 20 0 FIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000537972719 1084437586 /nfs/dbraw/zinc/43/75/86/1084437586.db2.gz ZGGIXZSMAIWYDK-DYVFJYSZSA-N 2 0 351.332 4.460 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1csc(-c2ccccc2)n1 ZINC000414106883 1084579480 /nfs/dbraw/zinc/57/94/80/1084579480.db2.gz YARHSHDONTXDKO-FGTMMUONSA-N 2 0 373.566 4.350 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000072085636 1084655295 /nfs/dbraw/zinc/65/52/95/1084655295.db2.gz BCVFGDZCVQNRNK-OALUTQOASA-N 2 0 352.522 4.161 20 0 FIADRP Cc1nn(Cc2ccc(C)cc2)c(C)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511503383 1084689695 /nfs/dbraw/zinc/68/96/95/1084689695.db2.gz FWDRHBFWYYMNMA-UHFFFAOYSA-N 2 0 368.569 4.020 20 0 FIADRP CSC1(C[NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH+](C)CC1 ZINC000414142616 1084691512 /nfs/dbraw/zinc/69/15/12/1084691512.db2.gz IYWOJIBOPKBECP-FUHWJXTLSA-N 2 0 352.975 4.393 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1 ZINC000414163325 1084721892 /nfs/dbraw/zinc/72/18/92/1084721892.db2.gz FZPQGHPEPXXKIK-INIZCTEOSA-N 2 0 365.481 4.059 20 0 FIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414181095 1084751195 /nfs/dbraw/zinc/75/11/95/1084751195.db2.gz MMPTYFPHZBNBLK-APWZRJJASA-N 2 0 357.567 4.425 20 0 FIADRP CCOc1ccc([C@@H](CC)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1OCC ZINC000414189212 1084776778 /nfs/dbraw/zinc/77/67/78/1084776778.db2.gz RDUHAEIMAPGKGF-LJQANCHMSA-N 2 0 353.466 4.373 20 0 FIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(F)c(OC(F)(F)F)c2)CC1 ZINC001143442771 1084782339 /nfs/dbraw/zinc/78/23/39/1084782339.db2.gz LBVRRQVUZPDSCP-UHFFFAOYSA-N 2 0 362.411 4.277 20 0 FIADRP C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(Cl)cc1 ZINC000657377425 1084808857 /nfs/dbraw/zinc/80/88/57/1084808857.db2.gz TWPKMHGRWIWOQP-VOBQZIQPSA-N 2 0 352.869 4.408 20 0 FIADRP C(CC[N@@H+]1CCC[C@@]2(CCSC2)C1)C[NH+]1CCC[C@]2(CCSC2)C1 ZINC000582282487 1084828935 /nfs/dbraw/zinc/82/89/35/1084828935.db2.gz BBHBONBWBBXEHV-BGYRXZFFSA-N 2 0 368.656 4.205 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2c(C3CCC3)cnn2C)C[N@@H+]1Cc1ccccc1 ZINC000657415905 1084952760 /nfs/dbraw/zinc/95/27/60/1084952760.db2.gz OVQYVYXLJVCZOL-ICSRJNTNSA-N 2 0 366.553 4.078 20 0 FIADRP CC(C)[N@@H+]1CCCC[C@@H]1CN(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167573363 1084992857 /nfs/dbraw/zinc/99/28/57/1084992857.db2.gz VKNLBHHDVKEEFE-YMPZKCBVSA-N 2 0 357.586 4.234 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)CC1 ZINC000472584093 1085049070 /nfs/dbraw/zinc/04/90/70/1085049070.db2.gz GOVNTAOTMZVGSZ-XWDDPXMASA-N 2 0 369.597 4.361 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(C)CC[NH+](C)C2CCCCC2)cc1)C(C)C ZINC000511855271 1085151497 /nfs/dbraw/zinc/15/14/97/1085151497.db2.gz WNRHGJROBDJRLU-UHFFFAOYSA-N 2 0 373.585 4.253 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCCc5cccnc54)[C@@H]3C2)cc1 ZINC000684960963 1085324709 /nfs/dbraw/zinc/32/47/09/1085324709.db2.gz DOCPKJVLMMAVQK-BJESRGMDSA-N 2 0 361.533 4.349 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCCc5cccnc54)[C@H]3C2)cc1 ZINC000684960972 1085325165 /nfs/dbraw/zinc/32/51/65/1085325165.db2.gz DOCPKJVLMMAVQK-MLCQCVOFSA-N 2 0 361.533 4.349 20 0 FIADRP c1c2cnccc2oc1C[NH2+][C@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000651759931 1085457051 /nfs/dbraw/zinc/45/70/51/1085457051.db2.gz IHKGIHTWIQZYEE-BWAGFHJFSA-N 2 0 361.489 4.218 20 0 FIADRP Fc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)o2)cc1 ZINC000657536713 1085460317 /nfs/dbraw/zinc/46/03/17/1085460317.db2.gz OPFXXIFXUVZLBG-UHFFFAOYSA-N 2 0 372.484 4.066 20 0 FIADRP COc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000652152190 1085719877 /nfs/dbraw/zinc/71/98/77/1085719877.db2.gz GQXSIMCMQJDEFK-QHCPKHFHSA-N 2 0 367.537 4.425 20 0 FIADRP Oc1cc(F)cc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000473132637 1085732202 /nfs/dbraw/zinc/73/22/02/1085732202.db2.gz MWYZUTWOQSDOKC-UHFFFAOYSA-N 2 0 354.469 4.019 20 0 FIADRP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1 ZINC000583048078 1086090107 /nfs/dbraw/zinc/09/01/07/1086090107.db2.gz KZFLEYQOFHHZBQ-YADHBBJMSA-N 2 0 367.537 4.146 20 0 FIADRP CCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1 ZINC000248445610 1086169053 /nfs/dbraw/zinc/16/90/53/1086169053.db2.gz MPUBUMZAWUXVLA-GOTSBHOMSA-N 2 0 352.522 4.274 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H](CO)c2ccccc2Cl)CC1 ZINC000583162207 1086326639 /nfs/dbraw/zinc/32/66/39/1086326639.db2.gz OWIQEXDZYHAJPZ-WWMYMODYSA-N 2 0 364.961 4.049 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H](CO)c2ccccc2Cl)CC1 ZINC000583162206 1086326958 /nfs/dbraw/zinc/32/69/58/1086326958.db2.gz OWIQEXDZYHAJPZ-LZJOCLMNSA-N 2 0 364.961 4.049 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2OC(F)F)[C@H](C)C1 ZINC000583174400 1086351093 /nfs/dbraw/zinc/35/10/93/1086351093.db2.gz AWZXJHNAOQRLAK-DEYMUQAISA-N 2 0 352.469 4.353 20 0 FIADRP Cc1cccc(C[N@H+](Cc2ccccn2)Cc2cccc3c2CC[NH2+]C3)c1 ZINC000662261779 1086380592 /nfs/dbraw/zinc/38/05/92/1086380592.db2.gz NUZQXDIJCGUEDR-UHFFFAOYSA-N 2 0 357.501 4.238 20 0 FIADRP c1cnn(C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c2ccccc2)c1 ZINC000663301048 1086386407 /nfs/dbraw/zinc/38/64/07/1086386407.db2.gz FNUHOGUNFDNYLM-DEOSSOPVSA-N 2 0 374.532 4.400 20 0 FIADRP Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)cs1 ZINC000662293836 1086398592 /nfs/dbraw/zinc/39/85/92/1086398592.db2.gz OLPNKEVRBQBSRE-MRXNPFEDSA-N 2 0 359.514 4.161 20 0 FIADRP CCOC(=O)C1CCC([NH2+][C@H]2CCCCCN(Cc3ccccc3)C2)CC1 ZINC000709645375 1086462712 /nfs/dbraw/zinc/46/27/12/1086462712.db2.gz KUGFNLYWMSWYMV-HRTMPFAESA-N 2 0 372.553 4.143 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000583351628 1086597190 /nfs/dbraw/zinc/59/71/90/1086597190.db2.gz IMMLAELMYVKZRS-QHCPKHFHSA-N 2 0 352.522 4.301 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467748302 1086604980 /nfs/dbraw/zinc/60/49/80/1086604980.db2.gz XVRWNNPQISIRJQ-LBPRGKRZSA-N 2 0 370.444 4.124 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000150979672 1086663049 /nfs/dbraw/zinc/66/30/49/1086663049.db2.gz KXNVVISUWFNVBR-OAHLLOKOSA-N 2 0 373.522 4.003 20 0 FIADRP Cc1noc(C)c1[C@@H](C)[NH2+]CC[C@H](C)CC[NH2+][C@@H](C)c1c(C)noc1C ZINC000663597656 1086695414 /nfs/dbraw/zinc/69/54/14/1086695414.db2.gz FXWSODXPEBRGGR-BTTYYORXSA-N 2 0 362.518 4.314 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@H](C5CC5)C4)[C@H]3C2)cc1 ZINC000583456811 1086700886 /nfs/dbraw/zinc/70/08/86/1086700886.db2.gz ZWMQYRXFGQDGHF-HTUFRPJOSA-N 2 0 368.565 4.224 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001167835589 1086705545 /nfs/dbraw/zinc/70/55/45/1086705545.db2.gz RRRKYDVKVODTSI-QTJGBDASSA-N 3 0 371.613 4.341 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(NC(=O)Nc2cccc(C)c2)CC1 ZINC001167836167 1086706768 /nfs/dbraw/zinc/70/67/68/1086706768.db2.gz WSHPBMZSXISCKO-IBGZPJMESA-N 2 0 374.573 4.091 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N2CCc3ccccc3C2)CC1 ZINC001167836740 1086708764 /nfs/dbraw/zinc/70/87/64/1086708764.db2.gz GMYFCUXMYXEKTP-FQEVSTJZSA-N 2 0 357.586 4.020 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001167838253 1086712091 /nfs/dbraw/zinc/71/20/91/1086712091.db2.gz SNJPBYITHWHYDQ-YLJYHZDGSA-N 2 0 352.950 4.398 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N(C)Cc2ccccc2F)CC1 ZINC001167840656 1086727174 /nfs/dbraw/zinc/72/71/74/1086727174.db2.gz GYTQBNLDHQJVHX-LJQANCHMSA-N 2 0 363.565 4.232 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 ZINC001167841613 1086738232 /nfs/dbraw/zinc/73/82/32/1086738232.db2.gz NCHWNZDSRYBIRU-GUDVDZBRSA-N 2 0 369.594 4.265 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cc(-c4ccccc4)cs3)C2)C1 ZINC000650706382 1086755370 /nfs/dbraw/zinc/75/53/70/1086755370.db2.gz JOZAIIWBBDWPOF-QFUCXCTJSA-N 2 0 356.535 4.133 20 0 FIADRP CCOC1CC([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000549626054 1086756522 /nfs/dbraw/zinc/75/65/22/1086756522.db2.gz QVOJYYHOLUBJDV-VFVPAJFXSA-N 2 0 362.945 4.411 20 0 FIADRP CC[C@@H](C[NH2+]C1CC[NH+](C(C)C)CC1)Oc1ccccc1C(F)(F)F ZINC000543834656 1086775445 /nfs/dbraw/zinc/77/54/45/1086775445.db2.gz MZNJGKWRJOOEEP-INIZCTEOSA-N 2 0 358.448 4.325 20 0 FIADRP [NH3+]CC1(CC[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000650713111 1086786400 /nfs/dbraw/zinc/78/64/00/1086786400.db2.gz GLCXZXRKXFIODF-UHFFFAOYSA-N 2 0 365.340 4.396 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CCC([NH3+])CC2)CCC3)cc1 ZINC000583558869 1086795759 /nfs/dbraw/zinc/79/57/59/1086795759.db2.gz QNAOOPMYVWAOQH-VMBOVVBDSA-N 2 0 357.523 4.056 20 0 FIADRP CC(C)CC[N@@H+]1Cc2cccc(NC(=O)[C@@H](C)[C@@H]([NH3+])c3ccccc3)c2C1 ZINC000246188617 1086903613 /nfs/dbraw/zinc/90/36/13/1086903613.db2.gz CVNRQIWVVXFVMA-HTAPYJJXSA-N 2 0 365.521 4.323 20 0 FIADRP Cc1c([C@H](C)NCc2ccc(C[NH3+])cc2F)cnn1-c1cc(C)ccc1C ZINC000650753160 1086954174 /nfs/dbraw/zinc/95/41/74/1086954174.db2.gz HZSHIXWYQQSRRN-INIZCTEOSA-N 2 0 366.484 4.246 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)c(F)c1 ZINC000650754784 1086963121 /nfs/dbraw/zinc/96/31/21/1086963121.db2.gz QUFYZOIWISLJPE-MRXNPFEDSA-N 2 0 369.303 4.349 20 0 FIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3cc(Br)ccc32)c(F)c1 ZINC000650754957 1086963753 /nfs/dbraw/zinc/96/37/53/1086963753.db2.gz VPUTZBPSPFSQNF-SFHVURJKSA-N 2 0 363.274 4.214 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C ZINC000650757984 1086971448 /nfs/dbraw/zinc/97/14/48/1086971448.db2.gz GBLIOJZXIIJULW-CQSZACIVSA-N 2 0 352.507 4.084 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CCC4(CCCO4)CC3)cc2)C1 ZINC000583969158 1087069521 /nfs/dbraw/zinc/06/95/21/1087069521.db2.gz NPYPBFSYYFKWGG-BVVFMGSASA-N 2 0 356.554 4.500 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)C(C)(C)C(F)F)CC2)c1 ZINC000657829717 1087177727 /nfs/dbraw/zinc/17/77/27/1087177727.db2.gz ZWHGHGWCSBPSPG-SFHVURJKSA-N 2 0 367.528 4.167 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2CCCn3nccc32)cc1 ZINC000657832377 1087198909 /nfs/dbraw/zinc/19/89/09/1087198909.db2.gz JFQVJGUCZLIDNY-QFIPXVFZSA-N 2 0 360.505 4.236 20 0 FIADRP COc1cc2ccc([C@H](C)[NH2+]C3CC[NH+](CC4CC4)CC3)cc2cc1OC ZINC000657847777 1087294251 /nfs/dbraw/zinc/29/42/51/1087294251.db2.gz ZWUQDQZCRAGAMY-INIZCTEOSA-N 2 0 368.521 4.382 20 0 FIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000584378425 1087313322 /nfs/dbraw/zinc/31/33/22/1087313322.db2.gz JKEMZOMKHQTEEX-UNMCSNQZSA-N 2 0 350.506 4.278 20 0 FIADRP CC[C@H](Cc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000657856001 1087361082 /nfs/dbraw/zinc/36/10/82/1087361082.db2.gz JFZHEFCMSYLSFU-QGZVFWFLSA-N 2 0 365.359 4.377 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCCc2nc3ccccc3n2C)CC1 ZINC000090050254 1087401268 /nfs/dbraw/zinc/40/12/68/1087401268.db2.gz VRGQPLYWPORKMW-NQIIRXRSSA-N 2 0 368.569 4.139 20 0 FIADRP COc1ccccc1[C@H]([NH2+]CCc1cn2c(n1)CCCC2)C1CCCC1 ZINC000091284637 1087426540 /nfs/dbraw/zinc/42/65/40/1087426540.db2.gz XHCQXZHNPGIHIB-JOCHJYFZSA-N 2 0 353.510 4.292 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285114 1087427074 /nfs/dbraw/zinc/42/70/74/1087427074.db2.gz UDCWQBNUCLRSOV-IBGZPJMESA-N 2 0 370.368 4.062 20 0 FIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285113 1087427185 /nfs/dbraw/zinc/42/71/85/1087427185.db2.gz UDCWQBNUCLRSOV-LJQANCHMSA-N 2 0 370.368 4.062 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2ccncc2s1 ZINC000657869105 1087471729 /nfs/dbraw/zinc/47/17/29/1087471729.db2.gz YCTQHXAVHLJJGZ-INIZCTEOSA-N 2 0 369.534 4.478 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc3cc(OC)c(OC)cc3c2)CC1 ZINC000657873262 1087513145 /nfs/dbraw/zinc/51/31/45/1087513145.db2.gz WJILQYOHHQCJHC-INIZCTEOSA-N 2 0 356.510 4.240 20 0 FIADRP Fc1cc(F)cc(C2CC([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000685425988 1087565175 /nfs/dbraw/zinc/56/51/75/1087565175.db2.gz OZGDGZWANSKUPL-UHFFFAOYSA-N 2 0 357.448 4.112 20 0 FIADRP C[C@H]([NH2+][C@H](c1cnn(C)c1)C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685425674 1087565314 /nfs/dbraw/zinc/56/53/14/1087565314.db2.gz UWVSWOSKRAWNSB-FBBABVLZSA-N 2 0 354.542 4.008 20 0 FIADRP C[N@H+](Cc1cc(-c2ccccc2)cs1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000685457895 1087573043 /nfs/dbraw/zinc/57/30/43/1087573043.db2.gz RSHSOVGWNIQBJY-OAQYLSRUSA-N 2 0 369.578 4.015 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)cc1O ZINC000685645201 1087655531 /nfs/dbraw/zinc/65/55/31/1087655531.db2.gz XKNUWCSDVZKODC-GOSISDBHSA-N 2 0 368.521 4.484 20 0 FIADRP CCC1(C[NH2+][C@H]2CCCn3nccc32)CC[NH+](Cc2ccccc2)CC1 ZINC000657931043 1087658954 /nfs/dbraw/zinc/65/89/54/1087658954.db2.gz QSMTVXFOZZWVDK-FQEVSTJZSA-N 2 0 352.526 4.000 20 0 FIADRP COc1cccc(C2(C[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000685655481 1087659749 /nfs/dbraw/zinc/65/97/49/1087659749.db2.gz RBSSEGSCPUNFKV-TZIWHRDSSA-N 2 0 364.533 4.227 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2ccncc2s1 ZINC000657999161 1087696343 /nfs/dbraw/zinc/69/63/43/1087696343.db2.gz SQUJQOXOMFRQFJ-FUHWJXTLSA-N 2 0 351.519 4.469 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658065608 1087705448 /nfs/dbraw/zinc/70/54/48/1087705448.db2.gz RSWKYMQFHAUVBK-GOSISDBHSA-N 2 0 363.505 4.056 20 0 FIADRP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658066496 1087710011 /nfs/dbraw/zinc/71/00/11/1087710011.db2.gz BAJUDDHAYBFSIY-XZOQPEGZSA-N 2 0 356.554 4.112 20 0 FIADRP CC(C)[C@@H](CCc1ccccc1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067420 1087710033 /nfs/dbraw/zinc/71/00/33/1087710033.db2.gz NRDXGIQLKQEPDI-HSZRJFAPSA-N 2 0 358.570 4.124 20 0 FIADRP c1ccc(C2CCC([NH2+]CC3CC[NH+](C4CCOCC4)CC3)CC2)cc1 ZINC000658068991 1087710303 /nfs/dbraw/zinc/71/03/03/1087710303.db2.gz IXNZIVVXMCQMCH-UHFFFAOYSA-N 2 0 356.554 4.193 20 0 FIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(F)ccc1F ZINC000658071767 1087711382 /nfs/dbraw/zinc/71/13/82/1087711382.db2.gz YTKHYLRBVCZCAK-NRFANRHFSA-N 2 0 366.496 4.143 20 0 FIADRP Cc1ccc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CCC2)cc1 ZINC000658070449 1087711638 /nfs/dbraw/zinc/71/16/38/1087711638.db2.gz OWRYVNZLGWHQAV-HSZRJFAPSA-N 2 0 356.554 4.317 20 0 FIADRP CCC1(C[NH2+][C@H]2CCC23CCOCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000548859487 1087713653 /nfs/dbraw/zinc/71/36/53/1087713653.db2.gz KUVLIACHKDMIJC-NRFANRHFSA-N 2 0 356.554 4.228 20 0 FIADRP CC(C)(C)OC(=O)CCCC[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000612059119 1087728819 /nfs/dbraw/zinc/72/88/19/1087728819.db2.gz UDPSJEAGAXKUOC-UHFFFAOYSA-N 2 0 352.563 4.086 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc2ccccc2c1 ZINC000658147230 1087739074 /nfs/dbraw/zinc/73/90/74/1087739074.db2.gz XJPLDLDNVGOSLW-UUOWRZLLSA-N 2 0 360.501 4.257 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@@H](CC3CCC3)c3ccccc3)cc2)C1 ZINC000658136279 1087742725 /nfs/dbraw/zinc/74/27/25/1087742725.db2.gz GMMGYRRLRAIDNE-RPWUZVMVSA-N 2 0 364.533 4.274 20 0 FIADRP O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]C3c4ccccc4-c4ccccc43)cc2)C1 ZINC000658138384 1087743500 /nfs/dbraw/zinc/74/35/00/1087743500.db2.gz MRFJWKSSRJURMO-FQEVSTJZSA-N 2 0 370.496 4.113 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc2ccccc2s1 ZINC000658139962 1087745788 /nfs/dbraw/zinc/74/57/88/1087745788.db2.gz RLAYZEHHEBWTTM-OXJNMPFZSA-N 2 0 366.530 4.319 20 0 FIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc(C)c1F ZINC000658164490 1087759828 /nfs/dbraw/zinc/75/98/28/1087759828.db2.gz DTNHLIUVOUIUSP-SFHVURJKSA-N 2 0 355.501 4.400 20 0 FIADRP Fc1ccc2c(c1)CCC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165003 1087760156 /nfs/dbraw/zinc/76/01/56/1087760156.db2.gz HCHQMYXHMPEOAN-QFIPXVFZSA-N 2 0 353.485 4.100 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658164894 1087760171 /nfs/dbraw/zinc/76/01/71/1087760171.db2.gz GMTPSDBNDORTIZ-LJQANCHMSA-N 2 0 367.537 4.432 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc2c(s1)CCC2 ZINC000658166263 1087761767 /nfs/dbraw/zinc/76/17/67/1087761767.db2.gz NLUVNLILHAAEAZ-INIZCTEOSA-N 2 0 355.551 4.195 20 0 FIADRP CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3C[N@@H+]3CCCC[C@H]3C)C[C@H]2C1 ZINC000424260732 1087879333 /nfs/dbraw/zinc/87/93/33/1087879333.db2.gz DLEQASDLDJUYKF-PHNZBSFLSA-N 2 0 356.554 4.354 20 0 FIADRP Cc1nc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)oc1-c1ccc(Cl)cc1 ZINC000424285563 1087897365 /nfs/dbraw/zinc/89/73/65/1087897365.db2.gz FUIZDTCXDUUAPU-CQSZACIVSA-N 2 0 359.901 4.267 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H](Cc2ccncc2)c2cccs2)ccc1F ZINC000424309254 1087931948 /nfs/dbraw/zinc/93/19/48/1087931948.db2.gz ICVITTFSDVYYPX-FQEVSTJZSA-N 2 0 369.509 4.417 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414808312 1088181143 /nfs/dbraw/zinc/18/11/43/1088181143.db2.gz FCKWSMJRYJLFDF-CABCVRRESA-N 2 0 359.901 4.175 20 0 FIADRP C[N@@H+]1CC[C@H](N[C@H](C[NH3+])c2ccc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000423385592 1088184440 /nfs/dbraw/zinc/18/44/40/1088184440.db2.gz GRUWOCIHMFERQW-VXNXHJTFSA-N 2 0 359.517 4.265 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000163558256 1088209807 /nfs/dbraw/zinc/20/98/07/1088209807.db2.gz INUUZNMBMPZSOD-CRICUBBOSA-N 2 0 358.551 4.117 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c(-c2ccccc2Cl)n1 ZINC000414830734 1088361304 /nfs/dbraw/zinc/36/13/04/1088361304.db2.gz CINUKWBQIFEONK-MRXNPFEDSA-N 2 0 374.960 4.438 20 0 FIADRP C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000311258132 1088473473 /nfs/dbraw/zinc/47/34/73/1088473473.db2.gz MMPRNPYEFMUDGF-XWSJACJDSA-N 2 0 367.578 4.017 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(COCc3ccccc3)c2)[C@@H]2CCC[C@@H]21 ZINC000514090565 1088735662 /nfs/dbraw/zinc/73/56/62/1088735662.db2.gz VLBBGXOMWHMGAV-HJOGWXRNSA-N 2 0 364.533 4.366 20 0 FIADRP c1coc(-c2nc(CN3CCC(c4ncc5n4CCCC5)CC3)cs2)c1 ZINC000434675003 1088939552 /nfs/dbraw/zinc/93/95/52/1088939552.db2.gz JXWQYMSJDCQQCT-UHFFFAOYSA-N 2 0 368.506 4.316 20 0 FIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)C1 ZINC000415029205 1089058143 /nfs/dbraw/zinc/05/81/43/1089058143.db2.gz DOMJLBCFQQEVLV-PWSUYJOCSA-N 2 0 356.322 4.334 20 0 FIADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000415042243 1089079537 /nfs/dbraw/zinc/07/95/37/1089079537.db2.gz QNLXVBRAKRQASM-QWHCGFSZSA-N 2 0 365.340 4.395 20 0 FIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000415046864 1089093258 /nfs/dbraw/zinc/09/32/58/1089093258.db2.gz VLDICKKDPIPOLS-BXUZGUMPSA-N 2 0 355.429 4.046 20 0 FIADRP [NH3+]CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000415055885 1089101116 /nfs/dbraw/zinc/10/11/16/1089101116.db2.gz PFLOXMMJLDLOSJ-UCBGAZFYSA-N 3 0 363.549 4.252 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)ccc1Oc1cccnc1 ZINC000415055563 1089101791 /nfs/dbraw/zinc/10/17/91/1089101791.db2.gz RGEATKAOHIKKAO-CTNGQTDRSA-N 2 0 351.494 4.146 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Br)ccc1F)c1ccccc1 ZINC000415064226 1089104362 /nfs/dbraw/zinc/10/43/62/1089104362.db2.gz KHKDAHSOFDUSPG-KRWDZBQOSA-N 2 0 351.263 4.158 20 0 FIADRP C[C@@H]1C[C@H](C[NH2+]CC2(c3ccc(Cl)cc3Cl)CCOCC2)CC[NH2+]1 ZINC000415087259 1089148912 /nfs/dbraw/zinc/14/89/12/1089148912.db2.gz KTATWNNAQQQQLQ-HUUCEWRRSA-N 2 0 371.352 4.019 20 0 FIADRP CC(C)[NH+]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000514506642 1089165199 /nfs/dbraw/zinc/16/51/99/1089165199.db2.gz OVXYVACLZNFNQR-UHFFFAOYSA-N 2 0 372.557 4.009 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1)[C@H]1CCC[NH2+]C1 ZINC000414860432 1089167459 /nfs/dbraw/zinc/16/74/59/1089167459.db2.gz VJRIYGAHWLMTMU-RDJZCZTQSA-N 2 0 371.912 4.070 20 0 FIADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000415116913 1089175599 /nfs/dbraw/zinc/17/55/99/1089175599.db2.gz IKNUQZMPWHOWFD-KUHUBIRLSA-N 2 0 370.368 4.078 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)C1 ZINC000415126560 1089178406 /nfs/dbraw/zinc/17/84/06/1089178406.db2.gz POZIGNBCEGXZDG-AZUAARDMSA-N 2 0 374.525 4.273 20 0 FIADRP Cc1ccc(-c2cccc(C[NH+]3CCC([C@@H]4C[C@@H]([NH3+])CCO4)CC3)c2)cc1 ZINC000415126092 1089180196 /nfs/dbraw/zinc/18/01/96/1089180196.db2.gz PCUFXKGOXFUNGU-ZEQRLZLVSA-N 2 0 364.533 4.380 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000415125029 1089186938 /nfs/dbraw/zinc/18/69/38/1089186938.db2.gz KZKIVLVHOXMZTF-FPOVZHCZSA-N 2 0 356.535 4.133 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000415130703 1089197940 /nfs/dbraw/zinc/19/79/40/1089197940.db2.gz RKNOUGRCDCXFGC-GOTSBHOMSA-N 2 0 350.506 4.072 20 0 FIADRP C[C@@H]1CC(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C[C@@H](C)O1 ZINC000549236935 1089311077 /nfs/dbraw/zinc/31/10/77/1089311077.db2.gz IQBLJMBOHYODJC-JTPPEQCGSA-N 2 0 356.554 4.080 20 0 FIADRP C[C@H](CC[NH2+]Cc1ccccc1-c1ccnn1C)[N@H+](C)Cc1ccccc1 ZINC000511523971 1089396543 /nfs/dbraw/zinc/39/65/43/1089396543.db2.gz PYTGEKUEAIKOFV-LJQANCHMSA-N 2 0 362.521 4.087 20 0 FIADRP Cc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)c(-c2cnn(C)c2)c1 ZINC000549249906 1089419139 /nfs/dbraw/zinc/41/91/39/1089419139.db2.gz QAHUTDGEWGZBRW-UHFFFAOYSA-N 2 0 354.542 4.141 20 0 FIADRP Cc1ncc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cn1 ZINC000549270379 1089510410 /nfs/dbraw/zinc/51/04/10/1089510410.db2.gz WECDZKVUGSGTJU-KRIYCRJKSA-N 2 0 370.928 4.142 20 0 FIADRP C[C@@H](CC1CCOCC1)C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435424759 1089640179 /nfs/dbraw/zinc/64/01/79/1089640179.db2.gz ALLWPVVKIBTRRC-PXNSSMCTSA-N 2 0 362.583 4.145 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC(CC[NH3+])CC1 ZINC000515305886 1089946784 /nfs/dbraw/zinc/94/67/84/1089946784.db2.gz KMBYXGOTEKGJKP-QGZVFWFLSA-N 2 0 351.494 4.061 20 0 FIADRP Cc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000511536878 1090123387 /nfs/dbraw/zinc/12/33/87/1090123387.db2.gz LOFKZBVGSKYHIS-UHFFFAOYSA-N 2 0 353.510 4.346 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000549424258 1090320795 /nfs/dbraw/zinc/32/07/95/1090320795.db2.gz CTBPIHLAENDYLQ-KRWDZBQOSA-N 2 0 364.415 4.130 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000511565596 1090441423 /nfs/dbraw/zinc/44/14/23/1090441423.db2.gz KJLJRHPULSHRIC-GBESFXJTSA-N 2 0 352.522 4.069 20 0 FIADRP c1c2c(nn1-c1ccccc1)CCC[C@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000584669495 1090684294 /nfs/dbraw/zinc/68/42/94/1090684294.db2.gz YYUUCGOLMKODDQ-OAQYLSRUSA-N 2 0 352.526 4.105 20 0 FIADRP Cc1ccncc1CCC[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000584871324 1090962221 /nfs/dbraw/zinc/96/22/21/1090962221.db2.gz SPDCCLGFZGTDSX-JOCHJYFZSA-N 2 0 351.538 4.215 20 0 FIADRP O[C@H](CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccccc1 ZINC000312570829 1090976303 /nfs/dbraw/zinc/97/63/03/1090976303.db2.gz UUDPJUKYLCANCZ-HSZRJFAPSA-N 2 0 364.533 4.098 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)CC1 ZINC000500086388 1091032077 /nfs/dbraw/zinc/03/20/77/1091032077.db2.gz DIMRNMCZZCWKEW-SFHVURJKSA-N 2 0 363.977 4.282 20 0 FIADRP Brc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000582115233 1091145032 /nfs/dbraw/zinc/14/50/32/1091145032.db2.gz XTAFVCSDDWAQDD-RUCARUNLSA-N 2 0 363.343 4.159 20 0 FIADRP C[C@@H]1C[C@H](NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000390519711 1091162904 /nfs/dbraw/zinc/16/29/04/1091162904.db2.gz FSMVHZYGHNLXAZ-ZJSXRUAMSA-N 2 0 365.565 4.151 20 0 FIADRP CC(C)C[NH+]1CCC(NCc2cccc(NC(=O)OC(C)(C)C)c2)CC1 ZINC000709484821 1091377510 /nfs/dbraw/zinc/37/75/10/1091377510.db2.gz POAGVFPTHCEFJD-UHFFFAOYSA-N 2 0 361.530 4.244 20 0 FIADRP COc1cccc2cc(CNC[C@H]3CC[N@H+](Cc4ccccc4)C3)oc21 ZINC000311397297 1091425506 /nfs/dbraw/zinc/42/55/06/1091425506.db2.gz PUJZMBIGJKBDJC-GOSISDBHSA-N 2 0 350.462 4.053 20 0 FIADRP COCC[N@H+](C)CC[C@@H](Nc1cc[nH+]c2cc(F)ccc12)c1ccccc1 ZINC000500408398 1091458225 /nfs/dbraw/zinc/45/82/25/1091458225.db2.gz KMZSXCATGINEIH-HXUWFJFHSA-N 2 0 367.468 4.495 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ncc(Br)cc1F ZINC000187201218 1091854175 /nfs/dbraw/zinc/85/41/75/1091854175.db2.gz MZBFGVFQZRVOJW-AWEZNQCLSA-N 2 0 372.326 4.290 20 0 FIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(F)c3cccnc23)C1 ZINC000512215148 1091915619 /nfs/dbraw/zinc/91/56/19/1091915619.db2.gz VLYURKBVOBYDQF-ROUUACIJSA-N 2 0 355.501 4.460 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)c(OC)c1 ZINC000512314228 1092031627 /nfs/dbraw/zinc/03/16/27/1092031627.db2.gz NNOLVQRNNWGTJD-POAQFYNOSA-N 2 0 360.542 4.398 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc4occc4c3)cc2)CC1 ZINC000512374113 1092185789 /nfs/dbraw/zinc/18/57/89/1092185789.db2.gz DMBAHNFGHHUAEE-UHFFFAOYSA-N 2 0 350.462 4.196 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(CC[NH+](C)C)cc2)cc1)C1CC1 ZINC000076158105 1092263519 /nfs/dbraw/zinc/26/35/19/1092263519.db2.gz JJILPSHYWGZQOX-UHFFFAOYSA-N 2 0 365.521 4.027 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCCCC2)cc1OC ZINC000246081012 1092325849 /nfs/dbraw/zinc/32/58/49/1092325849.db2.gz BZEZPADFFCQAQH-UXHICEINSA-N 2 0 372.553 4.122 20 0 FIADRP COC(=O)c1cc([C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)oc1C ZINC000432781797 1092348976 /nfs/dbraw/zinc/34/89/76/1092348976.db2.gz TWVZWXLJZYAIKV-INIZCTEOSA-N 2 0 362.514 4.024 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)C2)cc1 ZINC000442709034 1092734285 /nfs/dbraw/zinc/73/42/85/1092734285.db2.gz MZVAONBPDSRHFM-QGPMSJSTSA-N 2 0 352.444 4.415 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+]CCc1ccc(OCC[NH+](C)C)cc1 ZINC000442788223 1092767009 /nfs/dbraw/zinc/76/70/09/1092767009.db2.gz YBXFVCKHOSXSLX-KRWDZBQOSA-N 2 0 358.551 4.242 20 0 FIADRP CC(C)[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000442878374 1092834191 /nfs/dbraw/zinc/83/41/91/1092834191.db2.gz STOBOLKHNKLYSG-SFHVURJKSA-N 2 0 371.491 4.018 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000549817994 1092843822 /nfs/dbraw/zinc/84/38/22/1092843822.db2.gz KTUNHNHTOCXRII-BVSLBCMMSA-N 2 0 372.553 4.000 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC(C)(C)c3cc(OC)ccc32)[C@H](C)C1 ZINC000474039339 1092845117 /nfs/dbraw/zinc/84/51/17/1092845117.db2.gz SUHTWKDLPUXYCF-VOQZNFBZSA-N 2 0 374.569 4.144 20 0 FIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000442918938 1092866376 /nfs/dbraw/zinc/86/63/76/1092866376.db2.gz DILBXKMHVWNIAR-CYBMUJFWSA-N 2 0 369.456 4.390 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000443063951 1092924891 /nfs/dbraw/zinc/92/48/91/1092924891.db2.gz XNRHJLNQETVDAP-MSOLQXFVSA-N 2 0 351.494 4.061 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(C)c(C)c2)CC1 ZINC000521828180 1092932495 /nfs/dbraw/zinc/93/24/95/1092932495.db2.gz IFTANYYLIFJURH-LJQANCHMSA-N 2 0 369.528 4.435 20 0 FIADRP Cc1ccccc1[C@@H]([C@H](C)NC1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000443200629 1092988581 /nfs/dbraw/zinc/98/85/81/1092988581.db2.gz VYKMHXPHALEBKH-GBXCKJPGSA-N 2 0 365.565 4.240 20 0 FIADRP C[C@@H](c1nc(-c2ccc(C[NH+]3CCCC3)cc2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443218578 1092994272 /nfs/dbraw/zinc/99/42/72/1092994272.db2.gz FUEJLIUWRMUSMJ-BBWFWOEESA-N 2 0 354.498 4.266 20 0 FIADRP C[C@H](c1nc(-c2ccc(C[NH+]3CCCC3)cc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443218581 1092994328 /nfs/dbraw/zinc/99/43/28/1092994328.db2.gz FUEJLIUWRMUSMJ-BRWVUGGUSA-N 2 0 354.498 4.266 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cs1 ZINC000512636276 1093053305 /nfs/dbraw/zinc/05/33/05/1093053305.db2.gz KWGPJIKUDMDHPD-HMXCVIKNSA-N 2 0 369.578 4.138 20 0 FIADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512660444 1093096232 /nfs/dbraw/zinc/09/62/32/1093096232.db2.gz NGNBYEBUKUSXJH-BHIFYINESA-N 2 0 358.570 4.066 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000522118216 1093105048 /nfs/dbraw/zinc/10/50/48/1093105048.db2.gz VIZHHOWIJUPUSK-UHFFFAOYSA-N 2 0 358.448 4.136 20 0 FIADRP CC(C)c1nc([C@@H](C)[NH2+]CCc2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000469775145 1093122073 /nfs/dbraw/zinc/12/20/73/1093122073.db2.gz JILAMHVODXTTKL-MRXNPFEDSA-N 2 0 361.555 4.100 20 0 FIADRP COc1cc(F)ccc1CN[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168017617 1093155091 /nfs/dbraw/zinc/15/50/91/1093155091.db2.gz BIMWQAHALBRKIX-UPHUGPLXSA-N 2 0 356.485 4.366 20 0 FIADRP CCCc1nc(C)c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433051070 1093159281 /nfs/dbraw/zinc/15/92/81/1093159281.db2.gz FVYQJVRNVUDREH-UHFFFAOYSA-N 2 0 367.537 4.424 20 0 FIADRP C[C@@H]1CC([NH2+]CCCOc2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168018832 1093173855 /nfs/dbraw/zinc/17/38/55/1093173855.db2.gz FKQAJDHXUBTAJU-WOJBJXKFSA-N 2 0 352.522 4.487 20 0 FIADRP C[C@H]1CC([NH2+]CCOc2cccc(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168020865 1093226068 /nfs/dbraw/zinc/22/60/68/1093226068.db2.gz OATYXMAMMGDFNN-ROUUACIJSA-N 2 0 356.485 4.236 20 0 FIADRP Cc1ccc(C)c(NC(=O)[C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000443597290 1093310970 /nfs/dbraw/zinc/31/09/70/1093310970.db2.gz ATNMUNYNYQHYBE-HXUWFJFHSA-N 2 0 371.569 4.218 20 0 FIADRP Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1C ZINC000443609080 1093325337 /nfs/dbraw/zinc/32/53/37/1093325337.db2.gz UMRLWTAMMNBBFI-FQEVSTJZSA-N 2 0 371.569 4.218 20 0 FIADRP CCN(CC)Cc1nc(C2([NH2+]C[C@@H]3C(C)=CCC[C@H]3C)CCCC2)no1 ZINC000443639437 1093364404 /nfs/dbraw/zinc/36/44/04/1093364404.db2.gz GPOLBGNQUVWFAJ-QZTJIDSGSA-N 2 0 360.546 4.263 20 0 FIADRP CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000443646760 1093387148 /nfs/dbraw/zinc/38/71/48/1093387148.db2.gz WSEBJRDWUGSVEN-NZQKXSOJSA-N 2 0 361.618 4.107 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c(F)c1 ZINC001168024446 1093392040 /nfs/dbraw/zinc/39/20/40/1093392040.db2.gz GQWWVVRELIYIFP-RMFSNUHRSA-N 2 0 370.512 4.408 20 0 FIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CCCCC4CCOCC4)C[C@H]3C2)cc1 ZINC000389160268 1093479023 /nfs/dbraw/zinc/47/90/23/1093479023.db2.gz YNNLUGBLTUQPNA-GOTSBHOMSA-N 2 0 356.554 4.037 20 0 FIADRP C[C@@H]1C[C@@H](NC(=[NH2+])c2cccnc2Cl)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168028556 1093537672 /nfs/dbraw/zinc/53/76/72/1093537672.db2.gz PHCRNWGKBSGWQS-SCAQPMJSSA-N 2 0 356.901 4.092 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(-c3cc[nH]n3)o2)C[N@@H+]1Cc1ccccc1 ZINC000433310823 1093564905 /nfs/dbraw/zinc/56/49/05/1093564905.db2.gz JRLAMZDTQVPBMZ-PKOBYXMFSA-N 2 0 364.493 4.060 20 0 FIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(-c4cc[nH]n4)o3)cc2)CC1 ZINC000433345717 1093599772 /nfs/dbraw/zinc/59/97/72/1093599772.db2.gz YOJSGNFOMPATKS-UHFFFAOYSA-N 2 0 364.493 4.191 20 0 FIADRP C[C@H]1CC(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168032307 1093652423 /nfs/dbraw/zinc/65/24/23/1093652423.db2.gz HLWKHISNHNHDLT-JAXLGGSGSA-N 2 0 369.597 4.425 20 0 FIADRP CC(C)C[C@@H](C[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000474284773 1093657145 /nfs/dbraw/zinc/65/71/45/1093657145.db2.gz SGOINXLSHMZZOW-QHCPKHFHSA-N 2 0 371.613 4.307 20 0 FIADRP C[C@@H]1C[C@@H](N2CCC([NH3+])(CC3CC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032592 1093667012 /nfs/dbraw/zinc/66/70/12/1093667012.db2.gz IEZNBJONXZAFSD-HATOLVCRSA-N 2 0 355.570 4.021 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc4ccccc4n3)CC2)C1 ZINC000513052518 1093697326 /nfs/dbraw/zinc/69/73/26/1093697326.db2.gz RERTWTHWKWBPER-XMSQKQJNSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4cc(F)ccc34)CC2)C1 ZINC000513063211 1093711571 /nfs/dbraw/zinc/71/15/71/1093711571.db2.gz GZKQPBIUSDOQPF-OXQOHEQNSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000513060653 1093712232 /nfs/dbraw/zinc/71/22/32/1093712232.db2.gz YVQILFLMFBHBHO-FDDCHVKYSA-N 2 0 351.538 4.410 20 0 FIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168033361 1093713630 /nfs/dbraw/zinc/71/36/30/1093713630.db2.gz KQRIPTMDPSTZTB-RUMRUAAYSA-N 3 0 371.613 4.386 20 0 FIADRP CC(C)C[NH+]1CCC(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168033359 1093713661 /nfs/dbraw/zinc/71/36/61/1093713661.db2.gz KQRIPTMDPSTZTB-NHCUHLMSSA-N 3 0 371.613 4.386 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000513063789 1093715329 /nfs/dbraw/zinc/71/53/29/1093715329.db2.gz IPMSNMKPHANNDL-DYESRHJHSA-N 2 0 365.496 4.492 20 0 FIADRP Cc1cccnc1C1(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168034002 1093729001 /nfs/dbraw/zinc/72/90/01/1093729001.db2.gz NXLNHXIGCBVSDS-WOJBJXKFSA-N 2 0 363.549 4.453 20 0 FIADRP COc1cc([C@H](C)NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)ccn1 ZINC001168033867 1093733513 /nfs/dbraw/zinc/73/35/13/1093733513.db2.gz MNTPWXOYTQTWQF-KURKYZTESA-N 2 0 353.510 4.182 20 0 FIADRP C[C@@H](C[NH2+][C@@H](C)Cc1ncc(C(F)(F)F)cc1Cl)C[NH+]1CCCC1 ZINC000623866742 1093735573 /nfs/dbraw/zinc/73/55/73/1093735573.db2.gz DSIGKMYCGSYVJC-STQMWFEESA-N 2 0 363.855 4.006 20 0 FIADRP CCOC(=O)[C@H]1CCCC[C@H]1[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168034637 1093759975 /nfs/dbraw/zinc/75/99/75/1093759975.db2.gz QHZIRVNGORJXNB-RPHTVSPISA-N 2 0 372.553 4.140 20 0 FIADRP Cc1ccnc(C2(C[NH2+]C3C[C@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)CC2)c1 ZINC001168034746 1093767705 /nfs/dbraw/zinc/76/77/05/1093767705.db2.gz RBTZODMTIBHGGD-PMACEKPBSA-N 2 0 363.549 4.453 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccc(OC)cc3)n2)CC1 ZINC000052209284 1093768508 /nfs/dbraw/zinc/76/85/08/1093768508.db2.gz GNQWYPQZPJBRKY-UHFFFAOYSA-N 2 0 371.525 4.294 20 0 FIADRP [NH3+][C@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)c1ccccc1 ZINC000178818013 1093770451 /nfs/dbraw/zinc/77/04/51/1093770451.db2.gz RRQRSLSIDVNWGD-OAQYLSRUSA-N 2 0 351.494 4.091 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)C1 ZINC000614387822 1093805606 /nfs/dbraw/zinc/80/56/06/1093805606.db2.gz OFZWMLFIDZHWGG-KDURUIRLSA-N 2 0 374.532 4.398 20 0 FIADRP CCOC(=O)C1(C)CCC([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000474471815 1093816429 /nfs/dbraw/zinc/81/64/29/1093816429.db2.gz NZPJBSFQXARVFO-UHFFFAOYSA-N 2 0 372.553 4.274 20 0 FIADRP C[C@@H]([C@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCC1 ZINC000474473472 1093818942 /nfs/dbraw/zinc/81/89/42/1093818942.db2.gz JLQCVGALSGOCNX-OALUTQOASA-N 2 0 358.570 4.338 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccnn2-c2ccccc2C)cc1 ZINC000474475909 1093821064 /nfs/dbraw/zinc/82/10/64/1093821064.db2.gz WYAHHSPMYVXHJK-UHFFFAOYSA-N 2 0 362.521 4.312 20 0 FIADRP COc1cccc(C[NH+]2CCC3(CC2)CC[NH+]([C@@H]2C[C@H]4C[C@H]4C2)CC3)c1 ZINC001167934107 1093928468 /nfs/dbraw/zinc/92/84/68/1093928468.db2.gz FWXGWTYZQJEWJI-WKCHPHFGSA-N 2 0 354.538 4.172 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)Oc1ccccc1C(F)(F)F ZINC000246541126 1094000924 /nfs/dbraw/zinc/00/09/24/1094000924.db2.gz VXFXMAJQRIKRGT-OWCLPIDISA-N 2 0 356.432 4.079 20 0 FIADRP Fc1cccc(C2([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CCC2)c1 ZINC000647802769 1094062725 /nfs/dbraw/zinc/06/27/25/1094062725.db2.gz TYUQAEMDIBRKHF-CTNGQTDRSA-N 2 0 352.453 4.050 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1-n1cccn1 ZINC000513341086 1094065680 /nfs/dbraw/zinc/06/56/80/1094065680.db2.gz QFFOVSRLLYRWJN-GOSISDBHSA-N 2 0 352.526 4.320 20 0 FIADRP c1ccc(C[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)c2cccnc2)nc1 ZINC000513353109 1094074328 /nfs/dbraw/zinc/07/43/28/1094074328.db2.gz HKENLVSTDUUHHI-JOCHJYFZSA-N 2 0 352.526 4.006 20 0 FIADRP Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000513405039 1094104048 /nfs/dbraw/zinc/10/40/48/1094104048.db2.gz QSMDJSZEUWEZLP-OAQYLSRUSA-N 2 0 372.459 4.217 20 0 FIADRP c1ccc(C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c2cccnc2)nc1 ZINC000513487725 1094158159 /nfs/dbraw/zinc/15/81/59/1094158159.db2.gz JEYNTYBIEGBSSM-XMMPIXPASA-N 2 0 372.516 4.146 20 0 FIADRP Cc1cccc2ncc(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)n21 ZINC000513493437 1094160809 /nfs/dbraw/zinc/16/08/09/1094160809.db2.gz ASEIVVIXIFAXBN-PZJWPPBQSA-N 2 0 362.521 4.033 20 0 FIADRP Cc1ccc([C@H](CNC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)[NH+]2CCCC2)o1 ZINC000513495136 1094163285 /nfs/dbraw/zinc/16/32/85/1094163285.db2.gz ZXCQFUQPMAQSGS-NYVOZVTQSA-N 2 0 373.585 4.358 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(-n3ccnc3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000513488019 1094166766 /nfs/dbraw/zinc/16/67/66/1094166766.db2.gz NQCMKJQQMVBESW-REWPJTCUSA-N 2 0 374.532 4.263 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000513502229 1094173856 /nfs/dbraw/zinc/17/38/56/1094173856.db2.gz YGOQPOCPQVIIEX-FPOVZHCZSA-N 2 0 374.532 4.467 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2-c2ccccc2)C[N@@H+]1Cc1ccccc1 ZINC000513502228 1094174080 /nfs/dbraw/zinc/17/40/80/1094174080.db2.gz YGOQPOCPQVIIEX-CTNGQTDRSA-N 2 0 374.532 4.467 20 0 FIADRP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(C(C)(C)C)cc3)cc2)CC1 ZINC000513643119 1094259269 /nfs/dbraw/zinc/25/92/69/1094259269.db2.gz NAPKGTRBSQLLQY-UHFFFAOYSA-N 2 0 365.565 4.021 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCOc2ccccc2F)CC1 ZINC000513671982 1094266532 /nfs/dbraw/zinc/26/65/32/1094266532.db2.gz HFINGLZIZDQIDB-UHFFFAOYSA-N 2 0 356.485 4.237 20 0 FIADRP Cc1cccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)[C@@H](C)C3)CC2)n1 ZINC001168036912 1094326870 /nfs/dbraw/zinc/32/68/70/1094326870.db2.gz XVJJFYKFRUHHAR-VTYHHJSWSA-N 2 0 363.549 4.453 20 0 FIADRP C[C@@H]1CC([NH2+]CC2(c3ncccc3F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168037341 1094366415 /nfs/dbraw/zinc/36/64/15/1094366415.db2.gz ZXPAJLBDOLPXRS-QZTJIDSGSA-N 2 0 367.512 4.284 20 0 FIADRP CC(C)C[NH+]1CCC([NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000513701871 1094390236 /nfs/dbraw/zinc/39/02/36/1094390236.db2.gz ATSBWPIZJUGUDG-UHFFFAOYSA-N 3 0 357.586 4.140 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474598667 1094395627 /nfs/dbraw/zinc/39/56/27/1094395627.db2.gz JMFPOSFWRJXFDQ-OVYGPGRDSA-N 2 0 370.990 4.373 20 0 FIADRP Cc1c2ccccc2oc1[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)C(C)C ZINC000501049329 1094456348 /nfs/dbraw/zinc/45/63/48/1094456348.db2.gz BPLWJBDSYDGEMA-QFIPXVFZSA-N 2 0 371.569 4.444 20 0 FIADRP CC[C@H](C)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)cc1 ZINC000501055092 1094467090 /nfs/dbraw/zinc/46/70/90/1094467090.db2.gz PZWPCXBCPGFBBL-RXVVDRJESA-N 2 0 365.993 4.433 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(C[NH+](C)C)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041569 1094578522 /nfs/dbraw/zinc/57/85/22/1094578522.db2.gz TVKJWCBONPEYNY-XHOKPMKBSA-N 3 0 357.586 4.138 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1OC ZINC000474793555 1094629508 /nfs/dbraw/zinc/62/95/08/1094629508.db2.gz DWCVPUAYNLHXEP-SJORKVTESA-N 2 0 360.542 4.192 20 0 FIADRP CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C1 ZINC000474802705 1094637143 /nfs/dbraw/zinc/63/71/43/1094637143.db2.gz YXLIWOFOMBLQEF-KNQAVFIVSA-N 2 0 358.570 4.338 20 0 FIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000474815328 1094661120 /nfs/dbraw/zinc/66/11/20/1094661120.db2.gz FHJAKBYWFABVLU-UNMCSNQZSA-N 2 0 356.510 4.206 20 0 FIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000501485507 1094736528 /nfs/dbraw/zinc/73/65/28/1094736528.db2.gz YXYLKDICEKVLKM-UHFFFAOYSA-N 2 0 368.521 4.022 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1OC ZINC000474893878 1094861883 /nfs/dbraw/zinc/86/18/83/1094861883.db2.gz ZRSMVOSDPWVSCY-IAGOWNOFSA-N 2 0 356.510 4.047 20 0 FIADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000420300925 1094870759 /nfs/dbraw/zinc/87/07/59/1094870759.db2.gz ICMABOXKBOLKMY-KRWDZBQOSA-N 2 0 366.534 4.032 20 0 FIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000420321415 1094880655 /nfs/dbraw/zinc/88/06/55/1094880655.db2.gz RFVRABUNELJADC-RBUKOAKNSA-N 2 0 354.542 4.186 20 0 FIADRP Cc1nc([C@H](C)[NH+]2CCC3(CC[NH2+]C3)CC2)oc1-c1ccc(Cl)cc1 ZINC000420345128 1094887752 /nfs/dbraw/zinc/88/77/52/1094887752.db2.gz VIPMKTZJAGSLAK-HNNXBMFYSA-N 2 0 359.901 4.440 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)nc(-c2ccc(Cl)cc2)n1 ZINC000420390973 1094909689 /nfs/dbraw/zinc/90/96/89/1094909689.db2.gz IEAXLRAAIHNERE-FXAWDEMLSA-N 2 0 370.928 4.069 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3sc4ccccc4c3Cl)CC2)C1 ZINC000420398934 1094912919 /nfs/dbraw/zinc/91/29/19/1094912919.db2.gz ZMAFOMFOVCKPLC-GOEBONIOSA-N 2 0 364.942 4.273 20 0 FIADRP COc1ccc(Br)cc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501770502 1094915577 /nfs/dbraw/zinc/91/55/77/1094915577.db2.gz ASSMTIJGBDXRKR-UHFFFAOYSA-N 2 0 369.347 4.012 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000474923313 1094923310 /nfs/dbraw/zinc/92/33/10/1094923310.db2.gz GABBJTKOLCPADY-AJYBTWMASA-N 2 0 374.569 4.438 20 0 FIADRP CCOC(=O)CC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168045049 1095023967 /nfs/dbraw/zinc/02/39/67/1095023967.db2.gz ILSCDGHXGMHMFW-HATOLVCRSA-N 2 0 372.553 4.093 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)CC1 ZINC000501982845 1095034916 /nfs/dbraw/zinc/03/49/16/1095034916.db2.gz VYRUBZVJKBXKCM-WXFUMESZSA-N 2 0 369.597 4.061 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000522551455 1095134020 /nfs/dbraw/zinc/13/40/20/1095134020.db2.gz JBOGHZBVTSFAQJ-CTNGQTDRSA-N 2 0 351.538 4.003 20 0 FIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000522551458 1095135520 /nfs/dbraw/zinc/13/55/20/1095135520.db2.gz JBOGHZBVTSFAQJ-TZIWHRDSSA-N 2 0 351.538 4.003 20 0 FIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000522551463 1095135742 /nfs/dbraw/zinc/13/57/42/1095135742.db2.gz JMFPAPRULWVHFO-SIKLNZKXSA-N 2 0 357.586 4.147 20 0 FIADRP CN(C[C@@H]1CCC[N@@H+]1C)C(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000421033240 1095246465 /nfs/dbraw/zinc/24/64/65/1095246465.db2.gz AITFXPNJMRIBJH-FQEVSTJZSA-N 2 0 372.557 4.009 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000502277582 1095298107 /nfs/dbraw/zinc/29/81/07/1095298107.db2.gz BIPWEYMVFHKNQH-DENIHFKCSA-N 2 0 356.554 4.500 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2cc(OC)c(OC)cc2C)c1 ZINC000502285432 1095310415 /nfs/dbraw/zinc/31/04/15/1095310415.db2.gz TZBIXBSUEDQDPF-GOSISDBHSA-N 2 0 370.537 4.185 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCCC34CCOCC4)c2)CC1 ZINC000502288226 1095311524 /nfs/dbraw/zinc/31/15/24/1095311524.db2.gz PPLODPNLQAJHPI-QFIPXVFZSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCCC23CCOCC3)C[N@@H+]1Cc1ccccc1 ZINC000502411458 1095435833 /nfs/dbraw/zinc/43/58/33/1095435833.db2.gz ARZRCCFKBGUYFD-HJNYFJLDSA-N 2 0 356.554 4.226 20 0 FIADRP C[NH+]1CCN(c2cccc(Cl)c2CNCc2ccccc2Cl)CC1 ZINC000237236425 1095721507 /nfs/dbraw/zinc/72/15/07/1095721507.db2.gz QOHQMDBOMDLTAR-UHFFFAOYSA-N 2 0 364.320 4.035 20 0 FIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cnn1-c1cccc(Cl)c1 ZINC000421883694 1095975249 /nfs/dbraw/zinc/97/52/49/1095975249.db2.gz TYOYHBCRKPXEFH-RWBZWWBESA-N 2 0 360.933 4.358 20 0 FIADRP c1cc2c(cccc2CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)[nH]1 ZINC000503123199 1096075451 /nfs/dbraw/zinc/07/54/51/1096075451.db2.gz RJJXXAANOCTCBZ-SSPYTLHUSA-N 2 0 359.517 4.211 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+]1[C@H](C)CC[C@H]1C ZINC000503162524 1096100813 /nfs/dbraw/zinc/10/08/13/1096100813.db2.gz VBAUMFGEYBXHRI-MKXGPGLRSA-N 2 0 357.542 4.261 20 0 FIADRP C[C@H](C[NH+](C)CCCC[N@@H+](C)C[C@@H](C)c1nccs1)c1nccs1 ZINC000273115131 1096235330 /nfs/dbraw/zinc/23/53/30/1096235330.db2.gz QRYNBKVFABGOIR-HZPDHXFCSA-N 2 0 366.600 4.151 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(OCc2ccccn2)cc1 ZINC000422718948 1096470292 /nfs/dbraw/zinc/47/02/92/1096470292.db2.gz LQSFANYTFFQQKH-QUCCMNQESA-N 2 0 353.510 4.061 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)CCc1ccc(OC(C)C)cc1 ZINC000422722129 1096471157 /nfs/dbraw/zinc/47/11/57/1096471157.db2.gz OWQJSDHMBPOSJL-IAGOWNOFSA-N 2 0 355.526 4.308 20 0 FIADRP CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OCC ZINC000422760530 1096476079 /nfs/dbraw/zinc/47/60/79/1096476079.db2.gz QFWJWPYTLKBJCI-LSDHHAIUSA-N 2 0 357.498 4.058 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1c2cc(Br)ccc2SC[C@@H]1C ZINC000422740855 1096477075 /nfs/dbraw/zinc/47/70/75/1096477075.db2.gz NNWROMFIVJGDEA-OZVIIMIRSA-N 2 0 357.361 4.339 20 0 FIADRP Cc1ccc(C[C@@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c2ccccn2)cc1 ZINC000422742738 1096478641 /nfs/dbraw/zinc/47/86/41/1096478641.db2.gz HAFDMQWEJAXGSK-FDDCHVKYSA-N 2 0 360.505 4.187 20 0 FIADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)c2ccccc21 ZINC000422768346 1096485347 /nfs/dbraw/zinc/48/53/47/1096485347.db2.gz SYAPFYCKQAVCJG-PMACEKPBSA-N 2 0 356.897 4.123 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000422766538 1096485534 /nfs/dbraw/zinc/48/55/34/1096485534.db2.gz RTRODTFAEAUVPM-AYBZRNKSSA-N 2 0 371.491 4.195 20 0 FIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422776064 1096489060 /nfs/dbraw/zinc/48/90/60/1096489060.db2.gz CBDHJEJFHPHNTB-IEBWSBKVSA-N 2 0 362.395 4.051 20 0 FIADRP C[C@H](C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)Sc1ccccc1 ZINC000422778587 1096489225 /nfs/dbraw/zinc/48/92/25/1096489225.db2.gz ATOJOKGQAKETBY-PBEJRMEISA-N 2 0 354.519 4.013 20 0 FIADRP CSc1cccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2cc(F)ccc2F)c1 ZINC000422785353 1096490353 /nfs/dbraw/zinc/49/03/53/1096490353.db2.gz JKTBDKCVVVSARW-ORAYPTAESA-N 2 0 350.478 4.493 20 0 FIADRP CC[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(F)cc1F ZINC000422762268 1096490872 /nfs/dbraw/zinc/49/08/72/1096490872.db2.gz MMFXIRYJIDTNLL-IRFCIJBXSA-N 2 0 358.432 4.261 20 0 FIADRP COc1ccc([C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C(C)C)cc1 ZINC000422786471 1096491385 /nfs/dbraw/zinc/49/13/85/1096491385.db2.gz OXPSXOMLTIQWRH-WWNPGLIZSA-N 2 0 366.505 4.238 20 0 FIADRP c1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cn2)cc1 ZINC000422848722 1096504916 /nfs/dbraw/zinc/50/49/16/1096504916.db2.gz UESGEAJHHLZUEV-PCCBWWKXSA-N 2 0 351.494 4.274 20 0 FIADRP Cc1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c(OCCC(C)C)c1 ZINC000422859257 1096506627 /nfs/dbraw/zinc/50/66/27/1096506627.db2.gz HGQSMNPBYKAEEO-QGZVFWFLSA-N 2 0 355.526 4.433 20 0 FIADRP Cc1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c(OCCC(C)C)c1 ZINC000422859256 1096507003 /nfs/dbraw/zinc/50/70/03/1096507003.db2.gz HGQSMNPBYKAEEO-KRWDZBQOSA-N 2 0 355.526 4.433 20 0 FIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422866576 1096508185 /nfs/dbraw/zinc/50/81/85/1096508185.db2.gz QSFYSTFSJCAPTQ-CTNGQTDRSA-N 2 0 372.509 4.034 20 0 FIADRP COc1cccc(C2(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)CCCC2)c1 ZINC000422889961 1096515333 /nfs/dbraw/zinc/51/53/33/1096515333.db2.gz RARXMSIQRMRTFM-INIZCTEOSA-N 2 0 353.510 4.020 20 0 FIADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000422870106 1096516574 /nfs/dbraw/zinc/51/65/74/1096516574.db2.gz YLQLTTAXNSEAPR-VXESANQCSA-N 2 0 351.494 4.107 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000422912668 1096522317 /nfs/dbraw/zinc/52/23/17/1096522317.db2.gz WQHUKBUPGIGKBI-QILLFSRXSA-N 2 0 371.550 4.174 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)C1C[NH2+]C1 ZINC000422923435 1096526079 /nfs/dbraw/zinc/52/60/79/1096526079.db2.gz WCTKEMHCAGBYOC-CYBMUJFWSA-N 2 0 350.384 4.195 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000422925097 1096526152 /nfs/dbraw/zinc/52/61/52/1096526152.db2.gz VBVHYYSJBCSRJU-SJORKVTESA-N 2 0 352.526 4.396 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000422927345 1096526974 /nfs/dbraw/zinc/52/69/74/1096526974.db2.gz GFWUUDSXZLFIMN-NWDGAFQWSA-N 2 0 353.388 4.159 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000422927661 1096527065 /nfs/dbraw/zinc/52/70/65/1096527065.db2.gz ZMVFZAWVVZCADL-LPHOPBHVSA-N 2 0 367.320 4.426 20 0 FIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422943867 1096528843 /nfs/dbraw/zinc/52/88/43/1096528843.db2.gz LCJLVPRNEUPHCV-NCXUSEDFSA-N 2 0 362.583 4.324 20 0 FIADRP CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1OC ZINC000422934568 1096529115 /nfs/dbraw/zinc/52/91/15/1096529115.db2.gz CPBASQXEYVOMFR-JKSUJKDBSA-N 2 0 371.525 4.448 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000422936967 1096529193 /nfs/dbraw/zinc/52/91/93/1096529193.db2.gz NJCTZPFMTPGZIA-OLZOCXBDSA-N 2 0 351.416 4.149 20 0 FIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422945649 1096535587 /nfs/dbraw/zinc/53/55/87/1096535587.db2.gz NOOIICFUAVILAO-IRFCIJBXSA-N 2 0 354.881 4.173 20 0 FIADRP CC(C)c1ccccc1OCC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422960321 1096540016 /nfs/dbraw/zinc/54/00/16/1096540016.db2.gz VUAIRGKYALFVQN-NZQKXSOJSA-N 2 0 366.505 4.034 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cnccc1N ZINC000422970392 1096542101 /nfs/dbraw/zinc/54/21/01/1096542101.db2.gz WIMPBEWYWARDPY-QGZVFWFLSA-N 2 0 360.505 4.074 20 0 FIADRP c1ccc(COc2cc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)ccn2)cc1 ZINC000422972084 1096543439 /nfs/dbraw/zinc/54/34/39/1096543439.db2.gz KOTHHHCNWMMYNQ-FDFHNCONSA-N 2 0 365.521 4.061 20 0 FIADRP c1ccc(COc2cc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)ccn2)cc1 ZINC000422972085 1096543715 /nfs/dbraw/zinc/54/37/15/1096543715.db2.gz KOTHHHCNWMMYNQ-YPAWHYETSA-N 2 0 365.521 4.061 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)s2)cc1 ZINC000422978985 1096544830 /nfs/dbraw/zinc/54/48/30/1096544830.db2.gz IJKIBIUOZLNIBS-QIXHYMPYSA-N 2 0 357.523 4.061 20 0 FIADRP C[NH+](C)[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000423057466 1096559462 /nfs/dbraw/zinc/55/94/62/1096559462.db2.gz ZVGBGKKAMFBRFC-GUDVDZBRSA-N 2 0 363.427 4.043 20 0 FIADRP Clc1cc2c(s1)CC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423120324 1096577997 /nfs/dbraw/zinc/57/79/97/1096577997.db2.gz GBUXIFYVJMQHQA-KHYOSLBOSA-N 2 0 360.910 4.234 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423122576 1096579202 /nfs/dbraw/zinc/57/92/02/1096579202.db2.gz KAOPENDUCRXMCZ-JKSUJKDBSA-N 2 0 362.477 4.448 20 0 FIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423129808 1096581008 /nfs/dbraw/zinc/58/10/08/1096581008.db2.gz MIZCHZCUZFBLKG-JBACZVJFSA-N 2 0 358.913 4.315 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000423106707 1096583528 /nfs/dbraw/zinc/58/35/28/1096583528.db2.gz OUCBJASLRSCBPW-AZQUWAFASA-N 3 0 363.977 4.361 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)cc1F ZINC000423109742 1096585067 /nfs/dbraw/zinc/58/50/67/1096585067.db2.gz OFQMBGSCGDXUCI-CMPLNLGQSA-N 2 0 366.278 4.162 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000423112053 1096586048 /nfs/dbraw/zinc/58/60/48/1096586048.db2.gz XGZVPQVDHFNTRE-VMRPVKRXSA-N 2 0 354.519 4.315 20 0 FIADRP Fc1ccc(C2CC2)cc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423147298 1096586501 /nfs/dbraw/zinc/58/65/01/1096586501.db2.gz RPYOYVKZHFAVTR-UNMCSNQZSA-N 2 0 352.453 4.049 20 0 FIADRP Fc1cc(F)c2c(c1)[C@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423146241 1096587091 /nfs/dbraw/zinc/58/70/91/1096587091.db2.gz OVMVWBVCASAQOH-KCZVDYSFSA-N 2 0 370.443 4.188 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH+]1CCC(Cc2cc(F)cc(F)c2)CC1 ZINC000423149847 1096587448 /nfs/dbraw/zinc/58/74/48/1096587448.db2.gz BAUPXUIFFVNKOE-OAHLLOKOSA-N 2 0 359.464 4.143 20 0 FIADRP FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423153386 1096588781 /nfs/dbraw/zinc/58/87/81/1096588781.db2.gz GKVOIGFPQHLEAA-PCODUJHASA-N 2 0 368.443 4.343 20 0 FIADRP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000503911874 1096593820 /nfs/dbraw/zinc/59/38/20/1096593820.db2.gz QXAFFFISCQVOIC-QGZVFWFLSA-N 2 0 351.494 4.002 20 0 FIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC[C@H](c1ccccc1)C(F)(F)F ZINC000423139600 1096594161 /nfs/dbraw/zinc/59/41/61/1096594161.db2.gz VTTKPOCNUMJVPX-IPELMVKDSA-N 2 0 350.428 4.271 20 0 FIADRP Cc1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc12 ZINC000423169029 1096601144 /nfs/dbraw/zinc/60/11/44/1096601144.db2.gz IOXHKYVOQWBESD-ISKFKSNPSA-N 2 0 358.485 4.494 20 0 FIADRP Cc1ncsc1C[N@H+](C[C@H](C)CCc1ccccc1)C[C@H]1CC[NH2+]C1 ZINC000414722871 1096609619 /nfs/dbraw/zinc/60/96/19/1096609619.db2.gz GOEOUVSQBFTHFU-XLIONFOSSA-N 2 0 357.567 4.132 20 0 FIADRP Cc1c([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cnn1-c1ccc(Cl)cc1Cl ZINC000423238398 1096618439 /nfs/dbraw/zinc/61/84/39/1096618439.db2.gz ADVKTGAMCYBZMH-JSGCOSHPSA-N 2 0 367.324 4.138 20 0 FIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423214010 1096619416 /nfs/dbraw/zinc/61/94/16/1096619416.db2.gz ODACKHVNNYWFGW-BBRMVZONSA-N 2 0 361.942 4.430 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)[C@@H]1CCC[NH2+]C1 ZINC000423219788 1096621597 /nfs/dbraw/zinc/62/15/97/1096621597.db2.gz ULIROEOKMAHMLQ-FRRDWIJNSA-N 2 0 351.288 4.234 20 0 FIADRP CCOc1cccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000414724258 1096621684 /nfs/dbraw/zinc/62/16/84/1096621684.db2.gz RJNRXTCYIPWRQD-FQEVSTJZSA-N 2 0 356.535 4.291 20 0 FIADRP CCC([NH3+])(CC)C[NH2+][C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423283476 1096633592 /nfs/dbraw/zinc/63/35/92/1096633592.db2.gz FGUACJDKHCDDHI-KRWDZBQOSA-N 2 0 369.347 4.024 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423292665 1096636046 /nfs/dbraw/zinc/63/60/46/1096636046.db2.gz NURYCSMUUFAIJF-IRXDYDNUSA-N 2 0 368.525 4.431 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+]C[C@H]([NH3+])C(C)C)nc1 ZINC000423269471 1096638301 /nfs/dbraw/zinc/63/83/01/1096638301.db2.gz HHVOVUYLPYWBLE-SFTDATJTSA-N 2 0 359.945 4.024 20 0 FIADRP CC1(C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]CC1 ZINC000423315707 1096642524 /nfs/dbraw/zinc/64/25/24/1096642524.db2.gz AASSGWQUVRURRN-LJQANCHMSA-N 2 0 360.448 4.357 20 0 FIADRP Fc1cccc(C[C@H]([NH2+]CC2C[NH2+]C2)c2ccc(Cl)c(Cl)c2)c1 ZINC000423300451 1096645458 /nfs/dbraw/zinc/64/54/58/1096645458.db2.gz DUUHWQPYJGFVHQ-SFHVURJKSA-N 2 0 353.268 4.225 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000423326187 1096647737 /nfs/dbraw/zinc/64/77/37/1096647737.db2.gz LXOQWKXCMXPTHH-AWEZNQCLSA-N 2 0 365.237 4.248 20 0 FIADRP C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@H]1CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423339599 1096650940 /nfs/dbraw/zinc/65/09/40/1096650940.db2.gz IYPOWVWGVJQZJP-KNOCVWDGSA-N 2 0 366.549 4.126 20 0 FIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccc(F)cc3)s2)CC[NH2+]CC1 ZINC000423380526 1096660582 /nfs/dbraw/zinc/66/05/82/1096660582.db2.gz DTTOSNHUCMTFLS-HNNXBMFYSA-N 2 0 362.514 4.221 20 0 FIADRP CC1CC[NH+](CCC[C@H](N[C@@H]2CC[NH2+][C@H](C)C2)c2ccc(F)cc2)CC1 ZINC000423392995 1096665204 /nfs/dbraw/zinc/66/52/04/1096665204.db2.gz XZGCYOQZVXGOTK-QIJUGHKUSA-N 2 0 361.549 4.109 20 0 FIADRP COCC1(C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]CC1 ZINC000423396333 1096666220 /nfs/dbraw/zinc/66/62/20/1096666220.db2.gz BIHVPGBBWIVKMN-FQEVSTJZSA-N 2 0 358.913 4.035 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)CCC3)cc1 ZINC000423433432 1096684174 /nfs/dbraw/zinc/68/41/74/1096684174.db2.gz JUAZGRMVHAHZLB-YQVWRLOYSA-N 2 0 371.525 4.304 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423457564 1096689343 /nfs/dbraw/zinc/68/93/43/1096689343.db2.gz IKVFJARXUOBZJL-SDDRHHMPSA-N 2 0 364.383 4.058 20 0 FIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000423463380 1096690662 /nfs/dbraw/zinc/69/06/62/1096690662.db2.gz PWFGHBLPRAGPLO-SVPCYEDISA-N 2 0 355.345 4.067 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000423464766 1096691832 /nfs/dbraw/zinc/69/18/32/1096691832.db2.gz HGLUTCGILRTWQD-HJNYFJLDSA-N 2 0 353.485 4.045 20 0 FIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc2cc(Br)ccc2o1 ZINC000423475509 1096695866 /nfs/dbraw/zinc/69/58/66/1096695866.db2.gz ICXIIGPCGDIMQX-SWLSCSKDSA-N 2 0 351.288 4.378 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cc2cc(Br)ccc2o1 ZINC000423477993 1096696859 /nfs/dbraw/zinc/69/68/59/1096696859.db2.gz SUMSXKNDLRENLR-ZOWXZIJZSA-N 2 0 351.288 4.363 20 0 FIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1nc2ccc(Cl)cc2n1C ZINC000423507197 1096701899 /nfs/dbraw/zinc/70/18/99/1096701899.db2.gz PTNGTMKXFZIBOY-WMLDXEAASA-N 2 0 356.901 4.358 20 0 FIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cncn2)cc1Cl ZINC000423507780 1096702371 /nfs/dbraw/zinc/70/23/71/1096702371.db2.gz QKOGOLFSIAQYQT-MGPUTAFESA-N 2 0 369.900 4.052 20 0 FIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000423482054 1096703077 /nfs/dbraw/zinc/70/30/77/1096703077.db2.gz XONFIEMTHBGHFO-XLJIZYSNSA-N 2 0 370.512 4.309 20 0 FIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000423509962 1096703639 /nfs/dbraw/zinc/70/36/39/1096703639.db2.gz RTGFKLOPWBBAKF-KXBFYZLASA-N 2 0 351.494 4.047 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423516559 1096711403 /nfs/dbraw/zinc/71/14/03/1096711403.db2.gz YCDZXKSQPFEMGU-UTKZUKDTSA-N 2 0 368.525 4.347 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423521799 1096711918 /nfs/dbraw/zinc/71/19/18/1096711918.db2.gz TZGRNPBMPDPBKY-JXFKEZNVSA-N 2 0 356.510 4.013 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2ccccc2)cc1 ZINC000423537613 1096715901 /nfs/dbraw/zinc/71/59/01/1096715901.db2.gz DICCHEUBKUMZOB-RCLSDMTESA-N 2 0 372.459 4.355 20 0 FIADRP Clc1cc(Br)cc2c1CC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423541687 1096716626 /nfs/dbraw/zinc/71/66/26/1096716626.db2.gz LJMZQCVWDVFKHX-PCUPFXIVSA-N 2 0 369.734 4.068 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)C2)cc1 ZINC000423541746 1096716854 /nfs/dbraw/zinc/71/68/54/1096716854.db2.gz LRWDPOOLWAKQTB-LLLOQXOTSA-N 2 0 352.444 4.319 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423554490 1096720290 /nfs/dbraw/zinc/72/02/90/1096720290.db2.gz WOUXFVAWUMFGAE-QCEMKRCNSA-N 2 0 359.514 4.296 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000515530274 1098668850 /nfs/dbraw/zinc/66/88/50/1098668850.db2.gz TWXQYIZXMZMBLC-LUOVTCROSA-N 2 0 350.453 4.248 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000515846350 1098978941 /nfs/dbraw/zinc/97/89/41/1098978941.db2.gz VUSQXTJGJACWER-OXJNMPFZSA-N 2 0 372.484 4.083 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000436402231 1098991628 /nfs/dbraw/zinc/99/16/28/1098991628.db2.gz UUDUNPQTOLPFFS-OYDLWJJNSA-N 2 0 364.533 4.069 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000436402233 1098991653 /nfs/dbraw/zinc/99/16/53/1098991653.db2.gz UUDUNPQTOLPFFS-ZTCOLXNVSA-N 2 0 364.533 4.069 20 0 FIADRP FC(F)(F)COc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533534557 1099162982 /nfs/dbraw/zinc/16/29/82/1099162982.db2.gz XKJSPPFOYHAONC-VQIMIIECSA-N 2 0 368.443 4.076 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@H]2CCC[C@H]21 ZINC000516324645 1099369973 /nfs/dbraw/zinc/36/99/73/1099369973.db2.gz XWBHALNZIDQFTM-FUPPJEDESA-N 2 0 374.532 4.047 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@@H]2CCC[C@H]21 ZINC000516324647 1099370652 /nfs/dbraw/zinc/37/06/52/1099370652.db2.gz XWBHALNZIDQFTM-QNWVGRARSA-N 2 0 374.532 4.047 20 0 FIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000516352948 1099401667 /nfs/dbraw/zinc/40/16/67/1099401667.db2.gz HJSKUURPNRPSKY-UHFFFAOYSA-N 2 0 370.562 4.279 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000162492430 1099808837 /nfs/dbraw/zinc/80/88/37/1099808837.db2.gz OSOMZHDTRIPGCA-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP C[C@H]([NH2+]CCOCc1ccc(Cl)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508693515 1099823451 /nfs/dbraw/zinc/82/34/51/1099823451.db2.gz CVCMDXPYEWRFFT-GHTZIAJQSA-N 2 0 372.940 4.357 20 0 FIADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Oc1ccc(F)cc1 ZINC000508693187 1099824220 /nfs/dbraw/zinc/82/42/20/1099824220.db2.gz AFNKZPUQHSWWJZ-QWFCFKBJSA-N 2 0 356.485 4.093 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H]2CC[NH+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000516866864 1099896609 /nfs/dbraw/zinc/89/66/09/1099896609.db2.gz UZUMPINZNKEABM-XZOQPEGZSA-N 2 0 369.597 4.141 20 0 FIADRP COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000516870693 1099899195 /nfs/dbraw/zinc/89/91/95/1099899195.db2.gz KVDJIISYHVGUIV-AZUAARDMSA-N 2 0 364.574 4.275 20 0 FIADRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(SC2CCCC2)cc1 ZINC000162582949 1099899643 /nfs/dbraw/zinc/89/96/43/1099899643.db2.gz WUPLRFVNVAVUDT-SFHVURJKSA-N 2 0 361.599 4.009 20 0 FIADRP C[C@H]([NH2+]CCc1nc2c(s1)CCCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508711760 1099903512 /nfs/dbraw/zinc/90/35/12/1099903512.db2.gz PDVKWNNWWQQBIQ-HKUYNNGSSA-N 2 0 369.578 4.065 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000467360075 1100103379 /nfs/dbraw/zinc/10/33/79/1100103379.db2.gz WFCXVVUHIAEVHO-IFPLKCGESA-N 2 0 356.554 4.082 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OCc2cccnc2)CC1 ZINC000536652391 1100106024 /nfs/dbraw/zinc/10/60/24/1100106024.db2.gz CKXDYMHTYZKRKQ-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1OCC(C)C ZINC000536653012 1100107930 /nfs/dbraw/zinc/10/79/30/1100107930.db2.gz RDMVQBRNJPWCEI-UHFFFAOYSA-N 2 0 362.558 4.282 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)C[C@H]1C ZINC000536659684 1100130776 /nfs/dbraw/zinc/13/07/76/1100130776.db2.gz RLSRDSMMULFLMU-QUCCMNQESA-N 2 0 353.510 4.487 20 0 FIADRP CC1(C)C[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccc(F)cc2O1 ZINC000459435187 1100147585 /nfs/dbraw/zinc/14/75/85/1100147585.db2.gz OTQHBYIFXPOFAC-IBGZPJMESA-N 2 0 355.457 4.082 20 0 FIADRP Clc1cc(Cl)c(OCC[NH2+]C2CCN(C3CC3)CC2)c(Cl)c1 ZINC000459423807 1100154180 /nfs/dbraw/zinc/15/41/80/1100154180.db2.gz JOLZRZPKQKSXOE-UHFFFAOYSA-N 2 0 363.716 4.242 20 0 FIADRP CCOc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc(Cl)c1O ZINC000459462307 1100207192 /nfs/dbraw/zinc/20/71/92/1100207192.db2.gz KUFXOCMCFVMZIA-ZBFHGGJFSA-N 2 0 366.933 4.187 20 0 FIADRP C[C@@H](CC[NH2+]C1CCN(c2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000379620519 1100219845 /nfs/dbraw/zinc/21/98/45/1100219845.db2.gz DCOCTEXWLPNEOS-FQEVSTJZSA-N 2 0 351.538 4.156 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1OC ZINC000379625509 1100222497 /nfs/dbraw/zinc/22/24/97/1100222497.db2.gz FTKGDRYMPCTUHC-ROUUACIJSA-N 2 0 356.510 4.265 20 0 FIADRP Fc1cc(-c2ccco2)ccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459505467 1100242950 /nfs/dbraw/zinc/24/29/50/1100242950.db2.gz OOZBJLVGEBNKQQ-UHFFFAOYSA-N 2 0 351.425 4.239 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000379628431 1100243899 /nfs/dbraw/zinc/24/38/99/1100243899.db2.gz JAOGPJPPFIUSTM-BBTUJRGHSA-N 2 0 366.505 4.162 20 0 FIADRP Fc1ccc(C2CC([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1Cl ZINC000459522999 1100271940 /nfs/dbraw/zinc/27/19/40/1100271940.db2.gz GOLXUMTWGFIHRC-UHFFFAOYSA-N 2 0 359.876 4.379 20 0 FIADRP CC(C)(C)CCOc1cnccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459562332 1100288512 /nfs/dbraw/zinc/28/85/12/1100288512.db2.gz BAKCGFSIMWUYCJ-UHFFFAOYSA-N 2 0 368.525 4.050 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc(F)c1 ZINC000536808288 1100308371 /nfs/dbraw/zinc/30/83/71/1100308371.db2.gz ZBSXCVBALUEJKJ-LJQANCHMSA-N 2 0 355.501 4.079 20 0 FIADRP CCN1CCC[C@@H](C[N@H+](C)C[C@H](C)c2ccc(F)cc2)[C@@H]1c1cnn(C)c1 ZINC000437982453 1100346978 /nfs/dbraw/zinc/34/69/78/1100346978.db2.gz ZGCPFGOYZLHZQO-LQBOVUBWSA-N 2 0 372.532 4.068 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@H]4CC[N@H+](C)C[C@@H]4C)cc3)ccc2O1 ZINC000536838072 1100348983 /nfs/dbraw/zinc/34/89/83/1100348983.db2.gz GNOJDLTZNSUSCX-JKSBSHDWSA-N 2 0 350.506 4.107 20 0 FIADRP CCSc1ccccc1[C@@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536858605 1100374332 /nfs/dbraw/zinc/37/43/32/1100374332.db2.gz QZTWFYIBZIMBPR-FGTMMUONSA-N 2 0 350.572 4.339 20 0 FIADRP COc1cccc2c1CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC000426022354 1100676770 /nfs/dbraw/zinc/67/67/70/1100676770.db2.gz NGBUQOWFMIPSDA-QIJUGHKUSA-N 2 0 364.533 4.053 20 0 FIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426031406 1100682702 /nfs/dbraw/zinc/68/27/02/1100682702.db2.gz RSTBAUQQBMLUJQ-NJYVYQBISA-N 2 0 357.929 4.481 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000506353691 1100910364 /nfs/dbraw/zinc/91/03/64/1100910364.db2.gz SEOXLCAXJQWHLU-UHFFFAOYSA-N 2 0 362.521 4.330 20 0 FIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1O ZINC000426158161 1100919981 /nfs/dbraw/zinc/91/99/81/1100919981.db2.gz AKKHJIWHPDXAFG-GOSISDBHSA-N 2 0 370.537 4.352 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439146966 1101201257 /nfs/dbraw/zinc/20/12/57/1101201257.db2.gz PGMFRFAHCOAVBB-MRXNPFEDSA-N 2 0 357.361 4.283 20 0 FIADRP Clc1cccc(CC2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CC2)c1 ZINC000459718202 1101341255 /nfs/dbraw/zinc/34/12/55/1101341255.db2.gz SEOAMPRISUBTNO-UHFFFAOYSA-N 2 0 355.913 4.316 20 0 FIADRP CC(C)[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000536998066 1101385579 /nfs/dbraw/zinc/38/55/79/1101385579.db2.gz DBGCSKMTFGTVAN-IBGZPJMESA-N 2 0 372.384 4.308 20 0 FIADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000459798845 1101390422 /nfs/dbraw/zinc/39/04/22/1101390422.db2.gz YCJMGZQJVDDEFX-MXWWQKGMSA-N 2 0 351.332 4.017 20 0 FIADRP c1ccc(COc2ccc(CC[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC000537108617 1101475379 /nfs/dbraw/zinc/47/53/79/1101475379.db2.gz BGSUPWRFEHCVGS-UHFFFAOYSA-N 2 0 364.533 4.272 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(Br)ccc2F)C1 ZINC000518763533 1101518390 /nfs/dbraw/zinc/51/83/90/1101518390.db2.gz UCCIDDZCUXABLI-CQSZACIVSA-N 2 0 357.311 4.190 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(OCC(F)(F)F)cc2)C1 ZINC000518765497 1101522964 /nfs/dbraw/zinc/52/29/64/1101522964.db2.gz FSGAPDSSKCCEET-IRXDYDNUSA-N 2 0 372.475 4.475 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[N@@H+]1C ZINC000537310120 1101640504 /nfs/dbraw/zinc/64/05/04/1101640504.db2.gz CYCANGWTQJOFAC-FUHWJXTLSA-N 2 0 366.534 4.173 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000325418992 1101799428 /nfs/dbraw/zinc/79/94/28/1101799428.db2.gz NGPUSZUJRWYCNL-NSHDSACASA-N 2 0 354.338 4.156 20 0 FIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000643462262 1101927813 /nfs/dbraw/zinc/92/78/13/1101927813.db2.gz SEZGQPXOFQXOSE-QUCCMNQESA-N 2 0 353.510 4.061 20 0 FIADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000519189553 1101997380 /nfs/dbraw/zinc/99/73/80/1101997380.db2.gz DJYYZIVJQXDJFF-MZYLBHOOSA-N 2 0 370.581 4.474 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(CC)cc2)CC1 ZINC000519225003 1102021737 /nfs/dbraw/zinc/02/17/37/1102021737.db2.gz JHCVJGKXPXKJHM-GOSISDBHSA-N 2 0 359.558 4.020 20 0 FIADRP Clc1cccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)s2)c1 ZINC000060979595 1102180457 /nfs/dbraw/zinc/18/04/57/1102180457.db2.gz ZVSMUHGWRZGKCL-UHFFFAOYSA-N 2 0 364.942 4.271 20 0 FIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000537630101 1102227860 /nfs/dbraw/zinc/22/78/60/1102227860.db2.gz MPEBJWJHPYNULN-UHFFFAOYSA-N 2 0 362.514 4.097 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000415020834 1102263599 /nfs/dbraw/zinc/26/35/99/1102263599.db2.gz XTAFVHBVLCKEAX-GFCCVEGCSA-N 2 0 357.445 4.436 20 0 FIADRP COCCC1([NH3+])CC[NH+](C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168341507 1102330935 /nfs/dbraw/zinc/33/09/35/1102330935.db2.gz MLJPCAWGYYABQY-UHFFFAOYSA-N 2 0 350.934 4.196 20 0 FIADRP Cc1cc([C@@H]2CCC[NH+]2CCCCC[N@H+]2CCC[C@H]2c2cc(C)no2)on1 ZINC000532474692 1102404076 /nfs/dbraw/zinc/40/40/76/1102404076.db2.gz ZYUXUMCISUTDQP-OALUTQOASA-N 2 0 372.513 4.424 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)C1 ZINC000550827156 1102475374 /nfs/dbraw/zinc/47/53/74/1102475374.db2.gz LERYXOUHYVSUFB-HXUWFJFHSA-N 2 0 374.532 4.359 20 0 FIADRP C[C@@H](COc1ccc(F)cc1F)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000152274658 1102506053 /nfs/dbraw/zinc/50/60/53/1102506053.db2.gz YTZRLHDSPHZUOE-HNNXBMFYSA-N 2 0 352.469 4.119 20 0 FIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000122297509 1102560982 /nfs/dbraw/zinc/56/09/82/1102560982.db2.gz KVYBYJQVWUXPEH-OAHLLOKOSA-N 2 0 361.555 4.366 20 0 FIADRP COc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)ccc1OCc1ccccc1 ZINC000506850294 1102578113 /nfs/dbraw/zinc/57/81/13/1102578113.db2.gz FUSJXRVMACAURK-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)ccn1 ZINC000550885011 1102656494 /nfs/dbraw/zinc/65/64/94/1102656494.db2.gz BCHDUIVSWYMRGK-GOSISDBHSA-N 2 0 353.510 4.173 20 0 FIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cnc(-c3ccc(C)cc3)s2)C1 ZINC000537649019 1102688164 /nfs/dbraw/zinc/68/81/64/1102688164.db2.gz BHSOWANPNQXUCR-LJQANCHMSA-N 2 0 373.566 4.051 20 0 FIADRP Cc1cc(NC2CC[NH+](Cc3ccccn3)CC2)c2cc(F)ccc2[nH+]1 ZINC000121566249 1102717726 /nfs/dbraw/zinc/71/77/26/1102717726.db2.gz JHGUIHHMFSPTIT-UHFFFAOYSA-N 2 0 350.441 4.154 20 0 FIADRP COc1cccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167977809 1102733540 /nfs/dbraw/zinc/73/35/40/1102733540.db2.gz FPANDPRYVIGXOZ-SEJPIABJSA-N 2 0 354.538 4.013 20 0 FIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953903 1102749463 /nfs/dbraw/zinc/74/94/63/1102749463.db2.gz KQKCZJQEGZYBSL-MRXNPFEDSA-N 2 0 369.372 4.181 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)OCCCO2 ZINC000123074850 1102764976 /nfs/dbraw/zinc/76/49/76/1102764976.db2.gz GWMVNEWBMUWBPP-GOSISDBHSA-N 2 0 366.505 4.295 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[NH+](C)C)cc1 ZINC000551014270 1102790407 /nfs/dbraw/zinc/79/04/07/1102790407.db2.gz QVTVMSDUIKGDRF-ZRBLBEILSA-N 2 0 351.538 4.023 20 0 FIADRP Cc1ccc(-c2cccc(C[N@H+]3CCO[C@@H]4C[C@@H]([NH+](C)C)CC[C@H]43)c2)cc1 ZINC000537692739 1102871680 /nfs/dbraw/zinc/87/16/80/1102871680.db2.gz MGKFADMEAGMBQX-RBZQAINGSA-N 2 0 364.533 4.346 20 0 FIADRP Cc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc1Oc1cccnc1 ZINC000506866402 1102917939 /nfs/dbraw/zinc/91/79/39/1102917939.db2.gz IHABBIVPWQTMEP-UHFFFAOYSA-N 2 0 365.521 4.490 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC1CCC(F)(F)CC1 ZINC000459365911 1102930885 /nfs/dbraw/zinc/93/08/85/1102930885.db2.gz BWHBPGLZIAPBML-UHFFFAOYSA-N 2 0 351.485 4.445 20 0 FIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000551201902 1102976394 /nfs/dbraw/zinc/97/63/94/1102976394.db2.gz RUVSARCYYMNYFO-UHFFFAOYSA-N 2 0 371.956 4.124 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCCNc2ccccn2)CC1 ZINC000551267642 1103028892 /nfs/dbraw/zinc/02/88/92/1103028892.db2.gz HDAMXBRLHJHIRC-UHFFFAOYSA-N 2 0 366.553 4.307 20 0 FIADRP Clc1cc(C[NH2+]CCCCCCC[NH+]2CCCC2)cc2c1OCCO2 ZINC000729682357 1103036893 /nfs/dbraw/zinc/03/68/93/1103036893.db2.gz SJJZAXWDNTVZBT-UHFFFAOYSA-N 2 0 366.933 4.247 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000729682779 1103049623 /nfs/dbraw/zinc/04/96/23/1103049623.db2.gz KSQZGAGSNLUAEZ-JOCHJYFZSA-N 2 0 352.522 4.476 20 0 FIADRP CN(c1ccccc1C[N@@H+]1CC[C@@H](c2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000507082068 1103103676 /nfs/dbraw/zinc/10/36/76/1103103676.db2.gz ALCNFDHYTGXSQF-OAQYLSRUSA-N 2 0 363.549 4.207 20 0 FIADRP COc1ncc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000551541724 1103321731 /nfs/dbraw/zinc/32/17/31/1103321731.db2.gz WBRAOXTZXCRARQ-OAHLLOKOSA-N 2 0 359.901 4.190 20 0 FIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000507441137 1103373922 /nfs/dbraw/zinc/37/39/22/1103373922.db2.gz KGUTUKHDOKIQHX-KRWDZBQOSA-N 2 0 351.332 4.222 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cccc(Cl)c3F)cc2)CC1 ZINC000551576008 1103387131 /nfs/dbraw/zinc/38/71/31/1103387131.db2.gz COVLTUDVDSSRKX-UHFFFAOYSA-N 2 0 362.876 4.242 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+]CCc4ccc5ccccc5n4)[C@H]3C2)cc1 ZINC000507519020 1103463945 /nfs/dbraw/zinc/46/39/45/1103463945.db2.gz GQZBXBDWPMVYMT-UMXIMWEHSA-N 2 0 371.528 4.278 20 0 FIADRP Cc1ccsc1[C@H](CO)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000519780534 1103865928 /nfs/dbraw/zinc/86/59/28/1103865928.db2.gz XTGHCXZOPGZLER-MHJFOBGBSA-N 2 0 358.551 4.123 20 0 FIADRP C[N@H+](CCSc1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537846096 1103967655 /nfs/dbraw/zinc/96/76/55/1103967655.db2.gz ZQBMRJGXIAPLIN-UHFFFAOYSA-N 2 0 355.551 4.412 20 0 FIADRP COC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000538206174 1104048631 /nfs/dbraw/zinc/04/86/31/1104048631.db2.gz GZSSZVKAYYMOIN-FTRWYGJKSA-N 2 0 354.485 4.000 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(CC)(CC)c2ccc(OC)c(OC)c2)[C@@H](C)C1 ZINC000461081811 1104082559 /nfs/dbraw/zinc/08/25/59/1104082559.db2.gz BOIFXYPHOITUCJ-PKOBYXMFSA-N 2 0 362.558 4.082 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2)C2CCCCC2)CC1 ZINC000538274876 1104095092 /nfs/dbraw/zinc/09/50/92/1104095092.db2.gz LHMRDEFVAJUDST-QHCPKHFHSA-N 2 0 357.586 4.315 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cn(C)nc2C(C)(C)C)CC1 ZINC000538305436 1104126567 /nfs/dbraw/zinc/12/65/67/1104126567.db2.gz SZOYQYMZUJKQME-SFHVURJKSA-N 2 0 360.590 4.194 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4c3OCO4)cc2)C1 ZINC000520205081 1104170938 /nfs/dbraw/zinc/17/09/38/1104170938.db2.gz SGDOYEYKKLBZGE-HDICACEKSA-N 2 0 366.505 4.183 20 0 FIADRP COc1ccccc1/C=C/C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000520210392 1104177289 /nfs/dbraw/zinc/17/72/89/1104177289.db2.gz LUYLQKOQQNQXOK-UKTHLTGXSA-N 2 0 350.506 4.484 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCCSc1ccccc1Cl ZINC000441201916 1104195836 /nfs/dbraw/zinc/19/58/36/1104195836.db2.gz FRZMIDHCFUCRDJ-BPQIPLTHSA-N 2 0 368.974 4.006 20 0 FIADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000520343992 1104284864 /nfs/dbraw/zinc/28/48/64/1104284864.db2.gz SRLYFAANSNFWQJ-PZJWPPBQSA-N 2 0 358.570 4.330 20 0 FIADRP Clc1ccc(SCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441397526 1104329610 /nfs/dbraw/zinc/32/96/10/1104329610.db2.gz WSNYSMXVGLJFSA-DNVCBOLYSA-N 2 0 350.959 4.381 20 0 FIADRP c1cc(S[C@@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)ccn1 ZINC001167995520 1104516782 /nfs/dbraw/zinc/51/67/82/1104516782.db2.gz IQCXEKRJFJFUQM-KXZRCVDZSA-N 2 0 357.567 4.044 20 0 FIADRP c1ccc2c(c1)cccc2OCCC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441451900 1104741046 /nfs/dbraw/zinc/74/10/46/1104741046.db2.gz OIZOFPFOJJSSDR-FQEVSTJZSA-N 2 0 352.522 4.417 20 0 FIADRP c1ccc2cc(OCCC[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441466343 1104800746 /nfs/dbraw/zinc/80/07/46/1104800746.db2.gz NFDJJLQMAFVJJN-HXUWFJFHSA-N 2 0 352.522 4.417 20 0 FIADRP CCc1nc2ccccc2n1C1CC[NH+](CCCC2CC[NH2+]CC2)CC1 ZINC000647989906 1104968012 /nfs/dbraw/zinc/96/80/12/1104968012.db2.gz COMPYYGGYWWPTQ-UHFFFAOYSA-N 2 0 354.542 4.015 20 0 FIADRP COc1cccc(C[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001168003024 1104993862 /nfs/dbraw/zinc/99/38/62/1104993862.db2.gz ILCQRFFVRASRBX-JYEDNEFCSA-N 2 0 368.565 4.355 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(OCc2ccccc2)c1 ZINC000152366675 1105035289 /nfs/dbraw/zinc/03/52/89/1105035289.db2.gz ATLUSEQOOUXYDE-UYAOXDASSA-N 2 0 350.506 4.401 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ncc(Br)cc1F ZINC000427604219 1105044682 /nfs/dbraw/zinc/04/46/82/1105044682.db2.gz OEVCOYGXUQZREK-KGLIPLIRSA-N 2 0 372.326 4.288 20 0 FIADRP C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1OCc1ccccc1 ZINC000152404250 1105087341 /nfs/dbraw/zinc/08/73/41/1105087341.db2.gz VEFFDCGSLILGOV-QUCCMNQESA-N 2 0 350.506 4.401 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000152403801 1105087506 /nfs/dbraw/zinc/08/75/06/1105087506.db2.gz ASSJRXROJLXILO-AUSIDOKSSA-N 2 0 350.506 4.053 20 0 FIADRP Cc1cccnc1CCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006565 1105112810 /nfs/dbraw/zinc/11/28/10/1105112810.db2.gz NQEQHMNVJHTFME-PMACEKPBSA-N 2 0 351.538 4.354 20 0 FIADRP COC(=O)CCCCCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006750 1105117028 /nfs/dbraw/zinc/11/70/28/1105117028.db2.gz OPJWCKPARDJUHU-CEQLMSFQSA-N 2 0 360.542 4.141 20 0 FIADRP C[C@@H]1CC(NC(=[NH2+])c2cc(F)cc(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168007283 1105130827 /nfs/dbraw/zinc/13/08/27/1105130827.db2.gz ADZCJJOZQJXOHV-HUUCEWRRSA-N 2 0 357.448 4.321 20 0 FIADRP CCc1noc(C)c1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000536484414 1105164703 /nfs/dbraw/zinc/16/47/03/1105164703.db2.gz COEHKAQHPXLEOR-UHFFFAOYSA-N 2 0 353.510 4.034 20 0 FIADRP C[C@H]1CC(n2c3ccccc3nc2CC[NH3+])C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008466 1105196176 /nfs/dbraw/zinc/19/61/76/1105196176.db2.gz DYWHMRVAPDHWAO-ROUUACIJSA-N 2 0 362.521 4.152 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000507817186 1105203391 /nfs/dbraw/zinc/20/33/91/1105203391.db2.gz WTVJFRMHOVCTBU-UHFFFAOYSA-N 2 0 372.509 4.395 20 0 FIADRP Clc1cc(Cl)cc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000665228787 1105224437 /nfs/dbraw/zinc/22/44/37/1105224437.db2.gz HFWYKTJTHMSLCB-MJGOQNOKSA-N 2 0 363.288 4.339 20 0 FIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(C)C ZINC000427699419 1105251261 /nfs/dbraw/zinc/25/12/61/1105251261.db2.gz XIUDQQZZXOJRMO-SJORKVTESA-N 2 0 357.464 4.434 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000508204652 1105358526 /nfs/dbraw/zinc/35/85/26/1105358526.db2.gz IHDBRZNQAMWRHO-XWSJACJDSA-N 2 0 357.542 4.118 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4cccc(-c5cccnc5)c4)C[C@@H]3C2)cc1 ZINC000475351391 1106741745 /nfs/dbraw/zinc/74/17/45/1106741745.db2.gz GGXYALGGIRRGRZ-PLQXJYEYSA-N 2 0 369.512 4.312 20 0 FIADRP CCc1cc(CCC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)on1 ZINC000451063948 1106906502 /nfs/dbraw/zinc/90/65/02/1106906502.db2.gz HQUKYNKCLYAUMU-UHFFFAOYSA-N 2 0 367.537 4.158 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c2ccccc21 ZINC000530209563 1106913438 /nfs/dbraw/zinc/91/34/38/1106913438.db2.gz IQJYJOGXNSFYNN-WOJBJXKFSA-N 2 0 366.509 4.127 20 0 FIADRP Clc1ccc(N2CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c(Cl)c1 ZINC000530440648 1107042170 /nfs/dbraw/zinc/04/21/70/1107042170.db2.gz CWGODASZHZPYPI-QGZVFWFLSA-N 2 0 368.352 4.036 20 0 FIADRP Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301717552 1107121531 /nfs/dbraw/zinc/12/15/31/1107121531.db2.gz ODMBNSLSMVARSU-KBXCAEBGSA-N 2 0 361.436 4.065 20 0 FIADRP Cc1cc(NCc2ccccc2C[NH+]2CCC(O)CC2)c2ccccc2[nH+]1 ZINC000301790821 1107150967 /nfs/dbraw/zinc/15/09/67/1107150967.db2.gz WNSXUBJMGQCKHW-UHFFFAOYSA-N 2 0 361.489 4.112 20 0 FIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152434100 1107436773 /nfs/dbraw/zinc/43/67/73/1107436773.db2.gz KZVGBAQAQQCUGX-FDDCHVKYSA-N 2 0 368.496 4.192 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000152455249 1107719077 /nfs/dbraw/zinc/71/90/77/1107719077.db2.gz RVWISXDVBIFTQH-GOEBONIOSA-N 2 0 371.550 4.262 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)nc1 ZINC000179106727 1107874205 /nfs/dbraw/zinc/87/42/05/1107874205.db2.gz BELHCHBYUWGYDM-MRXNPFEDSA-N 2 0 361.917 4.306 20 0 FIADRP COc1ccc(OC)c(CC[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000531700255 1108078595 /nfs/dbraw/zinc/07/85/95/1108078595.db2.gz ABDOJZZEIZLWJB-INIZCTEOSA-N 2 0 365.477 4.091 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c2nccn21 ZINC000453105696 1108174422 /nfs/dbraw/zinc/17/44/22/1108174422.db2.gz FWKNQNOPFCLPQF-DENIHFKCSA-N 2 0 366.553 4.213 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CCOC4(CCC4)C3)[C@@H]3CCC[C@@H]32)cc1 ZINC000453155339 1108223965 /nfs/dbraw/zinc/22/39/65/1108223965.db2.gz BASAEAOBKMMIDY-MLNNCEHLSA-N 2 0 354.538 4.121 20 0 FIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453164079 1108234631 /nfs/dbraw/zinc/23/46/31/1108234631.db2.gz QQDZWZGEDVSFGY-NJDAHSKKSA-N 2 0 362.945 4.149 20 0 FIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453171627 1108245805 /nfs/dbraw/zinc/24/58/05/1108245805.db2.gz MNZCYZXXGGYSMO-IDZYALCFSA-N 2 0 367.537 4.428 20 0 FIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c2sccc21 ZINC000453197029 1108267090 /nfs/dbraw/zinc/26/70/90/1108267090.db2.gz MSFCCULGYPBWHB-PBEJRMEISA-N 2 0 370.562 4.433 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccccc1C[NH+](C)C1CCCCC1 ZINC000531939141 1108416840 /nfs/dbraw/zinc/41/68/40/1108416840.db2.gz XOKDIVRYBJYSGO-PWHSHALESA-N 3 0 357.586 4.269 20 0 FIADRP CCCCc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000531941714 1108419709 /nfs/dbraw/zinc/41/97/09/1108419709.db2.gz QZBFKWXWAOJFJE-IBGZPJMESA-N 2 0 366.553 4.027 20 0 FIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000531965176 1108460791 /nfs/dbraw/zinc/46/07/91/1108460791.db2.gz RAGWMWMROQNHQQ-VXKWHMMOSA-N 2 0 371.956 4.369 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)ccc1OC ZINC000453388514 1108473759 /nfs/dbraw/zinc/47/37/59/1108473759.db2.gz WOFFGNZOKRUJKD-PGRDOPGGSA-N 2 0 360.542 4.101 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000531969861 1108475947 /nfs/dbraw/zinc/47/59/47/1108475947.db2.gz LUVOPMMAOJRKDJ-ZFGGDYGUSA-N 3 0 371.613 4.040 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCSc2ccc(Br)cc21)C1CC1 ZINC000453410829 1108509750 /nfs/dbraw/zinc/50/97/50/1108509750.db2.gz VJGOMVSZLFNRCK-INIZCTEOSA-N 2 0 369.372 4.450 20 0 FIADRP Cc1cc(Br)c(C[NH2+]Cc2cccc(C[NH+](C)C)c2)s1 ZINC000453570367 1108600951 /nfs/dbraw/zinc/60/09/51/1108600951.db2.gz KHANBOABAQHEOX-UHFFFAOYSA-N 2 0 353.329 4.170 20 0 FIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000532193182 1108701992 /nfs/dbraw/zinc/70/19/92/1108701992.db2.gz POZQRNXCZVCVGI-OALUTQOASA-N 3 0 354.542 4.343 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000532215507 1108716782 /nfs/dbraw/zinc/71/67/82/1108716782.db2.gz BFIZLBVIFCTQDK-MSOLQXFVSA-N 2 0 355.501 4.379 20 0 FIADRP Fc1ccc(CC[NH+]2CCC(N[C@H]3CSc4ccccc43)CC2)cc1 ZINC000532223085 1108720121 /nfs/dbraw/zinc/72/01/21/1108720121.db2.gz QXYAAUODKZTWIH-FQEVSTJZSA-N 2 0 356.510 4.269 20 0 FIADRP CN(c1ccccc1C[NH2+]CCSc1ccccc1)C1CC[NH+](C)CC1 ZINC000532361570 1108771029 /nfs/dbraw/zinc/77/10/29/1108771029.db2.gz SDKYLWYEYFUVLG-UHFFFAOYSA-N 2 0 369.578 4.099 20 0 FIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccc4ccccc4c3)CC2)C[C@@H](C)O1 ZINC000524812107 1109161565 /nfs/dbraw/zinc/16/15/65/1109161565.db2.gz OMWYUTXFAYSGLR-RTBURBONSA-N 2 0 352.522 4.161 20 0 FIADRP CN(C)c1ccccc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000525183075 1109293605 /nfs/dbraw/zinc/29/36/05/1109293605.db2.gz BOIFCNAXBGFYFT-UHFFFAOYSA-N 2 0 363.505 4.267 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000525183662 1109294100 /nfs/dbraw/zinc/29/41/00/1109294100.db2.gz POMDXMLDXBYDKJ-UHFFFAOYSA-N 2 0 360.461 4.078 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@H](C)c3ccc4ccccc4c3)C2)CC1 ZINC000525267306 1109324942 /nfs/dbraw/zinc/32/49/42/1109324942.db2.gz NGQUMVROUFAXFK-XXBNENTESA-N 2 0 351.538 4.001 20 0 FIADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446840697 1109361463 /nfs/dbraw/zinc/36/14/63/1109361463.db2.gz HYDQMINRONCJSO-INIZCTEOSA-N 2 0 359.739 4.485 20 0 FIADRP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446913757 1109388523 /nfs/dbraw/zinc/38/85/23/1109388523.db2.gz HXFXUETUKJZUOO-UHFFFAOYSA-N 2 0 366.553 4.134 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446938447 1109396090 /nfs/dbraw/zinc/39/60/90/1109396090.db2.gz ISHVNTZDOPYZPA-KRWDZBQOSA-N 2 0 369.734 4.405 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@@H]1CCOc2ccc(F)cc21 ZINC000525858456 1109541241 /nfs/dbraw/zinc/54/12/41/1109541241.db2.gz PMIUEFAWHVRUAM-MAODMQOUSA-N 2 0 354.469 4.150 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(C(F)F)cc3)cc2)CC1 ZINC000525980924 1109580528 /nfs/dbraw/zinc/58/05/28/1109580528.db2.gz QJEVDOYCOUBWIY-UHFFFAOYSA-N 2 0 373.491 4.052 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1F ZINC000447582584 1109585336 /nfs/dbraw/zinc/58/53/36/1109585336.db2.gz XEGJWSVZJSNHCI-LBPRGKRZSA-N 2 0 355.295 4.113 20 0 FIADRP Fc1ccc2c(c1)[C@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000447596566 1109591287 /nfs/dbraw/zinc/59/12/87/1109591287.db2.gz CSEOOJHMAMUUJE-RCLSDMTESA-N 2 0 352.453 4.044 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000508605164 1109605524 /nfs/dbraw/zinc/60/55/24/1109605524.db2.gz RXVRMVURJYRYFV-OTWHNJEPSA-N 2 0 357.542 4.118 20 0 FIADRP FC(F)c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000527518672 1109772802 /nfs/dbraw/zinc/77/28/02/1109772802.db2.gz HWHCRDIOXPPBMD-UHFFFAOYSA-N 2 0 360.448 4.389 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccnn2-c2ccccc2)CC1 ZINC000448346356 1109778335 /nfs/dbraw/zinc/77/83/35/1109778335.db2.gz XSVPGZIGMUWENC-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4cc[nH]c4c3)cc2)C[C@H](C)O1 ZINC000527634045 1109790919 /nfs/dbraw/zinc/79/09/19/1109790919.db2.gz JAXTWIHBFBALOM-HDICACEKSA-N 2 0 363.505 4.067 20 0 FIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)cc1OC ZINC000527633871 1109791072 /nfs/dbraw/zinc/79/10/72/1109791072.db2.gz YRBXREFMKMSRBL-UHFFFAOYSA-N 2 0 372.484 4.119 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CCC[C@@H](c4ccccc4)CC3)CC2)CC1 ZINC000527651174 1109795862 /nfs/dbraw/zinc/79/58/62/1109795862.db2.gz UBARSTHTNWSPSS-FGZHOGPDSA-N 2 0 369.597 4.251 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527672567 1109800736 /nfs/dbraw/zinc/80/07/36/1109800736.db2.gz AWJJYVFHJDWKCA-BAMDZGJYSA-N 2 0 356.554 4.070 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCc3cc(F)c(Cl)cc32)c1 ZINC000527854869 1109839820 /nfs/dbraw/zinc/83/98/20/1109839820.db2.gz WLVMJOWDASDDET-FQEVSTJZSA-N 2 0 362.876 4.197 20 0 FIADRP CC(C)c1cccc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c1 ZINC000527859420 1109840621 /nfs/dbraw/zinc/84/06/21/1109840621.db2.gz QKJZGNOWUSRFIM-GBXCKJPGSA-N 2 0 365.565 4.449 20 0 FIADRP CC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000527860804 1109841568 /nfs/dbraw/zinc/84/15/68/1109841568.db2.gz YDHXBEGPGXYEST-HSZRJFAPSA-N 2 0 366.549 4.144 20 0 FIADRP CC(C)c1cccc([C@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000527897331 1109853302 /nfs/dbraw/zinc/85/33/02/1109853302.db2.gz GFLIJMAIIRHOOB-SFHVURJKSA-N 2 0 355.526 4.386 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCOC2)cc1C[NH+]1CCCCC1 ZINC000527933527 1109870313 /nfs/dbraw/zinc/87/03/13/1109870313.db2.gz VMAZYFUVVTWXTR-RTBURBONSA-N 2 0 360.542 4.148 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000449108493 1109977234 /nfs/dbraw/zinc/97/72/34/1109977234.db2.gz RFCPHMKEAURNSN-FQEVSTJZSA-N 2 0 373.544 4.463 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CC(c3ccc(Br)cc3F)C2)C1 ZINC000449092103 1109978817 /nfs/dbraw/zinc/97/88/17/1109978817.db2.gz LHGMOZBZCZCZFW-VQCLRJIVSA-N 2 0 369.322 4.156 20 0 FIADRP COc1ccc(CC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)cc1F ZINC000449121430 1109980449 /nfs/dbraw/zinc/98/04/49/1109980449.db2.gz HSIFSULHJMAFJM-GOSISDBHSA-N 2 0 370.512 4.062 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+]C3CCC(OC4CCCC4)CC3)C2)cc1 ZINC000449123548 1109980917 /nfs/dbraw/zinc/98/09/17/1109980917.db2.gz NODYKDZIUJKRSN-ZLHNRXBCSA-N 2 0 370.581 4.411 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2CCOC3(CCC3)C2)CC1 ZINC000449130413 1109981733 /nfs/dbraw/zinc/98/17/33/1109981733.db2.gz YWZZVBVAHBBZOM-IBGZPJMESA-N 2 0 362.945 4.243 20 0 FIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449131623 1109982407 /nfs/dbraw/zinc/98/24/07/1109982407.db2.gz OIXQRUYDMCKXJZ-RTBURBONSA-N 2 0 352.522 4.008 20 0 FIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449148528 1109985516 /nfs/dbraw/zinc/98/55/16/1109985516.db2.gz KJCVAKFGOKYGBP-NHCUHLMSSA-N 2 0 362.945 4.102 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(CCO)CCCCC2)CC1 ZINC000449175816 1109989133 /nfs/dbraw/zinc/98/91/33/1109989133.db2.gz RTFOMXXWSUWWRR-FQEVSTJZSA-N 2 0 358.570 4.005 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@@H]2CCCC[C@H]2O)CC1 ZINC000449190539 1109991613 /nfs/dbraw/zinc/99/16/13/1109991613.db2.gz JELLHIIMBQBIFM-UNWVZKJWSA-N 2 0 358.570 4.003 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)CC1 ZINC000449216079 1109999253 /nfs/dbraw/zinc/99/92/53/1109999253.db2.gz ZZGSZAHLQKZQFQ-RLLPEYFOSA-N 2 0 368.565 4.019 20 0 FIADRP Cc1cnc([C@@H](C)C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)s1 ZINC000449240596 1110009657 /nfs/dbraw/zinc/00/96/57/1110009657.db2.gz ZSPBSYHQSKVKMU-DLBZAZTESA-N 2 0 357.567 4.240 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)CC1 ZINC000449247457 1110011740 /nfs/dbraw/zinc/01/17/40/1110011740.db2.gz GIZDJKLDOPSHNV-DENIHFKCSA-N 2 0 350.591 4.460 20 0 FIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cnc(-c4ccccc4F)s3)C2)CC1 ZINC000449326554 1110026723 /nfs/dbraw/zinc/02/67/23/1110026723.db2.gz XDMJLGJMMUOZMR-MRXNPFEDSA-N 2 0 359.514 4.113 20 0 FIADRP CC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000449342833 1110034679 /nfs/dbraw/zinc/03/46/79/1110034679.db2.gz FPURWCPKRWRPQF-YADHBBJMSA-N 2 0 356.554 4.084 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCc2c(F)cc(F)cc21 ZINC000449353166 1110047280 /nfs/dbraw/zinc/04/72/80/1110047280.db2.gz YRAFTTAMUDXESK-HXUWFJFHSA-N 2 0 354.404 4.021 20 0 FIADRP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3CSc4ccccc43)CC2)cc1 ZINC000449363543 1110049741 /nfs/dbraw/zinc/04/97/41/1110049741.db2.gz MHSNOVAYFGPSSK-LJQANCHMSA-N 2 0 352.547 4.173 20 0 FIADRP CC1(C)C[N@H+](CC[C@@H]2CCOC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449414241 1110055985 /nfs/dbraw/zinc/05/59/85/1110055985.db2.gz LRRNHBRZZNUNIZ-IRLDBZIGSA-N 2 0 356.554 4.036 20 0 FIADRP CC1(C)C[N@H+](C[C@@H]2CCCOC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449416287 1110056885 /nfs/dbraw/zinc/05/68/85/1110056885.db2.gz SQPOOKRHOLIBJF-RBBKRZOGSA-N 2 0 356.554 4.036 20 0 FIADRP CC(C)n1cc(C2=CCC[N@@H+](C3CC[NH+](C4CCCCC4)CC3)CC2)nn1 ZINC000449476523 1110084403 /nfs/dbraw/zinc/08/44/03/1110084403.db2.gz ZQMIPFUIHVZNMO-UHFFFAOYSA-N 2 0 371.573 4.135 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@@H]4CCOC5(CCC5)C4)[C@H]3C2)cc1 ZINC000449478403 1110085204 /nfs/dbraw/zinc/08/52/04/1110085204.db2.gz KCKOWOICXAGURL-LDVJMBRRSA-N 2 0 368.565 4.226 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000449542305 1110100639 /nfs/dbraw/zinc/10/06/39/1110100639.db2.gz QEPOCGOZVGMBBX-FGZHOGPDSA-N 2 0 367.537 4.050 20 0 FIADRP Cc1cc(Br)c(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1Cl ZINC000449560295 1110111161 /nfs/dbraw/zinc/11/11/61/1110111161.db2.gz IZXHBKPUXAJLHQ-AGUYFDCRSA-N 2 0 357.723 4.126 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccccc2)CC1 ZINC000538409033 1111129806 /nfs/dbraw/zinc/12/98/06/1111129806.db2.gz AUTFZFKDQKJTMX-RJGXRXQPSA-N 2 0 356.554 4.275 20 0 FIADRP Oc1cccc(-c2ccc([C@H]3C[C@@H]3[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)c1 ZINC001168359659 1111316935 /nfs/dbraw/zinc/31/69/35/1111316935.db2.gz DPUAAIPOTJZHBF-RPWUZVMVSA-N 2 0 362.517 4.379 20 0 FIADRP CCN1CCC([NH2+][C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000461800708 1111367961 /nfs/dbraw/zinc/36/79/61/1111367961.db2.gz BEXXKPUQRFRGML-SFHVURJKSA-N 2 0 368.521 4.409 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000539056875 1111404088 /nfs/dbraw/zinc/40/40/88/1111404088.db2.gz DDVKZOODWLPXMP-NMNUPHIUSA-N 2 0 374.569 4.140 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Br)c2)CCCC1 ZINC000539062131 1111408110 /nfs/dbraw/zinc/40/81/10/1111408110.db2.gz SXRXXFPVHANDKL-QAPCUYQASA-N 2 0 365.359 4.191 20 0 FIADRP Cc1cc([C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C2CC2)ccc1F ZINC000539159013 1111461877 /nfs/dbraw/zinc/46/18/77/1111461877.db2.gz CYHMIBBLOJMFSX-QFIPXVFZSA-N 2 0 356.485 4.315 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)C(C)C)cc1 ZINC000539215296 1111478851 /nfs/dbraw/zinc/47/88/51/1111478851.db2.gz LOQCTLNOIKTWRY-DNVJHFABSA-N 2 0 358.570 4.304 20 0 FIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)ccn1 ZINC000539217654 1111479652 /nfs/dbraw/zinc/47/96/52/1111479652.db2.gz OIHOIQOCQFHJKE-JOCHJYFZSA-N 2 0 371.500 4.182 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC2(C(=O)Nc3ccc(C)c(C)c3)CCCC2)CC1 ZINC000462120736 1111505029 /nfs/dbraw/zinc/50/50/29/1111505029.db2.gz LEKXHUVNRPHJIM-UHFFFAOYSA-N 2 0 371.569 4.266 20 0 FIADRP COC[C@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)c1ccc(F)c(F)c1 ZINC000539316837 1111510536 /nfs/dbraw/zinc/51/05/36/1111510536.db2.gz IYBLYFTWHXFMOA-FQEVSTJZSA-N 2 0 354.485 4.000 20 0 FIADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000552056189 1111559955 /nfs/dbraw/zinc/55/99/55/1111559955.db2.gz VWGDNNFWMGWYJE-YFNKSVMNSA-N 2 0 363.549 4.213 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)CC1 ZINC000552067385 1111565472 /nfs/dbraw/zinc/56/54/72/1111565472.db2.gz IGUTUHUGTUSKFG-BWWMBTDCSA-N 2 0 356.554 4.224 20 0 FIADRP CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000552087477 1111569540 /nfs/dbraw/zinc/56/95/40/1111569540.db2.gz JHRIZYDTVDCJJE-AJSBUHFISA-N 2 0 356.554 4.334 20 0 FIADRP Clc1cc2[nH]cc(CC[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)c2c(Cl)c1 ZINC000477867462 1111583551 /nfs/dbraw/zinc/58/35/51/1111583551.db2.gz UCWSHUSEOJQNHC-CABCVRRESA-N 2 0 352.309 4.234 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)CC1 ZINC000477945665 1111617324 /nfs/dbraw/zinc/61/73/24/1111617324.db2.gz YLGWZTLKVIWUEB-CVNLYIMZSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000552527116 1111738345 /nfs/dbraw/zinc/73/83/45/1111738345.db2.gz YZMNLSBCSYFWOF-FQEVSTJZSA-N 2 0 371.569 4.057 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(CN2CCOCC2)cc1)c1cc(F)ccc1F ZINC000479356501 1111997199 /nfs/dbraw/zinc/99/71/99/1111997199.db2.gz GJXAMZKCXPERTL-JOCHJYFZSA-N 2 0 374.475 4.284 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000479381487 1112005105 /nfs/dbraw/zinc/00/51/05/1112005105.db2.gz BAUIEMNXWLCHKV-NRFANRHFSA-N 2 0 355.526 4.213 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(F)ccc1F ZINC000479438047 1112023130 /nfs/dbraw/zinc/02/31/30/1112023130.db2.gz NRSRHHFKXQTKGD-DENIHFKCSA-N 2 0 374.475 4.018 20 0 FIADRP COC1CCC(C)(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000479450349 1112027736 /nfs/dbraw/zinc/02/77/36/1112027736.db2.gz FKIWAIXBOXIQBG-MATYFGLISA-N 2 0 356.554 4.367 20 0 FIADRP Fc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479460998 1112032394 /nfs/dbraw/zinc/03/23/94/1112032394.db2.gz AGNNTGHITLJLQP-WIYYLYMNSA-N 2 0 354.469 4.151 20 0 FIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H](C[C@H]3CCOC3)c3ccccc3)C2)cc1 ZINC000479462536 1112032889 /nfs/dbraw/zinc/03/28/89/1112032889.db2.gz GHJDIKSZNREOAQ-AKFKNWHVSA-N 2 0 364.533 4.266 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000479464291 1112034835 /nfs/dbraw/zinc/03/48/35/1112034835.db2.gz LPCSBUDWUKUGQD-CTNGQTDRSA-N 2 0 360.505 4.045 20 0 FIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466323 1112041664 /nfs/dbraw/zinc/04/16/64/1112041664.db2.gz RNJXXHOVNAUDEW-IFMALSPDSA-N 2 0 350.506 4.320 20 0 FIADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000479491367 1112044586 /nfs/dbraw/zinc/04/45/86/1112044586.db2.gz PYDCPJXRKNYDQI-LEOMRAHMSA-N 2 0 356.407 4.208 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000479491492 1112044673 /nfs/dbraw/zinc/04/46/73/1112044673.db2.gz SMFYNUATDXAAAA-OPAMFIHVSA-N 2 0 356.485 4.494 20 0 FIADRP COc1c(Br)cccc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000479547086 1112065320 /nfs/dbraw/zinc/06/53/20/1112065320.db2.gz APHWUFLCDWDFQA-OAHLLOKOSA-N 2 0 369.347 4.059 20 0 FIADRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1ccc(OCc2cccnc2)cc1 ZINC000479778507 1112132964 /nfs/dbraw/zinc/13/29/64/1112132964.db2.gz KHAQMMYBIKNZEV-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1nnn(-c2ccc(C)cc2)c1C ZINC000479764503 1112135069 /nfs/dbraw/zinc/13/50/69/1112135069.db2.gz GWMLICSZNQWQBS-QZTJIDSGSA-N 2 0 357.546 4.045 20 0 FIADRP CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000480062038 1112254810 /nfs/dbraw/zinc/25/48/10/1112254810.db2.gz YGPAIMKUGQBEGQ-UHFFFAOYSA-N 2 0 371.569 4.057 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000480152160 1112304022 /nfs/dbraw/zinc/30/40/22/1112304022.db2.gz XQWANHDPUKLTAJ-SFHVURJKSA-N 2 0 360.546 4.087 20 0 FIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000667681603 1112446216 /nfs/dbraw/zinc/44/62/16/1112446216.db2.gz MRKCQAZIJFTFAY-IBGZPJMESA-N 2 0 355.551 4.282 20 0 FIADRP CO[C@@H](C)[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000480538331 1112466954 /nfs/dbraw/zinc/46/69/54/1112466954.db2.gz IHXGZOWKHICHEI-MOPGFXCFSA-N 2 0 352.522 4.462 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000480610035 1112500514 /nfs/dbraw/zinc/50/05/14/1112500514.db2.gz NFSXGSVCKLNXTF-HSALFYBXSA-N 2 0 354.542 4.281 20 0 FIADRP COc1cc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1OC(F)F ZINC000480606303 1112506761 /nfs/dbraw/zinc/50/67/61/1112506761.db2.gz CSQZKNKBVODTMD-HZPDHXFCSA-N 2 0 370.484 4.459 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1 ZINC000480645940 1112520067 /nfs/dbraw/zinc/52/00/67/1112520067.db2.gz YFCKGCXDUKPTJN-GBAAUQCPSA-N 2 0 371.613 4.245 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480636187 1112524525 /nfs/dbraw/zinc/52/45/25/1112524525.db2.gz CZKZLUPZGJAURZ-FGTMMUONSA-N 2 0 371.569 4.325 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000480703405 1112554964 /nfs/dbraw/zinc/55/49/64/1112554964.db2.gz YCDGGLYRSXEDSA-LJQANCHMSA-N 2 0 366.553 4.027 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cccc(Cl)c2)CC1 ZINC000480695919 1112558764 /nfs/dbraw/zinc/55/87/64/1112558764.db2.gz UXKISIBONJZOAO-GOSISDBHSA-N 2 0 371.956 4.328 20 0 FIADRP Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480712230 1112566172 /nfs/dbraw/zinc/56/61/72/1112566172.db2.gz SBIFGEVWOJJKAW-QFIPXVFZSA-N 2 0 366.553 4.019 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000480730900 1112574850 /nfs/dbraw/zinc/57/48/50/1112574850.db2.gz QGUUZPLPACVEAX-OAQYLSRUSA-N 2 0 368.521 4.411 20 0 FIADRP FC(F)(F)c1cccnc1[C@@H](NC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC001168364314 1112590948 /nfs/dbraw/zinc/59/09/48/1112590948.db2.gz BFVONYHHFJZGQB-KRWDZBQOSA-N 2 0 353.432 4.016 20 0 FIADRP CCOCc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000480810379 1112615779 /nfs/dbraw/zinc/61/57/79/1112615779.db2.gz DYVQUYMOWXFHPL-XXBNENTESA-N 2 0 352.522 4.223 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000480879154 1112652361 /nfs/dbraw/zinc/65/23/61/1112652361.db2.gz GTSJJGZYQLYZKE-PXNSSMCTSA-N 2 0 366.977 4.344 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC001649004382 1112661750 /nfs/dbraw/zinc/66/17/50/1112661750.db2.gz FNDSLJKJLJLFPY-HYBUGGRVSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000481309997 1112884233 /nfs/dbraw/zinc/88/42/33/1112884233.db2.gz STBPYJMMWUQHBP-KSFYIVLOSA-N 2 0 356.485 4.179 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(C)cc4)sc32)C1 ZINC000481302050 1112887942 /nfs/dbraw/zinc/88/79/42/1112887942.db2.gz BYJKTPLNOAJDCV-AEFFLSMTSA-N 2 0 355.551 4.427 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(Br)c1 ZINC000481318127 1112890172 /nfs/dbraw/zinc/89/01/72/1112890172.db2.gz JFHZOAHKGIEKKG-SFHVURJKSA-N 2 0 351.332 4.364 20 0 FIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CCCO2 ZINC000481320859 1112891840 /nfs/dbraw/zinc/89/18/40/1112891840.db2.gz NMCLQKRZTSVPLT-QFIPXVFZSA-N 2 0 368.521 4.247 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000481333328 1112903914 /nfs/dbraw/zinc/90/39/14/1112903914.db2.gz SKHUQKFBBCQUAQ-HKUYNNGSSA-N 2 0 356.485 4.397 20 0 FIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000481344305 1112909087 /nfs/dbraw/zinc/90/90/87/1112909087.db2.gz WNTGEQMXZMQUGM-FPOVZHCZSA-N 2 0 360.517 4.325 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]CC3CCCCC3)C3(C2)CCOCC3)cc1 ZINC000555611995 1112946685 /nfs/dbraw/zinc/94/66/85/1112946685.db2.gz FZSOBJSVZBLWFW-QFIPXVFZSA-N 2 0 356.554 4.085 20 0 FIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCC1 ZINC000481556792 1112980340 /nfs/dbraw/zinc/98/03/40/1112980340.db2.gz KJMHXPAYXRAOOF-CRAIPNDOSA-N 2 0 354.460 4.447 20 0 FIADRP FC(F)(F)Oc1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000899874703 1113037984 /nfs/dbraw/zinc/03/79/84/1113037984.db2.gz JFZQEDPRACKMBC-CHWSQXEVSA-N 2 0 351.372 4.172 20 0 FIADRP FC(F)(F)Oc1ccc2c(c1)[nH+]ccc2N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000899878410 1113042445 /nfs/dbraw/zinc/04/24/45/1113042445.db2.gz PMESEDMCLPTFMP-AWEZNQCLSA-N 2 0 365.399 4.198 20 0 FIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000481730098 1113057965 /nfs/dbraw/zinc/05/79/65/1113057965.db2.gz SPXMKVNDGOVTSZ-ZHRRBRCNSA-N 2 0 356.485 4.179 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000481816798 1113087390 /nfs/dbraw/zinc/08/73/90/1113087390.db2.gz QWVFXAQQDGNUES-SJLPKXTDSA-N 2 0 350.441 4.141 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000481943296 1113136207 /nfs/dbraw/zinc/13/62/07/1113136207.db2.gz IPKKYNLVLTZNDR-FQEVSTJZSA-N 2 0 350.934 4.198 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cc3c(cc(C)cc3C)[nH]2)CC1 ZINC000481980932 1113147146 /nfs/dbraw/zinc/14/71/46/1113147146.db2.gz ATWOBTSZBYPSEA-UHFFFAOYSA-N 2 0 357.542 4.108 20 0 FIADRP CC1(C)CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc21 ZINC000481996049 1113151635 /nfs/dbraw/zinc/15/16/35/1113151635.db2.gz ZOLANJMSVSNUCR-OFNKIYASSA-N 2 0 364.533 4.156 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3F)C2)[C@@H](C)C1 ZINC000482074767 1113172096 /nfs/dbraw/zinc/17/20/96/1113172096.db2.gz KYNHVFUTXQYOBK-VWNVYAMZSA-N 2 0 362.533 4.188 20 0 FIADRP CCc1nc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)sc1C ZINC000482076165 1113172171 /nfs/dbraw/zinc/17/21/71/1113172171.db2.gz CTWAVPBLZWTTGH-JXFKEZNVSA-N 2 0 357.567 4.057 20 0 FIADRP C[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000482115500 1113173181 /nfs/dbraw/zinc/17/31/81/1113173181.db2.gz RWQKWMUYRMPNES-INIZCTEOSA-N 2 0 369.484 4.141 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCCc1c(Cl)cccc1Cl ZINC000482172182 1113192335 /nfs/dbraw/zinc/19/23/35/1113192335.db2.gz RSCZTRSEVPAJRF-NIKGAXFTSA-N 2 0 371.352 4.110 20 0 FIADRP C[C@@H]([NH2+]CCCc1ccc2c(c1)CCO2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000482220807 1113202485 /nfs/dbraw/zinc/20/24/85/1113202485.db2.gz NPJLHWSDVKZDCZ-XXBNENTESA-N 2 0 364.533 4.054 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1OC ZINC000162904409 1113211285 /nfs/dbraw/zinc/21/12/85/1113211285.db2.gz MFVVIHSJUKFQEQ-SFHVURJKSA-N 2 0 368.521 4.459 20 0 FIADRP c1cn(-c2ccc(C[NH2+]C3CC[NH+](CC4CCCCC4)CC3)cc2)cn1 ZINC001649005051 1113214459 /nfs/dbraw/zinc/21/44/59/1113214459.db2.gz LUULTALREVRBMS-UHFFFAOYSA-N 2 0 352.526 4.007 20 0 FIADRP CN(C)CC[NH2+]C1CCC([NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000201921035 1113216743 /nfs/dbraw/zinc/21/67/43/1113216743.db2.gz DINHEIXRGUYCKE-UHFFFAOYSA-N 2 0 365.565 4.151 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000482326632 1113226419 /nfs/dbraw/zinc/22/64/19/1113226419.db2.gz ZDZURPNMNTWDMG-KDOFPFPSSA-N 2 0 356.432 4.283 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)C1 ZINC000482345928 1113230990 /nfs/dbraw/zinc/23/09/90/1113230990.db2.gz SURIJBXDBAMLFI-FZKQIMNGSA-N 2 0 369.322 4.286 20 0 FIADRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000482447721 1113259786 /nfs/dbraw/zinc/25/97/86/1113259786.db2.gz MKRNHAHOKNXQOM-VQTJNVASSA-N 2 0 357.586 4.268 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CCCO2 ZINC000482438996 1113260351 /nfs/dbraw/zinc/26/03/51/1113260351.db2.gz NWLQIUWJEUXNBY-GGAORHGYSA-N 2 0 364.533 4.363 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OC)cc1 ZINC000482451276 1113263636 /nfs/dbraw/zinc/26/36/36/1113263636.db2.gz RXCFWQDHBBSMNC-NZQKXSOJSA-N 2 0 352.522 4.301 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000482490117 1113273138 /nfs/dbraw/zinc/27/31/38/1113273138.db2.gz WVUXXEATCIEWMO-SFTDATJTSA-N 2 0 365.565 4.278 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](COC)c2cccc(C(F)(F)F)c2)CC1 ZINC000482499929 1113278683 /nfs/dbraw/zinc/27/86/83/1113278683.db2.gz GQGGEMQJMDCDQN-SFHVURJKSA-N 2 0 358.448 4.105 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482503527 1113279612 /nfs/dbraw/zinc/27/96/12/1113279612.db2.gz LPLFPMLNICVYNR-PXNSSMCTSA-N 2 0 371.594 4.142 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OC)c(Br)c2)CC1 ZINC000482519110 1113282713 /nfs/dbraw/zinc/28/27/13/1113282713.db2.gz MMCCLMCENNYADW-AWEZNQCLSA-N 2 0 369.347 4.230 20 0 FIADRP CC(C)C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)cc1 ZINC000482550508 1113291853 /nfs/dbraw/zinc/29/18/53/1113291853.db2.gz FVYNKLFCKYMLKN-FQEVSTJZSA-N 2 0 351.966 4.044 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000482561482 1113296553 /nfs/dbraw/zinc/29/65/53/1113296553.db2.gz PECNVUPSXRCYIH-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP CC(C)CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000482626458 1113313630 /nfs/dbraw/zinc/31/36/30/1113313630.db2.gz CNQOSGVGVROUBA-XLIONFOSSA-N 2 0 351.966 4.043 20 0 FIADRP CCn1cc([C@@H](C)[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)cn1 ZINC000482864468 1113380586 /nfs/dbraw/zinc/38/05/86/1113380586.db2.gz HTEHCSFEYXLGSV-HXUWFJFHSA-N 2 0 368.569 4.289 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2c3ccccc3sc21 ZINC000482866612 1113381633 /nfs/dbraw/zinc/38/16/33/1113381633.db2.gz MDSXKEQSFHUWHL-QFBILLFUSA-N 2 0 358.551 4.105 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1cccc(-c2ccccc2)c1 ZINC000482883669 1113391892 /nfs/dbraw/zinc/39/18/92/1113391892.db2.gz AJDHXUOMHUKMDX-CVDCTZTESA-N 2 0 352.522 4.241 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CCc2cccc(OCCCc3ccccc3)c2)CC[N@@H+]1C ZINC000482907816 1113396597 /nfs/dbraw/zinc/39/65/97/1113396597.db2.gz ZDWINZXQEXRWAC-NZQKXSOJSA-N 2 0 366.549 4.313 20 0 FIADRP COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000162372665 1113462336 /nfs/dbraw/zinc/46/23/36/1113462336.db2.gz VTTMOHHLRCDNDK-QZTJIDSGSA-N 2 0 356.510 4.356 20 0 FIADRP CC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)Cc1cccc(Br)c1 ZINC000483220415 1113467837 /nfs/dbraw/zinc/46/78/37/1113467837.db2.gz WUEXXPPPWAGLJF-RVKKMQEKSA-N 2 0 353.348 4.090 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486535282 1113591486 /nfs/dbraw/zinc/59/14/86/1113591486.db2.gz JBOBSMPTCQVGHJ-PXNSSMCTSA-N 2 0 374.475 4.331 20 0 FIADRP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486708702 1113626821 /nfs/dbraw/zinc/62/68/21/1113626821.db2.gz KDCLBLUVLKJJPN-APWZRJJASA-N 2 0 351.469 4.307 20 0 FIADRP Fc1ccc2cc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)[nH]c2c1 ZINC000486715764 1113628455 /nfs/dbraw/zinc/62/84/55/1113628455.db2.gz WZWOULLZONEAHQ-UHFFFAOYSA-N 2 0 351.469 4.309 20 0 FIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C3CCN([C@@H]4CCOC4)CC3)CC2)cc1 ZINC000668693819 1113658959 /nfs/dbraw/zinc/65/89/59/1113658959.db2.gz WEOAMXRWAKXCAT-TZIWHRDSSA-N 2 0 360.929 4.119 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3sccc3Cl)CC2)cc1 ZINC000486989874 1113691214 /nfs/dbraw/zinc/69/12/14/1113691214.db2.gz VFJRTPNUMSYVLZ-UHFFFAOYSA-N 2 0 364.942 4.412 20 0 FIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000488071762 1113850542 /nfs/dbraw/zinc/85/05/42/1113850542.db2.gz HOZCOSPXFATLIQ-BDTNDASRSA-N 2 0 354.538 4.110 20 0 FIADRP CC(C)(C)[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488408251 1113921213 /nfs/dbraw/zinc/92/12/13/1113921213.db2.gz GUZPCYPGFJTBQE-SJLPKXTDSA-N 2 0 352.613 4.470 20 0 FIADRP C[C@@H](c1ccc(Br)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488548321 1113950486 /nfs/dbraw/zinc/95/04/86/1113950486.db2.gz OZAXTOBIOJDBLY-HNNXBMFYSA-N 2 0 351.332 4.318 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490110503 1114216038 /nfs/dbraw/zinc/21/60/38/1114216038.db2.gz BVCSBULQLSMXFQ-XMMPIXPASA-N 2 0 365.565 4.010 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2ccc(C(C)(C)C)cc2)CC1)C1CC[NH+](C)CC1 ZINC000151080643 1114293661 /nfs/dbraw/zinc/29/36/61/1114293661.db2.gz YHXWSQBLBLGPRO-SFHVURJKSA-N 2 0 357.586 4.273 20 0 FIADRP Cc1ccc(C)c([C@@H]([NH2+]CCCN2CCC[N@@H+](C)CC2)c2ccccc2)c1 ZINC000491010661 1114359760 /nfs/dbraw/zinc/35/97/60/1114359760.db2.gz UEHHGVTZTOMRLM-DEOSSOPVSA-N 2 0 365.565 4.010 20 0 FIADRP C[C@@H](NCCC[N@H+](C)C1CCCCC1)c1cncc(Br)c1 ZINC000571897898 1114544638 /nfs/dbraw/zinc/54/46/38/1114544638.db2.gz YVYLGHCSUPYYOX-CQSZACIVSA-N 2 0 354.336 4.149 20 0 FIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccccc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000588710056 1114601747 /nfs/dbraw/zinc/60/17/47/1114601747.db2.gz PEESBIJSROAVGP-IYBDPMFKSA-N 2 0 370.459 4.027 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2OC(F)F)C[C@H]1C ZINC000572211986 1114622432 /nfs/dbraw/zinc/62/24/32/1114622432.db2.gz NXBDIZQVHVJWNY-ZDSWQNORSA-N 2 0 352.469 4.496 20 0 FIADRP C[NH2+]CC1CC[NH+](Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000572880864 1114802782 /nfs/dbraw/zinc/80/27/82/1114802782.db2.gz ROKOCHGTFVJWAJ-UHFFFAOYSA-N 2 0 374.941 4.148 20 0 FIADRP CCOc1cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc(Cl)c1OC ZINC000589836590 1114846999 /nfs/dbraw/zinc/84/69/99/1114846999.db2.gz NFKSPSBQKMZNMS-UHFFFAOYSA-N 2 0 368.949 4.349 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786159 1114974277 /nfs/dbraw/zinc/97/42/77/1114974277.db2.gz DMKCSAPNKDCLNN-GOSISDBHSA-N 2 0 373.585 4.191 20 0 FIADRP CC(C)(C(=O)Nc1cccc(C[NH+]2CCCCC2)c1)[C@@H]([NH3+])c1ccccc1 ZINC000573115741 1115045880 /nfs/dbraw/zinc/04/58/80/1115045880.db2.gz LIYZZYZUPYQXAE-NRFANRHFSA-N 2 0 365.521 4.337 20 0 FIADRP C[C@H]([NH3+])[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000573609578 1115146514 /nfs/dbraw/zinc/14/65/14/1115146514.db2.gz BRYBNLGBFNXSNI-DZGCQCFKSA-N 2 0 374.941 4.275 20 0 FIADRP Cc1ccncc1CCC[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000573725762 1115177998 /nfs/dbraw/zinc/17/79/98/1115177998.db2.gz NTLFNMQDYLDYCM-IRLDBZIGSA-N 2 0 351.538 4.213 20 0 FIADRP COc1ccc([C@@H](CC(C)C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000592390458 1115225211 /nfs/dbraw/zinc/22/52/11/1115225211.db2.gz UQRVIWLNTXZCJS-LJQANCHMSA-N 2 0 350.572 4.199 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(N2CCCC2=O)cc1 ZINC000157891528 1115381754 /nfs/dbraw/zinc/38/17/54/1115381754.db2.gz PGCGMSHMCFGMIM-MOPGFXCFSA-N 2 0 357.542 4.119 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000594784335 1115481571 /nfs/dbraw/zinc/48/15/71/1115481571.db2.gz DIOKFAUJDVPLDB-GOSISDBHSA-N 2 0 358.913 4.350 20 0 FIADRP [NH3+]C1(c2ccc(Cl)cc2)CC[NH+]([C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168417743 1115865722 /nfs/dbraw/zinc/86/57/22/1115865722.db2.gz SROVRASRDRYVAM-FQEVSTJZSA-N 2 0 358.888 4.286 20 0 FIADRP CC[NH+](CC)[C@H](C(=O)Nc1cc(C)cc(C[NH+](C)C)c1)c1ccccc1 ZINC000533967733 1116075337 /nfs/dbraw/zinc/07/53/37/1116075337.db2.gz SIEHCLWDURWJFN-NRFANRHFSA-N 2 0 353.510 4.078 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c1 ZINC000534064662 1116151526 /nfs/dbraw/zinc/15/15/26/1116151526.db2.gz YKMYDLIEXXDRED-VSKRKVRLSA-N 2 0 354.538 4.110 20 0 FIADRP Cc1ccccc1-c1cccc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1 ZINC000539895218 1117739162 /nfs/dbraw/zinc/73/91/62/1117739162.db2.gz AJLGOOCYDNTMRS-GMKZXUHWSA-N 2 0 364.533 4.346 20 0 FIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000539898429 1117740329 /nfs/dbraw/zinc/74/03/29/1117740329.db2.gz QTBJBCQNBOVJRK-GMAHTHKFSA-N 2 0 369.597 4.093 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000462786877 1117770986 /nfs/dbraw/zinc/77/09/86/1117770986.db2.gz DKSLESZRRDVMMB-SFHVURJKSA-N 2 0 354.542 4.437 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC000462799314 1117783722 /nfs/dbraw/zinc/78/37/22/1117783722.db2.gz SNIXWHXBTLJJSQ-YPAWHYETSA-N 2 0 374.569 4.092 20 0 FIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000462804600 1117786847 /nfs/dbraw/zinc/78/68/47/1117786847.db2.gz DTQWPDGFNANMAF-RBUKOAKNSA-N 2 0 371.569 4.051 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000462848253 1117818517 /nfs/dbraw/zinc/81/85/17/1117818517.db2.gz OMYZPCTXEUQOQE-CEXWTWQISA-N 2 0 362.558 4.404 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Br)c1 ZINC000540137172 1117900866 /nfs/dbraw/zinc/90/08/66/1117900866.db2.gz NBKWUTKVXYWAGS-HNNXBMFYSA-N 2 0 374.326 4.411 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000540160364 1117903863 /nfs/dbraw/zinc/90/38/63/1117903863.db2.gz CTFZGLIRYTXFBB-HSQYWUDLSA-N 2 0 358.570 4.403 20 0 FIADRP CC(C)[C@H](CNC1CC[NH+](C2CCCC2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000540188421 1117920151 /nfs/dbraw/zinc/92/01/51/1117920151.db2.gz OLULPDIDSDGHET-DEOSSOPVSA-N 2 0 369.597 4.066 20 0 FIADRP CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540178727 1117923164 /nfs/dbraw/zinc/92/31/64/1117923164.db2.gz FCXFGJUNQSGZQH-JTSKRJEESA-N 2 0 368.521 4.364 20 0 FIADRP C[C@@H](C[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1)C[NH+]1CCCCC1 ZINC000463071346 1117956006 /nfs/dbraw/zinc/95/60/06/1117956006.db2.gz LMPNHFYSCLWSFW-SFHVURJKSA-N 2 0 363.977 4.016 20 0 FIADRP C[C@@H](C[NH2+]C1CCN(Cc2ccccc2Cl)CC1)C[NH+]1CCCCC1 ZINC000463073768 1117957946 /nfs/dbraw/zinc/95/79/46/1117957946.db2.gz XOUKKXGQBHUPAV-SFHVURJKSA-N 2 0 363.977 4.016 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000540262171 1117962334 /nfs/dbraw/zinc/96/23/34/1117962334.db2.gz GMXYUXYROXNBLD-KBXCAEBGSA-N 2 0 351.332 4.222 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)[C@H](C)C1 ZINC000463108979 1117968369 /nfs/dbraw/zinc/96/83/69/1117968369.db2.gz IIXRUQSWZLMBDT-WIYYLYMNSA-N 2 0 356.558 4.177 20 0 FIADRP Cc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+](C)C)cc1 ZINC000463120468 1117979075 /nfs/dbraw/zinc/97/90/75/1117979075.db2.gz VYRKYIMYTZSIKZ-HUVFLSCGSA-N 2 0 365.565 4.240 20 0 FIADRP CCCc1ccc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C(C)C)cc1 ZINC000540321244 1117982745 /nfs/dbraw/zinc/98/27/45/1117982745.db2.gz RECLOJVZBOYDDB-REWPJTCUSA-N 2 0 358.570 4.427 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C[C@@H](C)O1 ZINC000540320793 1117982936 /nfs/dbraw/zinc/98/29/36/1117982936.db2.gz NBCVVPQVYKWUJS-JXXFODFXSA-N 2 0 350.934 4.270 20 0 FIADRP CC(C)(C)[C@H]1OCCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463133159 1117984117 /nfs/dbraw/zinc/98/41/17/1117984117.db2.gz DJKAYHTUBBJPHQ-UNMCSNQZSA-N 2 0 358.570 4.124 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+]C2CCN(c3ccccc3)CC2)cc1 ZINC000463137138 1117986299 /nfs/dbraw/zinc/98/62/99/1117986299.db2.gz PEKUMDXCYZSAAD-UHFFFAOYSA-N 2 0 351.538 4.287 20 0 FIADRP COc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000540327440 1117994365 /nfs/dbraw/zinc/99/43/65/1117994365.db2.gz CXUYHYLSAQDUQQ-BZSNNMDCSA-N 2 0 356.510 4.484 20 0 FIADRP CC[C@@H](Cc1ccccc1Br)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000540394705 1118028949 /nfs/dbraw/zinc/02/89/49/1118028949.db2.gz FKSVGJLTLVPDDG-KRWDZBQOSA-N 2 0 365.359 4.234 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000540418049 1118044416 /nfs/dbraw/zinc/04/44/16/1118044416.db2.gz TXQDGDQRDZSYSU-PXAZEXFGSA-N 2 0 369.372 4.163 20 0 FIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCC4CCOCC4)CC[C@H]32)cc1 ZINC000463293163 1118076855 /nfs/dbraw/zinc/07/68/55/1118076855.db2.gz DVKSUPSKBMTOBP-DHIUTWEWSA-N 2 0 356.554 4.180 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCOc1ccccc1)c1ccccc1O2 ZINC000540468504 1118083670 /nfs/dbraw/zinc/08/36/70/1118083670.db2.gz SYQDQOAWJYIUIJ-OAQYLSRUSA-N 2 0 366.505 4.033 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CCCNc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463288282 1118084861 /nfs/dbraw/zinc/08/48/61/1118084861.db2.gz ZZCLWWUFOSUNBD-XMSQKQJNSA-N 2 0 355.501 4.270 20 0 FIADRP C[NH+](C)CC1(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)CCCC1 ZINC000463288931 1118085232 /nfs/dbraw/zinc/08/52/32/1118085232.db2.gz QNFBCLLSCFRKOF-UHFFFAOYSA-N 2 0 363.977 4.016 20 0 FIADRP Cc1cc(F)ccc1CC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540495000 1118092049 /nfs/dbraw/zinc/09/20/49/1118092049.db2.gz OCZDVBGRYQABEW-NRFANRHFSA-N 2 0 368.496 4.254 20 0 FIADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540495002 1118092119 /nfs/dbraw/zinc/09/21/19/1118092119.db2.gz OCZDVBGRYQABEW-OAQYLSRUSA-N 2 0 368.496 4.254 20 0 FIADRP Cc1ccsc1CC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540507751 1118098614 /nfs/dbraw/zinc/09/86/14/1118098614.db2.gz NOWDZHGSGDIHOZ-GOSISDBHSA-N 2 0 356.535 4.177 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)[C@H](C)C1 ZINC000540551850 1118123282 /nfs/dbraw/zinc/12/32/82/1118123282.db2.gz VORAGIPJXIHYBE-KNQAVFIVSA-N 2 0 374.569 4.044 20 0 FIADRP CC[NH+](CC)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(C)c2C)CC1 ZINC000541083919 1118376103 /nfs/dbraw/zinc/37/61/03/1118376103.db2.gz ALMXIWBJTGGMQY-FQEVSTJZSA-N 2 0 373.585 4.464 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cn1 ZINC000491316102 1118479675 /nfs/dbraw/zinc/47/96/75/1118479675.db2.gz KBBKSPDDPMCVBN-FIKGOQFSSA-N 2 0 371.500 4.071 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC000541378907 1118495190 /nfs/dbraw/zinc/49/51/90/1118495190.db2.gz XWJLYAYDVUXNNR-OAQYLSRUSA-N 2 0 350.441 4.264 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCC(=O)Nc3ccccc32)c1 ZINC000541565561 1118557730 /nfs/dbraw/zinc/55/77/30/1118557730.db2.gz GIEAWWUMLSZFEN-FQEVSTJZSA-N 2 0 351.494 4.090 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541662172 1118601225 /nfs/dbraw/zinc/60/12/25/1118601225.db2.gz LAEUGOPGAMNKHY-FQEVSTJZSA-N 2 0 365.565 4.250 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000541914739 1118699357 /nfs/dbraw/zinc/69/93/57/1118699357.db2.gz IXBJQEQHXFUOIN-QINHECLXSA-N 2 0 354.485 4.141 20 0 FIADRP C[C@]1(C[NH2+]Cc2c[nH]nc2-c2ccccc2)CC[N@H+](Cc2ccccc2)C1 ZINC000312454389 1118711467 /nfs/dbraw/zinc/71/14/67/1118711467.db2.gz KITPJQCOVFYMNR-HSZRJFAPSA-N 2 0 360.505 4.079 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Br)C[C@H]1C ZINC000542279470 1118879597 /nfs/dbraw/zinc/87/95/97/1118879597.db2.gz XWBWSVOORDZIFE-WBVHZDCISA-N 2 0 353.348 4.186 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000173329742 1119033724 /nfs/dbraw/zinc/03/37/24/1119033724.db2.gz JFKGKCIINAJESE-OAHLLOKOSA-N 2 0 366.427 4.497 20 0 FIADRP COCC[C@H]1CCCC[NH+]([C@@H](C)CC[N@H+]2CCCC[C@@H](CCOC)C2)C1 ZINC000467274293 1119289033 /nfs/dbraw/zinc/28/90/33/1119289033.db2.gz FZFZRSSFVHHXBJ-FDFHNCONSA-N 2 0 368.606 4.042 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000311493685 1119376811 /nfs/dbraw/zinc/37/68/11/1119376811.db2.gz KDEPGAVFBZOWDW-XXBNENTESA-N 2 0 350.506 4.184 20 0 FIADRP c1ccc(C[N@H+]2CCCC[C@@H](C[NH2+][C@H]3CCCC34CCOCC4)C2)cc1 ZINC000311892244 1119393729 /nfs/dbraw/zinc/39/37/29/1119393729.db2.gz YPKVVOBZLJVWSK-VXKWHMMOSA-N 2 0 356.554 4.228 20 0 FIADRP CC1(C)[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)[C@@H]2CCCO[C@H]21 ZINC000312112555 1119402456 /nfs/dbraw/zinc/40/24/56/1119402456.db2.gz NBTSMUCCBCCROV-FNAHDJPLSA-N 2 0 356.554 4.082 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000542464572 1119411127 /nfs/dbraw/zinc/41/11/27/1119411127.db2.gz JVSVZMCJYBAKFC-UHFFFAOYSA-N 2 0 352.869 4.394 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)C1 ZINC000542477007 1119636563 /nfs/dbraw/zinc/63/65/63/1119636563.db2.gz AVUMZDCPNXEHDQ-GCJKJVERSA-N 2 0 355.501 4.412 20 0 FIADRP CC[C@@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000186574495 1119737151 /nfs/dbraw/zinc/73/71/51/1119737151.db2.gz DCWIVDKBNKKGRN-RDTXWAMCSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000186585215 1119737866 /nfs/dbraw/zinc/73/78/66/1119737866.db2.gz FQXGDBKWDOPQJY-VQTJNVASSA-N 2 0 351.538 4.030 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cccc(-c2ccccc2)c1 ZINC000186594474 1119738847 /nfs/dbraw/zinc/73/88/47/1119738847.db2.gz MBBCBSJLJGKBQF-VQTJNVASSA-N 2 0 351.538 4.030 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000187037444 1119762611 /nfs/dbraw/zinc/76/26/11/1119762611.db2.gz OUAPYSLOJBPRSE-UHFFFAOYSA-N 2 0 367.537 4.311 20 0 FIADRP O=C1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c2ccccc2N1 ZINC000542480494 1119822750 /nfs/dbraw/zinc/82/27/50/1119822750.db2.gz DJSKNBFGGCUNFF-OAQYLSRUSA-N 2 0 363.505 4.236 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000223056103 1119930318 /nfs/dbraw/zinc/93/03/18/1119930318.db2.gz DGJDKFKRUCMMFT-GOSISDBHSA-N 2 0 351.332 4.291 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)cn1 ZINC000190769390 1119948150 /nfs/dbraw/zinc/94/81/50/1119948150.db2.gz BBGWRRNMBFUZCJ-UHFFFAOYSA-N 2 0 366.553 4.059 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000190771186 1119948184 /nfs/dbraw/zinc/94/81/84/1119948184.db2.gz FCAGPLURENDKIL-IBGZPJMESA-N 2 0 366.553 4.202 20 0 FIADRP CC(C)N(C)c1ccc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cn1 ZINC000191470926 1119978630 /nfs/dbraw/zinc/97/86/30/1119978630.db2.gz LUUWFYZHGRCXAG-UHFFFAOYSA-N 2 0 358.574 4.059 20 0 FIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCS2 ZINC000191547249 1119983672 /nfs/dbraw/zinc/98/36/72/1119983672.db2.gz JPOVLYGLMQDKSX-JXXFODFXSA-N 2 0 360.567 4.475 20 0 FIADRP CCC1(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000494621176 1120000335 /nfs/dbraw/zinc/00/03/35/1120000335.db2.gz NQWVNSPNMFFRAL-YPAWHYETSA-N 2 0 368.565 4.226 20 0 FIADRP COC[C@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000193957232 1120219613 /nfs/dbraw/zinc/21/96/13/1120219613.db2.gz XPJZTXRZJXUSPX-NRFANRHFSA-N 2 0 358.913 4.413 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000494879724 1120355007 /nfs/dbraw/zinc/35/50/07/1120355007.db2.gz QPWUYJIFMSYSNO-UGKGYDQZSA-N 2 0 356.485 4.145 20 0 FIADRP Cc1noc(C2CCC([NH2+]CC3([NH+]4CCCCC4)CCCCC3)CC2)n1 ZINC000494881368 1120356293 /nfs/dbraw/zinc/35/62/93/1120356293.db2.gz GLCRQTQWWZGXMO-UHFFFAOYSA-N 2 0 360.546 4.183 20 0 FIADRP Cc1ccccc1[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)C1CCCC1 ZINC000495071108 1120455938 /nfs/dbraw/zinc/45/59/38/1120455938.db2.gz WTPDCTJIUQTTJI-HSZRJFAPSA-N 2 0 367.537 4.352 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)C1 ZINC000495089049 1120469008 /nfs/dbraw/zinc/46/90/08/1120469008.db2.gz XBZOKMYZHXXRHF-NNMXDRDESA-N 2 0 362.533 4.251 20 0 FIADRP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@H]3O)CC1)CCS2 ZINC000250103081 1120476239 /nfs/dbraw/zinc/47/62/39/1120476239.db2.gz RRSYBIGFBYGNEY-QHAWAJNXSA-N 2 0 374.594 4.198 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cc1F ZINC000495543884 1120876070 /nfs/dbraw/zinc/87/60/70/1120876070.db2.gz BKEWPDIDDQOFEH-IXDOHACOSA-N 2 0 374.475 4.425 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cc(Br)ncc1F ZINC000762729464 1120955959 /nfs/dbraw/zinc/95/59/59/1120955959.db2.gz KGWWMSVQXMUUJO-QWHCGFSZSA-N 2 0 360.315 4.144 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cc(Br)ncc1F ZINC000762736732 1120956930 /nfs/dbraw/zinc/95/69/30/1120956930.db2.gz RRFLNDBMTBEWCX-KGLIPLIRSA-N 2 0 372.326 4.288 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc(Br)ncc1F ZINC000762737736 1120957102 /nfs/dbraw/zinc/95/71/02/1120957102.db2.gz TZDCMWDJZAQWBN-CQSZACIVSA-N 2 0 372.326 4.146 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000236930736 1120971742 /nfs/dbraw/zinc/97/17/42/1120971742.db2.gz KJZUCRSCQBQQHS-NRFANRHFSA-N 2 0 368.521 4.096 20 0 FIADRP Cc1cc(F)ccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237412227 1120977063 /nfs/dbraw/zinc/97/70/63/1120977063.db2.gz HECYJPAFVDDBHE-QZTJIDSGSA-N 2 0 356.485 4.033 20 0 FIADRP c1cn(-c2ccc(-c3noc([C@@H]4CC[C@H](c5ccccc5)[NH2+]C4)n3)cc2)cn1 ZINC001212207293 1120979444 /nfs/dbraw/zinc/97/94/44/1120979444.db2.gz FTTIOBNPPCVPDR-UYAOXDASSA-N 2 0 371.444 4.131 20 0 FIADRP ClC1(Cl)C[C@H]1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762925926 1120998219 /nfs/dbraw/zinc/99/82/19/1120998219.db2.gz JHZVCSOOVPSAKI-KRWDZBQOSA-N 2 0 353.337 4.168 20 0 FIADRP CC[NH+](CC)[C@H](C)CNC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000043391011 1121195567 /nfs/dbraw/zinc/19/55/67/1121195567.db2.gz RQDUIPRBHJDOGV-GOSISDBHSA-N 2 0 374.573 4.303 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000397626984 1121252181 /nfs/dbraw/zinc/25/21/81/1121252181.db2.gz YJTYWBYAQTWNGZ-SFHVURJKSA-N 2 0 364.489 4.111 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1csc(Cl)c1 ZINC000397636140 1121256907 /nfs/dbraw/zinc/25/69/07/1121256907.db2.gz PXHHIMNYRUYTAA-HNNXBMFYSA-N 2 0 364.942 4.079 20 0 FIADRP C[C@@H]1CCC[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)CC1 ZINC001649048811 1121317361 /nfs/dbraw/zinc/31/73/61/1121317361.db2.gz ZZQYNTSRPSDYTG-CTNGQTDRSA-N 2 0 374.569 4.235 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000671739769 1121636910 /nfs/dbraw/zinc/63/69/10/1121636910.db2.gz OVVUQFDFUBPIHL-HNNXBMFYSA-N 2 0 353.466 4.226 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(OC)c(OC)cc2C)c1 ZINC000123907823 1121644786 /nfs/dbraw/zinc/64/47/86/1121644786.db2.gz UFXAFWUESLENKC-KRWDZBQOSA-N 2 0 356.510 4.315 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(N3CCCC3=O)c2)c1 ZINC000123948933 1121648599 /nfs/dbraw/zinc/64/85/99/1121648599.db2.gz PVQNJSLXMBTFFJ-GOSISDBHSA-N 2 0 365.521 4.116 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCN2Cc3ccccc3C2)CC1 ZINC000671744292 1121652099 /nfs/dbraw/zinc/65/20/99/1121652099.db2.gz LBHLTRUYYJFEJL-UHFFFAOYSA-N 2 0 363.549 4.035 20 0 FIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Cl)s1 ZINC000124652609 1121710669 /nfs/dbraw/zinc/71/06/69/1121710669.db2.gz NBQKSCVCMDAKFM-OAHLLOKOSA-N 2 0 355.979 4.002 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000124726299 1121716010 /nfs/dbraw/zinc/71/60/10/1121716010.db2.gz UPNZHEWABIMSLW-FHWLQOOXSA-N 2 0 354.542 4.271 20 0 FIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1 ZINC000124731935 1121716034 /nfs/dbraw/zinc/71/60/34/1121716034.db2.gz MFNJPIDZEVRZEK-HXUWFJFHSA-N 2 0 373.585 4.075 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1F ZINC000125463759 1121782110 /nfs/dbraw/zinc/78/21/10/1121782110.db2.gz MTURSZWTBZKMJP-OAHLLOKOSA-N 2 0 362.514 4.459 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000671764481 1121798112 /nfs/dbraw/zinc/79/81/12/1121798112.db2.gz ORWNPHSQWAPOLK-QFBILLFUSA-N 2 0 352.950 4.170 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125730949 1121818257 /nfs/dbraw/zinc/81/82/57/1121818257.db2.gz YLZNBVBGADXAEW-RBUKOAKNSA-N 2 0 374.573 4.331 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)ccc1OC(F)F ZINC000125793095 1121839702 /nfs/dbraw/zinc/83/97/02/1121839702.db2.gz JXXDUMYNKKYPDB-LSDHHAIUSA-N 2 0 356.457 4.068 20 0 FIADRP c1ccc2c(c1)-c1ccccc1C2[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000110473059 1121881962 /nfs/dbraw/zinc/88/19/62/1121881962.db2.gz QIZQDQUVVAJUPO-UHFFFAOYSA-N 2 0 362.517 4.191 20 0 FIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(F)c1 ZINC000126744591 1121982197 /nfs/dbraw/zinc/98/21/97/1121982197.db2.gz MLOQGIRBDDHFIV-HZPDHXFCSA-N 2 0 359.464 4.128 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000186360639 1122054233 /nfs/dbraw/zinc/05/42/33/1122054233.db2.gz VQNHEJXGNBFHGJ-UHFFFAOYSA-N 2 0 368.521 4.463 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630604 1122217588 /nfs/dbraw/zinc/21/75/88/1122217588.db2.gz QODCVAMIOVCXGE-KEZQHZCBSA-N 2 0 360.542 4.158 20 0 FIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)C2CCC2)o1 ZINC000542680635 1122272330 /nfs/dbraw/zinc/27/23/30/1122272330.db2.gz CZSNNGDBWXJHHX-FYYLOGMGSA-N 2 0 368.521 4.176 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC1 ZINC000497860455 1122443730 /nfs/dbraw/zinc/44/37/30/1122443730.db2.gz UMSLSDRQYWQCQC-AVRDEDQJSA-N 2 0 371.569 4.383 20 0 FIADRP CS[C@@H]1CCC[C@H]([NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000129307614 1122567716 /nfs/dbraw/zinc/56/77/16/1122567716.db2.gz BOYMVNILFJBRNV-VQTJNVASSA-N 2 0 350.547 4.096 20 0 FIADRP C[C@@H]1C[C@H](N[C@@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)C[N@@H+]1Cc1ccccc1 ZINC000556104971 1122656152 /nfs/dbraw/zinc/65/61/52/1122656152.db2.gz OANNHPYKNHDELQ-OUJCMCIWSA-N 2 0 363.549 4.075 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)CC1 ZINC000556104638 1122657516 /nfs/dbraw/zinc/65/75/16/1122657516.db2.gz FQUPPNIMBZZSNO-DHIUTWEWSA-N 2 0 357.586 4.170 20 0 FIADRP CCCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000132682620 1123332108 /nfs/dbraw/zinc/33/21/08/1123332108.db2.gz PCAZYNPVGCLCRA-LJQANCHMSA-N 2 0 366.549 4.447 20 0 FIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccccc1CN1CCOCC1 ZINC000152637931 1123430810 /nfs/dbraw/zinc/43/08/10/1123430810.db2.gz ZHRDEQUKVZZHKU-AVRDEDQJSA-N 2 0 350.506 4.165 20 0 FIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133155394 1123436834 /nfs/dbraw/zinc/43/68/34/1123436834.db2.gz OXSAUGUVPZFKHB-WOJBJXKFSA-N 2 0 374.569 4.263 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000133402738 1123484145 /nfs/dbraw/zinc/48/41/45/1123484145.db2.gz DESMLMRUPYGOMJ-IECBHUPTSA-N 3 0 365.565 4.234 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]CCCCSc2ccccc2Br)CC[N@@H+]1C ZINC000133420142 1123486260 /nfs/dbraw/zinc/48/62/60/1123486260.db2.gz VQMSTUMUBOUYCH-GJZGRUSLSA-N 2 0 371.388 4.394 20 0 FIADRP CC(C)[C@H](CNC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCCCC1 ZINC000195569492 1123738127 /nfs/dbraw/zinc/73/81/27/1123738127.db2.gz SISFYNKSHJUXEZ-QHCPKHFHSA-N 2 0 357.586 4.141 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@@H](C)C1 ZINC000245445708 1124035016 /nfs/dbraw/zinc/03/50/16/1124035016.db2.gz ZDSXSJDVIZYNHR-AVRDEDQJSA-N 2 0 365.521 4.101 20 0 FIADRP C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245650703 1124166186 /nfs/dbraw/zinc/16/61/86/1124166186.db2.gz CNHDYIIOFQGEGT-FDTGPBLFSA-N 2 0 364.533 4.499 20 0 FIADRP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245651390 1124167746 /nfs/dbraw/zinc/16/77/46/1124167746.db2.gz CNHDYIIOFQGEGT-TWHAJKEOSA-N 2 0 364.533 4.499 20 0 FIADRP CC1(C)CC(N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC(C)(C)[NH2+]1 ZINC000245672087 1124184446 /nfs/dbraw/zinc/18/44/46/1124184446.db2.gz HNTJXIHOOPRJLA-NUZGMZIFSA-N 3 0 355.570 4.081 20 0 FIADRP OCCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245737490 1124229001 /nfs/dbraw/zinc/22/90/01/1124229001.db2.gz RAFRUBAGZDADFU-JLLPCOHGSA-N 2 0 364.533 4.285 20 0 FIADRP C[NH+](C)[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245765571 1124244541 /nfs/dbraw/zinc/24/45/41/1124244541.db2.gz WHPKHKIYVVWLNO-XQUALCHDSA-N 2 0 363.549 4.075 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000542775317 1124252357 /nfs/dbraw/zinc/25/23/57/1124252357.db2.gz UCDUUKOXBMAMIZ-WTBLGDFPSA-N 2 0 363.549 4.144 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1C(F)(F)F ZINC000246320367 1124445818 /nfs/dbraw/zinc/44/58/18/1124445818.db2.gz FHMQJSWLOZRFBD-GDIGMMSISA-N 2 0 370.459 4.124 20 0 FIADRP CSC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000542847266 1124447520 /nfs/dbraw/zinc/44/75/20/1124447520.db2.gz UQQKIGMFFYYYHX-MRXNPFEDSA-N 2 0 360.489 4.431 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2Cl ZINC000542848569 1124448712 /nfs/dbraw/zinc/44/87/12/1124448712.db2.gz RWLYHQQSGKKLPQ-GCJKJVERSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc(C(F)(F)F)c1 ZINC000246519881 1124523821 /nfs/dbraw/zinc/52/38/21/1124523821.db2.gz UPIIHTRZCIDING-ZOCIIQOWSA-N 2 0 370.459 4.124 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1 ZINC000246586814 1124537594 /nfs/dbraw/zinc/53/75/94/1124537594.db2.gz ZCWIYFCUWCZROR-XUVXKRRUSA-N 2 0 350.934 4.149 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1Br ZINC000246976153 1124577882 /nfs/dbraw/zinc/57/78/82/1124577882.db2.gz JUKPZXDQHUNNHO-CABCVRRESA-N 2 0 369.347 4.229 20 0 FIADRP CCOc1ccccc1Oc1ccc(CN[C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)cn1 ZINC000247030511 1124584090 /nfs/dbraw/zinc/58/40/90/1124584090.db2.gz MFKFTCVTAXRQMN-ZIFCJYIRSA-N 2 0 369.509 4.091 20 0 FIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000247171113 1124596674 /nfs/dbraw/zinc/59/66/74/1124596674.db2.gz YNFCEICPXPCVNS-JYJNAYRXSA-N 2 0 353.576 4.115 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(Cc3ccccc3)nc2C)C1 ZINC000247183873 1124597872 /nfs/dbraw/zinc/59/78/72/1124597872.db2.gz VKWYSGHHMYUKPA-VQIMIIECSA-N 2 0 357.567 4.425 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1cccc(OCC[NH+](C)C)c1 ZINC000247931260 1124731349 /nfs/dbraw/zinc/73/13/49/1124731349.db2.gz CBIFVIANFGLJPQ-HFSMHLIXSA-N 2 0 362.558 4.119 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)c1c(C)noc1C ZINC000248412781 1124764798 /nfs/dbraw/zinc/76/47/98/1124764798.db2.gz KBAJRHXHKSEEHJ-IVAOSVALSA-N 2 0 353.510 4.243 20 0 FIADRP COCC[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412045 1124764887 /nfs/dbraw/zinc/76/48/87/1124764887.db2.gz ZYRFVYKYAJVYOM-SLYNCCJLSA-N 2 0 362.533 4.016 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(C)c1 ZINC000248435648 1124768098 /nfs/dbraw/zinc/76/80/98/1124768098.db2.gz FUCQTZGHMKIBJE-KNQAVFIVSA-N 2 0 352.522 4.111 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(C)cc1 ZINC000248434731 1124768255 /nfs/dbraw/zinc/76/82/55/1124768255.db2.gz DZJLDZQZRWAAAJ-GOTSBHOMSA-N 2 0 352.522 4.193 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1F ZINC000248463305 1124773684 /nfs/dbraw/zinc/77/36/84/1124773684.db2.gz YWAUQIQTHZPOMZ-UGKGYDQZSA-N 2 0 374.475 4.162 20 0 FIADRP Clc1cccc2c1C[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)C2 ZINC001168683858 1124801363 /nfs/dbraw/zinc/80/13/63/1124801363.db2.gz APMNAHDMRXGOHS-JROBLHLSSA-N 2 0 366.936 4.307 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000248831894 1124817194 /nfs/dbraw/zinc/81/71/94/1124817194.db2.gz HRSPXRNOZAJDIV-MZADTFQBSA-N 2 0 368.496 4.162 20 0 FIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000249108337 1124843586 /nfs/dbraw/zinc/84/35/86/1124843586.db2.gz MANRUCRJQXVWNS-SPHCQZIESA-N 2 0 363.549 4.293 20 0 FIADRP Cc1ccc(-c2ccccc2-c2noc([C@@](C)([NH3+])CCCC[NH3+])n2)cc1 ZINC001212335926 1124843909 /nfs/dbraw/zinc/84/39/09/1124843909.db2.gz ONEJNSPIFWEUPP-NRFANRHFSA-N 2 0 350.466 4.015 20 0 FIADRP Cc1ccc(-c2ccccc2)c(-c2noc([C@@](C)([NH3+])CCCC[NH3+])n2)c1 ZINC001212336024 1124848340 /nfs/dbraw/zinc/84/83/40/1124848340.db2.gz QBKCCLKNXCGKDZ-NRFANRHFSA-N 2 0 350.466 4.015 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000249452145 1124858901 /nfs/dbraw/zinc/85/89/01/1124858901.db2.gz COAPLIBVVAIELN-WBMJQRKESA-N 2 0 357.361 4.283 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cnc2ccsc2c1 ZINC000089215440 1124891627 /nfs/dbraw/zinc/89/16/27/1124891627.db2.gz ICSZVQGJAADDSB-HNNXBMFYSA-N 2 0 352.507 4.259 20 0 FIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCCc3nc4ccccc4n3C)CC2)C1 ZINC000090050964 1124978907 /nfs/dbraw/zinc/97/89/07/1124978907.db2.gz XPRAXXFPNWDNRM-AZUAARDMSA-N 2 0 368.569 4.139 20 0 FIADRP CC(C)[C@H](CCc1ccccc1)[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000090525741 1125000719 /nfs/dbraw/zinc/00/07/19/1125000719.db2.gz XHRBLSPFXMVTCQ-VABKMULXSA-N 2 0 358.570 4.001 20 0 FIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1 ZINC000090523407 1125001127 /nfs/dbraw/zinc/00/11/27/1125001127.db2.gz ZCWIYFCUWCZROR-ZCNNSNEGSA-N 2 0 350.934 4.149 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C ZINC000091261381 1125059662 /nfs/dbraw/zinc/05/96/62/1125059662.db2.gz PEACFWLREHVLCI-CABCVRRESA-N 2 0 350.938 4.388 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091285520 1125061984 /nfs/dbraw/zinc/06/19/84/1125061984.db2.gz YUYRXWOCPGVJFM-AUUYWEPGSA-N 2 0 370.368 4.060 20 0 FIADRP COc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000091372384 1125069251 /nfs/dbraw/zinc/06/92/51/1125069251.db2.gz MKBCXLCGHPQCSB-QFIPXVFZSA-N 2 0 351.494 4.048 20 0 FIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1nc2ccccc2n1C ZINC000091403725 1125070737 /nfs/dbraw/zinc/07/07/37/1125070737.db2.gz QSGFHNHAARHYEM-LMDPOFIKSA-N 2 0 354.542 4.267 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cnc2ccccc2c1 ZINC000499599856 1125266203 /nfs/dbraw/zinc/26/62/03/1125266203.db2.gz JFWXSEVXHFZASW-UHFFFAOYSA-N 2 0 360.505 4.368 20 0 FIADRP C[C@@H](C[NH2+][C@H](c1cccc(Cl)c1)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000543012756 1125327653 /nfs/dbraw/zinc/32/76/53/1125327653.db2.gz VSYVRFANODRYEX-UWJYYQICSA-N 2 0 363.977 4.187 20 0 FIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000543016698 1125410751 /nfs/dbraw/zinc/41/07/51/1125410751.db2.gz KHUYUAAEPBLCBI-LJQANCHMSA-N 2 0 350.934 4.008 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)cc1C[NH+]1CCCCC1 ZINC000182353369 1125424340 /nfs/dbraw/zinc/42/43/40/1125424340.db2.gz WXJWWCSEDCXJFL-SFHVURJKSA-N 2 0 363.505 4.404 20 0 FIADRP CC(C)n1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)cn1 ZINC000602275601 567962337 /nfs/dbraw/zinc/96/23/37/567962337.db2.gz YGDJSGGKXBFZMU-UHFFFAOYSA-N 2 0 368.569 4.289 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2ccc(Sc3ccccc3)cc2)CC1 ZINC000563135099 568267103 /nfs/dbraw/zinc/26/71/03/568267103.db2.gz DJFOLZSIIXRHAD-YADHBBJMSA-N 2 0 368.546 4.166 20 0 FIADRP CC[C@@H](C[N@H+](Cc1nccn1CC)[C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000563136708 568270194 /nfs/dbraw/zinc/27/01/94/568270194.db2.gz NHZVWTYOCFQUEL-PZJWPPBQSA-N 2 0 366.553 4.041 20 0 FIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2F)ccc1OC ZINC000182536922 1125555228 /nfs/dbraw/zinc/55/52/28/1125555228.db2.gz YTOVHCOMRKNPDW-HRAATJIYSA-N 2 0 374.500 4.060 20 0 FIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(CO)c(F)c2)ccc1OC ZINC000182576711 1125573145 /nfs/dbraw/zinc/57/31/45/1125573145.db2.gz HNDZPPZNVZJJOR-MRXNPFEDSA-N 2 0 374.500 4.019 20 0 FIADRP COc1ccc([C@H](C)[NH2+][C@H](C)C2CCOCC2)cc1C[NH+]1CCCCC1 ZINC000183130461 1125755065 /nfs/dbraw/zinc/75/50/65/1125755065.db2.gz NTMSXBFVVKSFCK-MSOLQXFVSA-N 2 0 360.542 4.147 20 0 FIADRP C[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC001648785835 1079569322 /nfs/dbraw/zinc/56/93/22/1079569322.db2.gz HSNLNFXWOWAOLG-GBXCKJPGSA-N 2 0 363.549 4.287 20 0 FIADRP Brc1ccccc1C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643547240 1079678538 /nfs/dbraw/zinc/67/85/38/1079678538.db2.gz BSOHHACQNCDQIP-SJLPKXTDSA-N 2 0 363.343 4.035 20 0 FIADRP COc1cccc2c1CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC000683159346 1079746948 /nfs/dbraw/zinc/74/69/48/1079746948.db2.gz MQFHOZHGQVSVGN-IFMALSPDSA-N 2 0 364.533 4.054 20 0 FIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cc(-c2ccco2)on1 ZINC000179396827 1080168153 /nfs/dbraw/zinc/16/81/53/1080168153.db2.gz BDADWUGQTQKVGD-UHFFFAOYSA-N 2 0 366.465 4.068 20 0 FIADRP COc1ccc([C@@H]([NH2+]CCCn2ccnc2)c2ccccc2Cl)cc1 ZINC000179963477 1080389821 /nfs/dbraw/zinc/38/98/21/1080389821.db2.gz DWXYSVMDIBNKTE-HXUWFJFHSA-N 2 0 355.869 4.314 20 0 FIADRP c1n[nH]cc1[C@@H]1CCCC[NH+]1CCCCC[N@@H+]1CCCC[C@H]1c1cn[nH]c1 ZINC000246917801 1080557602 /nfs/dbraw/zinc/55/76/02/1080557602.db2.gz IBVHCQJHTOVXGA-SFTDATJTSA-N 2 0 370.545 4.057 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000048136825 1080571392 /nfs/dbraw/zinc/57/13/92/1080571392.db2.gz YPOVUWWUQRLNSX-UHFFFAOYSA-N 2 0 365.521 4.377 20 0 FIADRP C[C@H]([NH2+]CCc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830572 1080944603 /nfs/dbraw/zinc/94/46/03/1080944603.db2.gz POBKGUAXAYGCOT-MAUKXSAKSA-N 2 0 362.439 4.147 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)CC[C@@H]([NH3+])c3ccccc3)cc2)C1 ZINC000237675692 1080985505 /nfs/dbraw/zinc/98/55/05/1080985505.db2.gz ZUJVOWGZHBQOQQ-PGRDOPGGSA-N 2 0 365.521 4.337 20 0 FIADRP CCOC(=O)CCCCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000312530459 1081022342 /nfs/dbraw/zinc/02/23/42/1081022342.db2.gz POTJZZRKSUQSFZ-UHFFFAOYSA-N 2 0 372.553 4.098 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cn4ccnc4s3)cc2)C1 ZINC001648808199 1081111579 /nfs/dbraw/zinc/11/15/79/1081111579.db2.gz DWEGYHAEONEBSH-IAGOWNOFSA-N 2 0 368.550 4.164 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(F)c2N)C1 ZINC001648808573 1081113283 /nfs/dbraw/zinc/11/32/83/1081113283.db2.gz UWQDGHVJKAMTSG-IRXDYDNUSA-N 2 0 355.501 4.176 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3ccnn3C3CCC3)cc2)C1 ZINC001648808667 1081114381 /nfs/dbraw/zinc/11/43/81/1081114381.db2.gz ZITSDNQIEZDGHV-KDURUIRLSA-N 2 0 366.553 4.376 20 0 FIADRP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001648811051 1081124254 /nfs/dbraw/zinc/12/42/54/1081124254.db2.gz CXMJBWJLPGNQKY-OALUTQOASA-N 2 0 356.558 4.465 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805434 1081210876 /nfs/dbraw/zinc/21/08/76/1081210876.db2.gz OBMUSRPJYFNUDD-WOKLECCJSA-N 2 0 369.372 4.162 20 0 FIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@H]3C[C@@H]([NH+](C)C)C3)s2)cc1 ZINC000655806442 1081214749 /nfs/dbraw/zinc/21/47/49/1081214749.db2.gz VYFVMDWTEAEKDW-UNEWFSDZSA-N 2 0 359.539 4.118 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC001648814946 1081226144 /nfs/dbraw/zinc/22/61/44/1081226144.db2.gz VYTLJEHLRXYRGT-NRFANRHFSA-N 2 0 374.569 4.379 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825547 1081231153 /nfs/dbraw/zinc/23/11/53/1081231153.db2.gz HJMYVHWLTLLIJU-IQGASKDCSA-N 2 0 374.532 4.278 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H]1CCCN2CCCC[C@@H]12 ZINC000655848610 1081257316 /nfs/dbraw/zinc/25/73/16/1081257316.db2.gz JEFWVMMYWFOEMV-QMMLZNLJSA-N 2 0 357.542 4.134 20 0 FIADRP Cc1cccc(C[NH2+][C@@H](Cn2ccnc2)C(C)(C)C)c1Br ZINC001648886849 1081346626 /nfs/dbraw/zinc/34/66/26/1081346626.db2.gz PKSVGPSDMCNVNS-HNNXBMFYSA-N 2 0 350.304 4.159 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2OCCc4ccccc42)C3)cc1 ZINC000683692374 1081390551 /nfs/dbraw/zinc/39/05/51/1081390551.db2.gz PQIIPDWDWGNWIU-JTOYRKQZSA-N 2 0 362.517 4.086 20 0 FIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+]([C@H]3CCC[C@@H]3O)CC1)CCC2 ZINC000537955318 1081448827 /nfs/dbraw/zinc/44/88/27/1081448827.db2.gz RDIDVKJJEITZKH-VJBWXMMDSA-N 2 0 356.554 4.155 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1ccc2cnccc2c1 ZINC000683765723 1081518798 /nfs/dbraw/zinc/51/87/98/1081518798.db2.gz AWFDXXJHYMGENH-UHFFFAOYSA-N 2 0 363.505 4.245 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](N[C@H]2CC[NH+](C)[C@@H](c3ccccc3)C2)C1 ZINC000580101779 1081593503 /nfs/dbraw/zinc/59/35/03/1081593503.db2.gz IOHVVGLHWMYKDE-QLBRKBSLSA-N 2 0 363.549 4.247 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](C)CC2)C(C)C)c(Br)c1 ZINC000580131904 1081708655 /nfs/dbraw/zinc/70/86/55/1081708655.db2.gz IYCLQTQNLVLJFA-GOSISDBHSA-N 2 0 369.347 4.086 20 0 FIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](CC(F)(F)F)c2ccc(Br)cc2)C1 ZINC000656198011 1081905195 /nfs/dbraw/zinc/90/51/95/1081905195.db2.gz FXJYSOGXXVMHJX-MGPQQGTHSA-N 2 0 365.237 4.302 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1nccc2ccccc21 ZINC000580803141 1082144963 /nfs/dbraw/zinc/14/49/63/1082144963.db2.gz BKFDDCTWCLUEHU-SFHVURJKSA-N 2 0 363.505 4.069 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000510354044 1082157743 /nfs/dbraw/zinc/15/77/43/1082157743.db2.gz JRYXASJNAGSSOM-CYVLTUHYSA-N 2 0 356.554 4.481 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000581103911 1082317388 /nfs/dbraw/zinc/31/73/88/1082317388.db2.gz ZGOKMWPWQKTYJA-ZJCZKGSNSA-N 2 0 350.453 4.107 20 0 FIADRP c1ccc(C[NH+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@H+]2CCCC2CCOCC2)cc1 ZINC000656401790 1082332909 /nfs/dbraw/zinc/33/29/09/1082332909.db2.gz JBKMPKFAUYAPGF-XQUALCHDSA-N 2 0 368.565 4.036 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(F)c(F)c1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548157572 1082419870 /nfs/dbraw/zinc/41/98/70/1082419870.db2.gz PBBBBICGJHWWHK-YJBOKZPZSA-N 2 0 362.439 4.147 20 0 FIADRP CC[NH2+]CC1CC[NH+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000430546225 1082426702 /nfs/dbraw/zinc/42/67/02/1082426702.db2.gz JKAFWQHJWWONHF-GOSISDBHSA-N 2 0 365.521 4.321 20 0 FIADRP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000430602579 1082571690 /nfs/dbraw/zinc/57/16/90/1082571690.db2.gz WLSQMHQMFAXAAO-LAUBAEHRSA-N 2 0 353.510 4.305 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000581460610 1082589199 /nfs/dbraw/zinc/58/91/99/1082589199.db2.gz XLDGQDVDNIFEMN-JQIJEIRASA-N 2 0 352.469 4.355 20 0 FIADRP COc1cccc(C2(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@@H]4C)CC3)CC2)c1 ZINC000581517870 1082633498 /nfs/dbraw/zinc/63/34/98/1082633498.db2.gz BLOJQRXOYSLZPN-PGRDOPGGSA-N 2 0 356.554 4.360 20 0 FIADRP CCOCc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000581574979 1082672170 /nfs/dbraw/zinc/67/21/70/1082672170.db2.gz WQRRPOGTESFBRC-XXBNENTESA-N 2 0 352.522 4.223 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000566088473 1082775764 /nfs/dbraw/zinc/77/57/64/1082775764.db2.gz SSSVORAFGSYGTB-JTQLQIEISA-N 2 0 354.338 4.374 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cncc(Br)c1 ZINC000581678619 1082795027 /nfs/dbraw/zinc/79/50/27/1082795027.db2.gz VCEHMDLUNXBOEM-LSDHHAIUSA-N 2 0 354.336 4.007 20 0 FIADRP CC(C)(C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000647192122 1082976607 /nfs/dbraw/zinc/97/66/07/1082976607.db2.gz QVLLUDPBOSKWRD-LEWJYISDSA-N 2 0 356.554 4.369 20 0 FIADRP c1ccc(COc2cccc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000090953707 1083218984 /nfs/dbraw/zinc/21/89/84/1083218984.db2.gz VZJVCWSIMCLKNG-FCHUYYIVSA-N 2 0 350.506 4.025 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@H]3CCCF)CC2)cc1 ZINC000510662909 1083229167 /nfs/dbraw/zinc/22/91/67/1083229167.db2.gz ILCZTTLQFFNEFY-UNMCSNQZSA-N 2 0 362.533 4.415 20 0 FIADRP C[C@H](c1cccc(F)c1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430913547 1083234307 /nfs/dbraw/zinc/23/43/07/1083234307.db2.gz WCSREKPRKQAPGQ-GOSISDBHSA-N 2 0 361.549 4.015 20 0 FIADRP CO[C@@]1(C)C[C@H]([N@H+](C)CCC[NH+]2CCC(Cc3ccccc3)CC2)C1(C)C ZINC001167493449 1083270164 /nfs/dbraw/zinc/27/01/64/1083270164.db2.gz YUYHXTVSDICIIE-UPVQGACJSA-N 2 0 372.597 4.467 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CC[C@@H]3C3CCC3)CC2)cc1 ZINC000510745882 1083287215 /nfs/dbraw/zinc/28/72/15/1083287215.db2.gz BCZCFSAYIPZEKG-DHIUTWEWSA-N 2 0 356.554 4.226 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]CCCCNc1ccccn1)CC2 ZINC000510753301 1083291570 /nfs/dbraw/zinc/29/15/70/1083291570.db2.gz MKFVAANAZWMOIR-KRWDZBQOSA-N 2 0 360.299 4.313 20 0 FIADRP CC(C)n1cc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cn1 ZINC000658320216 1083405856 /nfs/dbraw/zinc/40/58/56/1083405856.db2.gz RUZDZRMPUAYGLH-SIKLNZKXSA-N 2 0 366.553 4.417 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCSCC1 ZINC000658319165 1083405960 /nfs/dbraw/zinc/40/59/60/1083405960.db2.gz XWYDAVIWOOFKDC-NQIIRXRSSA-N 2 0 358.595 4.410 20 0 FIADRP Fc1ccc([C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2ccccn2)cc1 ZINC000658352928 1083424576 /nfs/dbraw/zinc/42/45/76/1083424576.db2.gz AFKLVZQTXVMORI-QFIPXVFZSA-N 2 0 353.485 4.022 20 0 FIADRP CCCCCn1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)n1 ZINC000548482325 1083454556 /nfs/dbraw/zinc/45/45/56/1083454556.db2.gz CWKRQROKWKOWOG-DENIHFKCSA-N 2 0 368.569 4.382 20 0 FIADRP C[C@H]([NH2+]CCc1ccc2ccccc2n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483249 1083459604 /nfs/dbraw/zinc/45/96/04/1083459604.db2.gz LDZMCXSEAWMRSX-SIKLNZKXSA-N 2 0 359.517 4.278 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000548483602 1083465874 /nfs/dbraw/zinc/46/58/74/1083465874.db2.gz VLXBSXCSTKXHLL-FXAWDEMLSA-N 2 0 356.485 4.225 20 0 FIADRP C[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483456 1083468159 /nfs/dbraw/zinc/46/81/59/1083468159.db2.gz NWTPQWMMTMQUPL-IEBWSBKVSA-N 2 0 371.594 4.483 20 0 FIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000510973763 1083542556 /nfs/dbraw/zinc/54/25/56/1083542556.db2.gz AUDUBFGAENQOQK-YCRPNKLZSA-N 2 0 372.484 4.113 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2cccc(Cl)c2Cl)cc1 ZINC000569995316 1083821930 /nfs/dbraw/zinc/82/19/30/1083821930.db2.gz POHSQDSPUMANGP-UHFFFAOYSA-N 2 0 367.320 4.266 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000181323679 1083866478 /nfs/dbraw/zinc/86/64/78/1083866478.db2.gz QPOXMXQRYIWFIJ-IERDGZPVSA-N 2 0 372.484 4.331 20 0 FIADRP C[C@@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000181318846 1083872442 /nfs/dbraw/zinc/87/24/42/1083872442.db2.gz DEOKKHRSLAODOL-IIBYNOLFSA-N 2 0 372.484 4.331 20 0 FIADRP Cc1ccc2[nH]c(C[NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)cc2c1C ZINC000472078684 1084251652 /nfs/dbraw/zinc/25/16/52/1084251652.db2.gz CVFCUWBFYIVKLP-NRFANRHFSA-N 2 0 361.533 4.439 20 0 FIADRP C[C@@H](NCc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cc2n(n1)CCC2 ZINC000414055554 1084377734 /nfs/dbraw/zinc/37/77/34/1084377734.db2.gz CQORJYUSHVHLJY-QZTJIDSGSA-N 2 0 352.526 4.055 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC000657311607 1084429568 /nfs/dbraw/zinc/42/95/68/1084429568.db2.gz PHZHJBIQNJZSLO-KRWDZBQOSA-N 2 0 358.551 4.416 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cc2n(n1)CCC2 ZINC000414071836 1084440060 /nfs/dbraw/zinc/44/00/60/1084440060.db2.gz UOCWUVXJZULVIE-GOSISDBHSA-N 2 0 374.532 4.409 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccnn3CC3CC3)cc2)C1 ZINC000657314476 1084495673 /nfs/dbraw/zinc/49/56/73/1084495673.db2.gz WALUUSHHZZITJS-RTBURBONSA-N 2 0 366.553 4.061 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+]C3CCC(C4CCC4)CC3)cc2)CC1 ZINC000657349554 1084678243 /nfs/dbraw/zinc/67/82/43/1084678243.db2.gz KZWKCYIGJVRVIN-UHFFFAOYSA-N 2 0 356.554 4.092 20 0 FIADRP CSC1(C[NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH+](C)CC1 ZINC000414142618 1084692347 /nfs/dbraw/zinc/69/23/47/1084692347.db2.gz IYWOJIBOPKBECP-SJLPKXTDSA-N 2 0 352.975 4.393 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000582208816 1084762218 /nfs/dbraw/zinc/76/22/18/1084762218.db2.gz NVXSPBDMHRHVHW-WWMYMODYSA-N 2 0 369.553 4.265 20 0 FIADRP COCc1csc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000657375414 1084798661 /nfs/dbraw/zinc/79/86/61/1084798661.db2.gz YDPUHOAIVUTBRX-UHFFFAOYSA-N 2 0 370.518 4.409 20 0 FIADRP C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(Cl)cc1 ZINC000657377423 1084799421 /nfs/dbraw/zinc/79/94/21/1084799421.db2.gz TWPKMHGRWIWOQP-UAOJZALGSA-N 2 0 352.869 4.408 20 0 FIADRP C(CC[N@@H+]1CCC[C@@]2(CCSC2)C1)C[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000582282489 1084828324 /nfs/dbraw/zinc/82/83/24/1084828324.db2.gz BBHBONBWBBXEHV-WOJBJXKFSA-N 2 0 368.656 4.205 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)c2sccc21 ZINC000414296370 1084988072 /nfs/dbraw/zinc/98/80/72/1084988072.db2.gz FGLHNAXSFLKZCH-YLJYHZDGSA-N 2 0 370.562 4.303 20 0 FIADRP CC(C)[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cc2ccccc2o1 ZINC000582426277 1084988738 /nfs/dbraw/zinc/98/87/38/1084988738.db2.gz IFTPMOUMERBAOT-QFIPXVFZSA-N 2 0 367.493 4.255 20 0 FIADRP CC[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CO1 ZINC000657462091 1085123403 /nfs/dbraw/zinc/12/34/03/1085123403.db2.gz CKHFXPKFQKGDLR-PFKGZQGLSA-N 2 0 362.945 4.411 20 0 FIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000563415148 1085244057 /nfs/dbraw/zinc/24/40/57/1085244057.db2.gz BXNJTNDGAWQBAS-KSZLIROESA-N 2 0 352.526 4.114 20 0 FIADRP Cc1ccc(C(=O)Nc2cccc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)c2)cc1 ZINC000125442862 1085268892 /nfs/dbraw/zinc/26/88/92/1085268892.db2.gz ORBZZGKAJYCBJZ-GOSISDBHSA-N 2 0 365.521 4.067 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000684957854 1085313475 /nfs/dbraw/zinc/31/34/75/1085313475.db2.gz YXUFDEPDTZDEQF-JOCHJYFZSA-N 2 0 361.489 4.474 20 0 FIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c2ccccc21 ZINC000549528409 1085368056 /nfs/dbraw/zinc/36/80/56/1085368056.db2.gz XZARLXYKYMHOPJ-IOMROCGXSA-N 2 0 358.526 4.022 20 0 FIADRP C[C@H](Nc1c[nH+]ccc1N1CC[NH+](C)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651744907 1085439630 /nfs/dbraw/zinc/43/96/30/1085439630.db2.gz TWAAMJLOMCMQNA-SFHVURJKSA-N 2 0 373.504 4.069 20 0 FIADRP C[C@H](CC[N@@H+]1CC[C@H](CC(F)(F)F)C1)[NH+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444707419 1085549947 /nfs/dbraw/zinc/54/99/47/1085549947.db2.gz PPINBRFXOFPQKG-MCIONIFRSA-N 2 0 360.386 4.314 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H](C)CSc1ccccc1 ZINC000651875522 1085585578 /nfs/dbraw/zinc/58/55/78/1085585578.db2.gz LUUQQDDWDJGJGH-INIZCTEOSA-N 2 0 352.507 4.188 20 0 FIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cccc(OC)c1 ZINC000661468672 1085586770 /nfs/dbraw/zinc/58/67/70/1085586770.db2.gz CTCNOEVBUQFLGG-QHCPKHFHSA-N 2 0 368.521 4.158 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3cccc(C4CCCC4)c3)cc2)C1 ZINC000657594580 1085659301 /nfs/dbraw/zinc/65/93/01/1085659301.db2.gz BVDMVLYVOVKIHK-XMMPIXPASA-N 2 0 364.533 4.201 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000582757783 1085677292 /nfs/dbraw/zinc/67/72/92/1085677292.db2.gz WAPHWCVBNZZKAF-ARBVUSPFSA-N 2 0 350.453 4.107 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000582757787 1085677576 /nfs/dbraw/zinc/67/75/76/1085677576.db2.gz WAPHWCVBNZZKAF-HRSGCLKMSA-N 2 0 350.453 4.107 20 0 FIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000582757830 1085679665 /nfs/dbraw/zinc/67/96/65/1085679665.db2.gz WAPHWCVBNZZKAF-QDWFBIQASA-N 2 0 350.453 4.107 20 0 FIADRP c1ccc(C[C@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613835 1085699952 /nfs/dbraw/zinc/69/99/52/1085699952.db2.gz SLNIOOQVXKYVAX-DNQXCXABSA-N 2 0 363.549 4.295 20 0 FIADRP COc1cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc(C(F)(F)F)c1 ZINC001143517478 1085809096 /nfs/dbraw/zinc/80/90/96/1085809096.db2.gz MWMUPFKDGAWAON-UHFFFAOYSA-N 2 0 358.448 4.266 20 0 FIADRP c1coc(-c2nc(CN3CCC(C[NH+]4CCCCCC4)CC3)cs2)c1 ZINC000048564797 1085902881 /nfs/dbraw/zinc/90/28/81/1085902881.db2.gz KQZSKRFTOHCPQY-UHFFFAOYSA-N 2 0 359.539 4.491 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347987 1085919054 /nfs/dbraw/zinc/91/90/54/1085919054.db2.gz QTEIBWOQEBOWEA-FHIHXZLISA-N 2 0 357.325 4.273 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000126042411 1085989931 /nfs/dbraw/zinc/98/99/31/1085989931.db2.gz XXGZJIZUDDWOTA-MRXNPFEDSA-N 2 0 360.448 4.290 20 0 FIADRP CN(CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1)c1ccccc1 ZINC001167646581 1086009455 /nfs/dbraw/zinc/00/94/55/1086009455.db2.gz FKJDLBKNWSNSFQ-VWNXMTODSA-N 2 0 363.549 4.109 20 0 FIADRP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(Cl)c(Cl)c1 ZINC000583107295 1086197883 /nfs/dbraw/zinc/19/78/83/1086197883.db2.gz PUHSTYQEMZMGBR-ZDUSSCGKSA-N 2 0 368.308 4.180 20 0 FIADRP O[C@@H](C[NH2+]Cc1c2ccccc2c(Cl)c2ccccc21)C[NH+]1CCCC1 ZINC000060270300 1086325268 /nfs/dbraw/zinc/32/52/68/1086325268.db2.gz VMGHQZZAYKFJHD-INIZCTEOSA-N 2 0 368.908 4.193 20 0 FIADRP CC[C@H](C(=O)OC(C)(C)C)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC001167658183 1086375389 /nfs/dbraw/zinc/37/53/89/1086375389.db2.gz CIRPTGXYDUSHSU-IEBWSBKVSA-N 2 0 352.563 4.083 20 0 FIADRP Cc1ccc(C(=O)C2CC[NH+](Cc3cccc4c3CC[NH2+]C4)CC2)c(C)c1 ZINC000662253957 1086378658 /nfs/dbraw/zinc/37/86/58/1086378658.db2.gz ZNUSMFJKADYBEL-UHFFFAOYSA-N 2 0 362.517 4.044 20 0 FIADRP C[C@H](c1ccc(F)c(F)c1)[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000662327977 1086418725 /nfs/dbraw/zinc/41/87/25/1086418725.db2.gz WWRPAGHLKHQBBD-CQSZACIVSA-N 2 0 374.479 4.096 20 0 FIADRP CC(C)(C)c1ccc(N2CCC([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000161598500 1086424032 /nfs/dbraw/zinc/42/40/32/1086424032.db2.gz WBSZPMZAFUQQDS-RBBKRZOGSA-N 2 0 355.570 4.169 20 0 FIADRP c1ccc2[nH]c(C3C[NH+](Cc4cccc(C[NH+]5CCCCC5)c4)C3)nc2c1 ZINC000663342295 1086441992 /nfs/dbraw/zinc/44/19/92/1086441992.db2.gz QIMWYCFMJVLOBS-UHFFFAOYSA-N 2 0 360.505 4.148 20 0 FIADRP Cc1nccc([C@H]2CCC[N@H+](Cc3ccc(C[NH+]4CCCCC4)cc3)C2)n1 ZINC000662504876 1086475129 /nfs/dbraw/zinc/47/51/29/1086475129.db2.gz GKERALXLSIECDU-QFIPXVFZSA-N 2 0 364.537 4.151 20 0 FIADRP CCOc1ccc(C(=O)C2CC[NH+]([C@@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167824708 1086609824 /nfs/dbraw/zinc/60/98/24/1086609824.db2.gz FUHAHLQKFVGISI-IBGZPJMESA-N 2 0 374.569 4.491 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COc2ccccn2)C1 ZINC001167825018 1086611464 /nfs/dbraw/zinc/61/14/64/1086611464.db2.gz PSWNAARNUISHOH-SJBKTWHCSA-N 2 0 359.558 4.073 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N2Cc3ccccc3NC2=O)CC1 ZINC001167825219 1086612401 /nfs/dbraw/zinc/61/24/01/1086612401.db2.gz HOWCEBBQVAXKAI-SFHVURJKSA-N 2 0 372.557 4.009 20 0 FIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)N1CCc2ccccc2C1 ZINC001648938218 1086635636 /nfs/dbraw/zinc/63/56/36/1086635636.db2.gz HTJGTYBAMQIVMT-UHFFFAOYSA-N 2 0 369.597 4.210 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000512006780 1086635860 /nfs/dbraw/zinc/63/58/60/1086635860.db2.gz IDFQOZWNVRVCHJ-MRXNPFEDSA-N 2 0 367.468 4.175 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCC34CCOCC4)cc2)C1 ZINC000548794520 1086672273 /nfs/dbraw/zinc/67/22/73/1086672273.db2.gz KDZKWXYFWDUTLN-XQBPLPMBSA-N 2 0 356.554 4.213 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](Cc1cccc(OC)c1)[C@@H](C)COC ZINC001167838063 1086712549 /nfs/dbraw/zinc/71/25/49/1086712549.db2.gz PFQUNHFSYJSECK-OALUTQOASA-N 2 0 350.547 4.043 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2cccc(Cl)n2)CC1 ZINC001167839939 1086719084 /nfs/dbraw/zinc/71/90/84/1086719084.db2.gz CUFHMNOANOYXJQ-MRXNPFEDSA-N 2 0 353.938 4.089 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCCO1 ZINC000432413231 1086736567 /nfs/dbraw/zinc/73/65/67/1086736567.db2.gz LMBGGSLROUUIKV-KXBFYZLASA-N 2 0 370.459 4.247 20 0 FIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CCCO1 ZINC000432422561 1086747658 /nfs/dbraw/zinc/74/76/58/1086747658.db2.gz FUVMRCOJSCPNJG-SUMWQHHRSA-N 2 0 357.325 4.071 20 0 FIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432424576 1086748952 /nfs/dbraw/zinc/74/89/52/1086748952.db2.gz PGUFCYTUUKMARB-RXVVDRJESA-N 2 0 360.542 4.114 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC000650705606 1086750866 /nfs/dbraw/zinc/75/08/66/1086750866.db2.gz NNGKHBCKIKRPDI-TXTKFYIRSA-N 2 0 366.505 4.197 20 0 FIADRP CC[C@H](C[NH2+]C1CC[NH+](C(C)C)CC1)Oc1ccccc1C(F)(F)F ZINC000543834657 1086775931 /nfs/dbraw/zinc/77/59/31/1086775931.db2.gz MZNJGKWRJOOEEP-MRXNPFEDSA-N 2 0 358.448 4.325 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Br)c(Cl)s1 ZINC000650720201 1086807123 /nfs/dbraw/zinc/80/71/23/1086807123.db2.gz HZNQFOFFADGRST-UHFFFAOYSA-N 2 0 359.720 4.173 20 0 FIADRP COc1ccsc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000657771826 1086821078 /nfs/dbraw/zinc/82/10/78/1086821078.db2.gz GVJXZXCJNLJWMT-SFHVURJKSA-N 2 0 356.535 4.149 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)CC1 ZINC000728571430 1086869549 /nfs/dbraw/zinc/86/95/49/1086869549.db2.gz DWVXGVSISUUVDS-SFHVURJKSA-N 2 0 373.585 4.363 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCc2cc(Br)cc(C)c21 ZINC000650756459 1086967874 /nfs/dbraw/zinc/96/78/74/1086967874.db2.gz BETZICGGACKQJS-GOSISDBHSA-N 2 0 359.311 4.254 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650763750 1086993489 /nfs/dbraw/zinc/99/34/89/1086993489.db2.gz IVHYGSAZDPOEPH-KRWDZBQOSA-N 2 0 359.514 4.306 20 0 FIADRP Cc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000583869285 1087004570 /nfs/dbraw/zinc/00/45/70/1087004570.db2.gz GHAXJKDAPWQYAE-OAQYLSRUSA-N 2 0 351.494 4.010 20 0 FIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1C ZINC000132634264 1087094748 /nfs/dbraw/zinc/09/47/48/1087094748.db2.gz DQCKSMYKEVYFTM-IBGZPJMESA-N 2 0 352.522 4.111 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4cc(Cl)ccc43)cc2)CC1 ZINC000132790064 1087103216 /nfs/dbraw/zinc/10/32/16/1087103216.db2.gz GZOQFAGQVNVKDN-QFIPXVFZSA-N 2 0 370.924 4.074 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Br)cn1 ZINC000584028463 1087121387 /nfs/dbraw/zinc/12/13/87/1087121387.db2.gz YGSNXZXLZUNDMF-HNNXBMFYSA-N 2 0 354.336 4.151 20 0 FIADRP CC[NH2+]CC1CC[NH+](Cc2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000584053312 1087140675 /nfs/dbraw/zinc/14/06/75/1087140675.db2.gz GPFCYZYTQVZKIP-UHFFFAOYSA-N 2 0 368.521 4.096 20 0 FIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000584142201 1087192330 /nfs/dbraw/zinc/19/23/30/1087192330.db2.gz KTVKULZLWGSKPY-QINSGFPZSA-N 2 0 352.469 4.401 20 0 FIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000657834443 1087214604 /nfs/dbraw/zinc/21/46/04/1087214604.db2.gz KBFYWRHNGZDPDH-GXTWGEPZSA-N 2 0 360.851 4.364 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccccn3)s2)c1 ZINC000084656539 1087356766 /nfs/dbraw/zinc/35/67/66/1087356766.db2.gz CRUIRWKCMBDLCR-UHFFFAOYSA-N 2 0 366.534 4.335 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc2cnccc2o1 ZINC000657866443 1087440338 /nfs/dbraw/zinc/44/03/38/1087440338.db2.gz BZNZENJXOKHHHO-MRXNPFEDSA-N 2 0 353.466 4.009 20 0 FIADRP c1cc2n(n1)CCC[C@H]2[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000657878614 1087521665 /nfs/dbraw/zinc/52/16/65/1087521665.db2.gz YFNMDWCUVPTQAX-JOCHJYFZSA-N 2 0 366.553 4.043 20 0 FIADRP C[C@H]([NH2+][C@@H](c1cnn(C)c1)C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685425673 1087565261 /nfs/dbraw/zinc/56/52/61/1087565261.db2.gz UWVSWOSKRAWNSB-DSKINZAPSA-N 2 0 354.542 4.008 20 0 FIADRP c1coc(C2=CCC[N@@H+](Cc3ccc(OCC[NH+]4CCCC4)cc3)C2)c1 ZINC000685436666 1087567872 /nfs/dbraw/zinc/56/78/72/1087567872.db2.gz RQIQVXQHPFUZBL-UHFFFAOYSA-N 2 0 352.478 4.044 20 0 FIADRP CC[C@@H](C)Oc1cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)ccc1OC ZINC000685463115 1087575628 /nfs/dbraw/zinc/57/56/28/1087575628.db2.gz GRWNLPSEMQBHSN-YLJYHZDGSA-N 2 0 360.542 4.036 20 0 FIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccncc2s1 ZINC000657909446 1087615470 /nfs/dbraw/zinc/61/54/70/1087615470.db2.gz LVYCZLRQSIDAPD-HNNXBMFYSA-N 2 0 352.507 4.259 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1O ZINC000685649176 1087656805 /nfs/dbraw/zinc/65/68/05/1087656805.db2.gz CCLYFYQHCPYIOO-MIVHDCIWSA-N 2 0 368.521 4.208 20 0 FIADRP CCC1(C[NH2+]C2CC(CF)(CF)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000657930487 1087657524 /nfs/dbraw/zinc/65/75/24/1087657524.db2.gz OHEOYCRGJVQNQY-UHFFFAOYSA-N 2 0 350.497 4.356 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2OCc2cccnc2)CC1 ZINC000093688620 1087691104 /nfs/dbraw/zinc/69/11/04/1087691104.db2.gz DTDPCVDLPMGUOH-UHFFFAOYSA-N 2 0 367.537 4.214 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2ccncc2s1 ZINC000657999163 1087696527 /nfs/dbraw/zinc/69/65/27/1087696527.db2.gz SQUJQOXOMFRQFJ-WMZOPIPTSA-N 2 0 351.519 4.469 20 0 FIADRP COc1cc2ccc([C@@H](C)[NH2+]C3CCC([NH+](C)C)CC3)cc2cc1OC ZINC000658037376 1087702710 /nfs/dbraw/zinc/70/27/10/1087702710.db2.gz BTQAQCOTVZHVKY-APMMTJHUSA-N 2 0 356.510 4.380 20 0 FIADRP CC1(c2ccccc2)CCC([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000658067197 1087710376 /nfs/dbraw/zinc/71/03/76/1087710376.db2.gz LRWRKWKEJFFBED-UHFFFAOYSA-N 2 0 370.581 4.368 20 0 FIADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccccc1 ZINC000658143557 1087735449 /nfs/dbraw/zinc/73/54/49/1087735449.db2.gz ZHUYNVREMRVGRZ-PKTZIBPZSA-N 2 0 352.522 4.130 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccccc1 ZINC000658143554 1087735753 /nfs/dbraw/zinc/73/57/53/1087735753.db2.gz ZHUYNVREMRVGRZ-DHIUTWEWSA-N 2 0 352.522 4.130 20 0 FIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000658138000 1087741501 /nfs/dbraw/zinc/74/15/01/1087741501.db2.gz LNTGYYCPKXADNE-DYESRHJHSA-N 2 0 370.562 4.216 20 0 FIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccs1 ZINC000658137531 1087741888 /nfs/dbraw/zinc/74/18/88/1087741888.db2.gz HIIJQMLYZJFJKB-WOJBJXKFSA-N 2 0 358.551 4.192 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000658137319 1087742053 /nfs/dbraw/zinc/74/20/53/1087742053.db2.gz GLFMTADMPPNYJJ-IRXDYDNUSA-N 2 0 364.942 4.209 20 0 FIADRP CC(C)CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccoc1 ZINC000658139247 1087745524 /nfs/dbraw/zinc/74/55/24/1087745524.db2.gz PMVQZBZRJBYDES-YADHBBJMSA-N 2 0 356.510 4.113 20 0 FIADRP C[N@H+](Cc1ccccc1C[NH2+][C@@H]1CCC12CCOCC2)C1CCCCC1 ZINC000548860832 1087746523 /nfs/dbraw/zinc/74/65/23/1087746523.db2.gz XZMGOWOIKOLVOR-JOCHJYFZSA-N 2 0 356.554 4.500 20 0 FIADRP Fc1ccc2c(c1)CCC[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165002 1087759401 /nfs/dbraw/zinc/75/94/01/1087759401.db2.gz HCHQMYXHMPEOAN-JOCHJYFZSA-N 2 0 353.485 4.100 20 0 FIADRP c1cc(C[NH+]2CCC(C[NH2+]C3CCC(OC4CCCC4)CC3)CC2)ccn1 ZINC000658166972 1087763225 /nfs/dbraw/zinc/76/32/25/1087763225.db2.gz WSVHBSTXPSYUHV-UHFFFAOYSA-N 2 0 371.569 4.154 20 0 FIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc2ccccc2n1 ZINC000658168324 1087765314 /nfs/dbraw/zinc/76/53/14/1087765314.db2.gz VYTFPOHXHVRGGH-GOSISDBHSA-N 2 0 360.505 4.193 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658206279 1087794774 /nfs/dbraw/zinc/79/47/74/1087794774.db2.gz IJJUEBKCPZCTPM-DLTYFMDKSA-N 2 0 364.533 4.059 20 0 FIADRP COCc1csc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000658210366 1087799017 /nfs/dbraw/zinc/79/90/17/1087799017.db2.gz RDDHNJBCYKDBQN-UHFFFAOYSA-N 2 0 358.551 4.427 20 0 FIADRP CCCOc1c(Cl)cc(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1OC ZINC000424378686 1087963654 /nfs/dbraw/zinc/96/36/54/1087963654.db2.gz NKVWQVHBASVZJD-HNNXBMFYSA-N 2 0 366.933 4.101 20 0 FIADRP c1ccc2c(c1)C1C[C@H](C[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)C2c2ccccc21 ZINC000647550763 1088063144 /nfs/dbraw/zinc/06/31/44/1088063144.db2.gz GMLZHJQUZPFNOB-NAFYJHQVSA-N 2 0 358.529 4.261 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Br)c(Cl)s2)cc1 ZINC000414806453 1088153345 /nfs/dbraw/zinc/15/33/45/1088153345.db2.gz BTFSHWXAUGTNGA-VIFPVBQESA-N 2 0 359.720 4.474 20 0 FIADRP CC(C)c1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414816758 1088268406 /nfs/dbraw/zinc/26/84/06/1088268406.db2.gz QLOLXIDDCSCIOC-IRXDYDNUSA-N 2 0 353.510 4.337 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)cc1 ZINC000163568368 1088291949 /nfs/dbraw/zinc/29/19/49/1088291949.db2.gz KINHUXCSSAWVDI-SSOJOUAXSA-N 2 0 358.551 4.117 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2ccc3c(c2)[C@@H](C[NH3+])CCC3)c1 ZINC000659291265 1088426014 /nfs/dbraw/zinc/42/60/14/1088426014.db2.gz FPHJMHGUYZPMSQ-HXUWFJFHSA-N 2 0 365.521 4.159 20 0 FIADRP c1ccc(C(c2ccccc2)[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000513897611 1088507740 /nfs/dbraw/zinc/50/77/40/1088507740.db2.gz UDRUDNXMAGPHCM-UHFFFAOYSA-N 2 0 364.533 4.210 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc(OCc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000311799331 1088727651 /nfs/dbraw/zinc/72/76/51/1088727651.db2.gz NEFMSHVYYFZOMY-LJQANCHMSA-N 2 0 352.522 4.128 20 0 FIADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000434777262 1089031854 /nfs/dbraw/zinc/03/18/54/1089031854.db2.gz PFGXKTYQVMNCIA-PGRDOPGGSA-N 2 0 374.569 4.091 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000415013433 1089039865 /nfs/dbraw/zinc/03/98/65/1089039865.db2.gz KWSVPRVPKRFGKL-INIZCTEOSA-N 2 0 354.523 4.208 20 0 FIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415032689 1089070118 /nfs/dbraw/zinc/07/01/18/1089070118.db2.gz IDOCVIFOGYUVKS-NFBKMPQASA-N 2 0 374.532 4.124 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnn(-c2ccc(Cl)cc2)c1)c1ccccc1 ZINC000415045411 1089089862 /nfs/dbraw/zinc/08/98/62/1089089862.db2.gz BQKNPSPYJNWBTO-FQEVSTJZSA-N 2 0 354.885 4.096 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]3CC[NH2+][C@@H](C)C3)s2)cc1 ZINC000415107392 1089168326 /nfs/dbraw/zinc/16/83/26/1089168326.db2.gz NUZVEMYGDHHJEA-DZKIICNBSA-N 2 0 359.539 4.166 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(OCC(F)F)cc2)C1 ZINC000462671719 1089171289 /nfs/dbraw/zinc/17/12/89/1089171289.db2.gz CUUPYACBNZNKDC-IAGOWNOFSA-N 2 0 354.485 4.178 20 0 FIADRP FC(F)(F)c1cccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CC2)c1 ZINC000415121680 1089185008 /nfs/dbraw/zinc/18/50/08/1089185008.db2.gz ZEOYVVFPGXQXSM-KZNAEPCWSA-N 2 0 352.444 4.247 20 0 FIADRP C[C@H]1C[C@@H](C[NH3+])CN1Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435374807 1089566242 /nfs/dbraw/zinc/56/62/42/1089566242.db2.gz YOWMZTHOFFTAGI-GJZGRUSLSA-N 2 0 360.933 4.128 20 0 FIADRP Cn1cc(-c2ccc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)s2)cn1 ZINC000549402846 1090233206 /nfs/dbraw/zinc/23/32/06/1090233206.db2.gz CQAHQPYQSBTSKL-UHFFFAOYSA-N 2 0 372.582 4.237 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000312148359 1090319156 /nfs/dbraw/zinc/31/91/56/1090319156.db2.gz DCBKYDQGTJQECS-BJLQDIEVSA-N 2 0 371.525 4.237 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OC)c(C[NH+]3CCCCC3)c2)C1 ZINC000182564257 1090361433 /nfs/dbraw/zinc/36/14/33/1090361433.db2.gz XJKOGPALSFUEKW-VQTJNVASSA-N 3 0 373.585 4.064 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cn(C)nc2C)cc1C[NH+]1CCCCC1 ZINC000182827896 1090376078 /nfs/dbraw/zinc/37/60/78/1090376078.db2.gz GTMMSQDOKUQJJI-SJORKVTESA-N 2 0 370.541 4.135 20 0 FIADRP C[C@@]1(C[NH2+]Cc2c[nH]nc2-c2ccccc2)CC[N@H+](Cc2ccccc2)C1 ZINC000312454391 1090822500 /nfs/dbraw/zinc/82/25/00/1090822500.db2.gz KITPJQCOVFYMNR-QHCPKHFHSA-N 2 0 360.505 4.079 20 0 FIADRP [NH3+]C[C@H](C[NH+]1CCC(c2noc3cc(F)ccc32)CC1)c1ccc(F)cc1 ZINC000584774836 1090869121 /nfs/dbraw/zinc/86/91/21/1090869121.db2.gz USQCDMKVZDUWPR-MRXNPFEDSA-N 2 0 371.431 4.028 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000584830509 1090925573 /nfs/dbraw/zinc/92/55/73/1090925573.db2.gz SCNYSZSGPKYBQG-OALUTQOASA-N 2 0 370.459 4.044 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(C(=O)OC)cs2)cc1 ZINC000584830841 1090926915 /nfs/dbraw/zinc/92/69/15/1090926915.db2.gz SFPCQWMMTMREDR-OAHLLOKOSA-N 2 0 360.523 4.227 20 0 FIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000136745854 1091152995 /nfs/dbraw/zinc/15/29/95/1091152995.db2.gz CAYNYMDZXUVYRD-NRFANRHFSA-N 2 0 372.553 4.133 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000652042517 1091266966 /nfs/dbraw/zinc/26/69/66/1091266966.db2.gz TWTPTKQGZCTTHB-UHFFFAOYSA-N 2 0 372.394 4.373 20 0 FIADRP COCC[N@H+](C)CC[C@H](Nc1cc[nH+]c2cc(F)ccc12)c1ccccc1 ZINC000500408396 1091458134 /nfs/dbraw/zinc/45/81/34/1091458134.db2.gz KMZSXCATGINEIH-FQEVSTJZSA-N 2 0 367.468 4.495 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1csc(Cl)c1 ZINC000468785988 1091485645 /nfs/dbraw/zinc/48/56/45/1091485645.db2.gz CEOHCIDQCYXOJJ-AWEZNQCLSA-N 2 0 352.931 4.235 20 0 FIADRP C[C@@H](C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000511766248 1091651857 /nfs/dbraw/zinc/65/18/57/1091651857.db2.gz DGSYISHTLVXBEG-OTWHNJEPSA-N 2 0 357.542 4.262 20 0 FIADRP COc1c(F)cccc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001143530475 1091780897 /nfs/dbraw/zinc/78/08/97/1091780897.db2.gz YDWPPQJFXSUDFT-UHFFFAOYSA-N 2 0 356.485 4.178 20 0 FIADRP COCC[C@@H](c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512237457 1091946209 /nfs/dbraw/zinc/94/62/09/1091946209.db2.gz RJZZTCQVMSMWKO-BJKOFHAPSA-N 2 0 364.533 4.362 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000512312341 1092031269 /nfs/dbraw/zinc/03/12/69/1092031269.db2.gz CYTYUBXJWBYOPY-XYJFISCASA-N 2 0 369.553 4.220 20 0 FIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)c(OC)c1 ZINC000512314226 1092031399 /nfs/dbraw/zinc/03/13/99/1092031399.db2.gz NNOLVQRNNWGTJD-HQRMLTQVSA-N 2 0 360.542 4.398 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2Cc3ccccc3O2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011930 1092308364 /nfs/dbraw/zinc/30/83/64/1092308364.db2.gz UJFDDQINVYCORQ-GMQQQROESA-N 2 0 350.506 4.021 20 0 FIADRP C[C@@H]1CC([NH2+]Cc2ccc(-n3ccnc3)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011989 1092315379 /nfs/dbraw/zinc/31/53/79/1092315379.db2.gz USULPXHOVNEIBZ-WOJBJXKFSA-N 2 0 374.532 4.404 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)s1 ZINC000520954245 1092378924 /nfs/dbraw/zinc/37/89/24/1092378924.db2.gz OPICKQGIXRURST-UHFFFAOYSA-N 2 0 357.567 4.057 20 0 FIADRP C[N@H+](Cc1ccccc1NC(=O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCCC1 ZINC000237166610 1092466410 /nfs/dbraw/zinc/46/64/10/1092466410.db2.gz RZZIDUOHPHKMDU-CTXDPNEZSA-N 2 0 369.553 4.310 20 0 FIADRP CC[NH+](CC)C[C@H](C)NC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000521372650 1092665972 /nfs/dbraw/zinc/66/59/72/1092665972.db2.gz DESUAZOAIRXVBC-SFHVURJKSA-N 2 0 374.573 4.303 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]C2CCC(C(F)F)CC2)C[C@@H](C)O1 ZINC000442789615 1092768148 /nfs/dbraw/zinc/76/81/48/1092768148.db2.gz YKLCNJZLBOSMCQ-VPRUJKLYSA-N 2 0 366.496 4.209 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(C)cc2-c2ccnn2C)CC1 ZINC000549802666 1092791457 /nfs/dbraw/zinc/79/14/57/1092791457.db2.gz VQZFPCVFRFPDHE-UHFFFAOYSA-N 2 0 368.569 4.339 20 0 FIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(-c2ccccc2)s1 ZINC000442869729 1092816916 /nfs/dbraw/zinc/81/69/16/1092816916.db2.gz FFDVAFFJIHERIX-KRWDZBQOSA-N 2 0 357.567 4.092 20 0 FIADRP CC(C)C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)cc1 ZINC000442870815 1092817018 /nfs/dbraw/zinc/81/70/18/1092817018.db2.gz ABQRIRBIZOSNSK-LJQANCHMSA-N 2 0 351.966 4.043 20 0 FIADRP COCCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(F)cc1 ZINC000442871573 1092820618 /nfs/dbraw/zinc/82/06/18/1092820618.db2.gz LYWVWDPOGFOEFT-RXVVDRJESA-N 2 0 350.522 4.251 20 0 FIADRP CC(C)(C)OC(=O)Nc1ccsc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000894068738 1092886708 /nfs/dbraw/zinc/88/67/08/1092886708.db2.gz YOYVGSFXUAFYFV-UHFFFAOYSA-N 2 0 365.543 4.059 20 0 FIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000443063954 1092925089 /nfs/dbraw/zinc/92/50/89/1092925089.db2.gz XNRHJLNQETVDAP-QZTJIDSGSA-N 2 0 351.494 4.061 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000521817857 1092937290 /nfs/dbraw/zinc/93/72/90/1092937290.db2.gz VBODDWZGDPLHLE-KDURUIRLSA-N 2 0 352.522 4.463 20 0 FIADRP Cc1cc(C(F)(F)F)cc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)n1 ZINC000663876316 1092985439 /nfs/dbraw/zinc/98/54/39/1092985439.db2.gz NTVAPTKMSVTZSP-CQSZACIVSA-N 2 0 364.415 4.326 20 0 FIADRP C[C@H](c1nc(-c2ccc(C[NH+]3CCCC3)cc2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443218583 1092994662 /nfs/dbraw/zinc/99/46/62/1092994662.db2.gz FUEJLIUWRMUSMJ-IXDOHACOSA-N 2 0 354.498 4.266 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000522035582 1093045779 /nfs/dbraw/zinc/04/57/79/1093045779.db2.gz ZSZWGJRVZFOJLL-UHFFFAOYSA-N 2 0 374.475 4.331 20 0 FIADRP COCCC1(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000512653423 1093080009 /nfs/dbraw/zinc/08/00/09/1093080009.db2.gz FDPWQVLRHVWNDA-FDFHNCONSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)C1CCC(F)(F)CC1 ZINC000474057826 1093164503 /nfs/dbraw/zinc/16/45/03/1093164503.db2.gz PJVJKHPOVITNCP-INIZCTEOSA-N 2 0 354.485 4.321 20 0 FIADRP C[C@H]1CC(n2cc(CC[NH3+])c3ncccc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168019209 1093180928 /nfs/dbraw/zinc/18/09/28/1093180928.db2.gz HMWRQVVKCRYHFA-ROUUACIJSA-N 2 0 362.521 4.152 20 0 FIADRP C[C@@H]1C[C@@H](n2cc(CC[NH3+])c3ncccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168019207 1093181219 /nfs/dbraw/zinc/18/12/19/1093181219.db2.gz HMWRQVVKCRYHFA-RMFSNUHRSA-N 2 0 362.521 4.152 20 0 FIADRP COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000474070002 1093181381 /nfs/dbraw/zinc/18/13/81/1093181381.db2.gz XFJBSTCGADZCAX-INIZCTEOSA-N 2 0 368.477 4.233 20 0 FIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCN(c3ccc(Cl)cc3Cl)C2)CC1 ZINC000474071848 1093186296 /nfs/dbraw/zinc/18/62/96/1093186296.db2.gz GFIFIYOVULCAHT-INIZCTEOSA-N 2 0 370.368 4.425 20 0 FIADRP Cc1cccn2cc(CN[C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)[C@@H](C)C3)nc12 ZINC001168019704 1093190166 /nfs/dbraw/zinc/19/01/66/1093190166.db2.gz JMLONELZHJAZPN-CEQLMSFQSA-N 2 0 362.521 4.174 20 0 FIADRP C[C@@H]1CC([NH2+]CCCC(=O)OC(C)(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020867 1093225856 /nfs/dbraw/zinc/22/58/56/1093225856.db2.gz OBAPDSYVDKRPCQ-QZTJIDSGSA-N 2 0 360.542 4.140 20 0 FIADRP C[C@](O)(CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000248993156 1093323328 /nfs/dbraw/zinc/32/33/28/1093323328.db2.gz NYTLATQKESBBEC-XQUALCHDSA-N 2 0 364.533 4.069 20 0 FIADRP C[C@@H]1CC(N[C@H]2COc3ccc(F)cc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023366 1093355554 /nfs/dbraw/zinc/35/55/54/1093355554.db2.gz VTZOWBMSYLXUOO-ZOCZFRKYSA-N 2 0 354.469 4.290 20 0 FIADRP COCc1cccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168024302 1093385939 /nfs/dbraw/zinc/38/59/39/1093385939.db2.gz DVKJGZHBWMEXPV-BBIADKPPSA-N 2 0 352.522 4.364 20 0 FIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c1 ZINC000512827967 1093407103 /nfs/dbraw/zinc/40/71/03/1093407103.db2.gz NLTDAZWCPOUDDB-UHFFFAOYSA-N 2 0 368.452 4.316 20 0 FIADRP Fc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)cc1Br ZINC000500914512 1093477724 /nfs/dbraw/zinc/47/77/24/1093477724.db2.gz GDSMLTLTGUQLGR-UHFFFAOYSA-N 2 0 357.311 4.334 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2cccc(Cl)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168026978 1093501692 /nfs/dbraw/zinc/50/16/92/1093501692.db2.gz MVQFNTWMTTYRMM-WOSNLTMFSA-N 2 0 372.940 4.405 20 0 FIADRP Clc1ccc(-n2cc(C[NH2+]CCCCC[NH+]3CCCCC3)cn2)cc1 ZINC000500926177 1093573270 /nfs/dbraw/zinc/57/32/70/1093573270.db2.gz ZVRYKLMYTYXZCA-UHFFFAOYSA-N 2 0 360.933 4.272 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000433322023 1093583419 /nfs/dbraw/zinc/58/34/19/1093583419.db2.gz OXKOXTVABFRDBX-QGZVFWFLSA-N 2 0 364.493 4.334 20 0 FIADRP CC(C)C[C@@H](C[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000474280321 1093649698 /nfs/dbraw/zinc/64/96/98/1093649698.db2.gz VJLXOIPTMORFNO-QHCPKHFHSA-N 2 0 371.613 4.307 20 0 FIADRP Clc1ccc(-c2nc(CC[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cs2)cc1 ZINC000246447123 1093677106 /nfs/dbraw/zinc/67/71/06/1093677106.db2.gz OZZIFLSSCKZDLR-WMZOPIPTSA-N 2 0 361.942 4.222 20 0 FIADRP CN(c1ccccc1C[NH2+]CC1(C(F)(F)F)CCC1)C1CC[NH+](C)CC1 ZINC000513037290 1093686508 /nfs/dbraw/zinc/68/65/08/1093686508.db2.gz RPKSSJJMIJKCNQ-UHFFFAOYSA-N 2 0 369.475 4.039 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC000513060655 1093712704 /nfs/dbraw/zinc/71/27/04/1093712704.db2.gz YVQILFLMFBHBHO-MBSDFSHPSA-N 2 0 351.538 4.410 20 0 FIADRP C[C@H](C[NH2+][C@@H](C)Cc1ncc(C(F)(F)F)cc1Cl)C[NH+]1CCCC1 ZINC000623866740 1093734850 /nfs/dbraw/zinc/73/48/50/1093734850.db2.gz DSIGKMYCGSYVJC-OLZOCXBDSA-N 2 0 363.855 4.006 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccccc2Cl)CC1 ZINC000052209960 1093768343 /nfs/dbraw/zinc/76/83/43/1093768343.db2.gz GMEIGEWEACTHAD-UHFFFAOYSA-N 2 0 365.949 4.113 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000513078917 1093780512 /nfs/dbraw/zinc/78/05/12/1093780512.db2.gz XNNNSPANOYARGD-BAGYTPMASA-N 2 0 369.553 4.305 20 0 FIADRP C[C@@H]1CC([NH2+][C@H]2Cc3ccc(F)cc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168035082 1093792915 /nfs/dbraw/zinc/79/29/15/1093792915.db2.gz SNTIUPQRAOWIGE-QZMQVMSPSA-N 2 0 352.497 4.324 20 0 FIADRP CCCn1c2ccccc2nc1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000614388730 1093799464 /nfs/dbraw/zinc/79/94/64/1093799464.db2.gz XTEVUYMUHJWUSJ-RTBURBONSA-N 2 0 356.558 4.294 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)C1 ZINC000614387824 1093804929 /nfs/dbraw/zinc/80/49/29/1093804929.db2.gz OFZWMLFIDZHWGG-RTBURBONSA-N 2 0 374.532 4.398 20 0 FIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000474479512 1093814692 /nfs/dbraw/zinc/81/46/92/1093814692.db2.gz RMNSUAZRLLOYPP-RTBURBONSA-N 2 0 362.558 4.298 20 0 FIADRP C[C@H]1CC([NH2+][C@H]2CCc3ccc(O)cc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168035761 1093815126 /nfs/dbraw/zinc/81/51/26/1093815126.db2.gz UXVMJCWOHMCJGA-SPEDKVCISA-N 2 0 364.533 4.281 20 0 FIADRP CC(C)[C@H](C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1 ZINC000474473064 1093818832 /nfs/dbraw/zinc/81/88/32/1093818832.db2.gz JFDBCNZFFDQJTR-DEOSSOPVSA-N 2 0 366.549 4.173 20 0 FIADRP c1c2ccccc2oc1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000513116123 1093856474 /nfs/dbraw/zinc/85/64/74/1093856474.db2.gz ZTEGEPWBGSJEPV-UHFFFAOYSA-N 2 0 363.505 4.125 20 0 FIADRP COc1cccc(C[NH+]2CCC3(CC2)CC[NH+]([C@H]2C[C@H]4C[C@H]4C2)CC3)c1 ZINC001167934106 1093928201 /nfs/dbraw/zinc/92/82/01/1093928201.db2.gz FWXGWTYZQJEWJI-AERCQKQUSA-N 2 0 354.538 4.172 20 0 FIADRP c1nn(C2CCC2)cc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC001648950992 1093930536 /nfs/dbraw/zinc/93/05/36/1093930536.db2.gz LCMHSWBIRLSEAI-UHFFFAOYSA-N 2 0 352.526 4.274 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)Sc1ccc(Br)cc1 ZINC000246531382 1093940815 /nfs/dbraw/zinc/94/08/15/1093940815.db2.gz VILQQVNWSVQOFL-BMFZPTHFSA-N 2 0 369.372 4.146 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000500979010 1093985547 /nfs/dbraw/zinc/98/55/47/1093985547.db2.gz ABZUHIQZIXQILX-JOCHJYFZSA-N 2 0 361.549 4.063 20 0 FIADRP CC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)Oc1ccccc1C(F)(F)F ZINC000246541118 1094001263 /nfs/dbraw/zinc/00/12/63/1094001263.db2.gz VXFXMAJQRIKRGT-HRCADAONSA-N 2 0 356.432 4.079 20 0 FIADRP COc1cccc(C[C@@H]([NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)C2CC2)c1 ZINC000513393913 1094095531 /nfs/dbraw/zinc/09/55/31/1094095531.db2.gz JMCLJKJWUGRQAA-JOCHJYFZSA-N 2 0 356.485 4.007 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(Br)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000513407689 1094105496 /nfs/dbraw/zinc/10/54/96/1094105496.db2.gz HFWFWQWIHNUXPR-GOEBONIOSA-N 2 0 351.332 4.192 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](Cc2ccccn2)c2cccnc2)cc1 ZINC000513493897 1094162199 /nfs/dbraw/zinc/16/21/99/1094162199.db2.gz DKVWXKPAZJOVMR-XMMPIXPASA-N 2 0 374.532 4.392 20 0 FIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(-n3ccnc3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000513488017 1094166999 /nfs/dbraw/zinc/16/69/99/1094166999.db2.gz NQCMKJQQMVBESW-NZQKXSOJSA-N 2 0 374.532 4.263 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]CC2=Cc3ccccc3OC2)C[N@@H+]1Cc1ccccc1 ZINC000513513835 1094186440 /nfs/dbraw/zinc/18/64/40/1094186440.db2.gz UWKXZBBWDVQKNG-FPOVZHCZSA-N 2 0 362.517 4.353 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cnn(C(C)(C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000513544979 1094206150 /nfs/dbraw/zinc/20/61/50/1094206150.db2.gz NNUDMEJHNGOFQJ-UYAOXDASSA-N 2 0 354.542 4.028 20 0 FIADRP C[C@@H](CCc1ccc(F)cc1F)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000513691253 1094314114 /nfs/dbraw/zinc/31/41/14/1094314114.db2.gz SUPSFQCBIIBNEM-INIZCTEOSA-N 2 0 355.432 4.321 20 0 FIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@H](C)c1ccc(Cl)cc1 ZINC000474596998 1094377033 /nfs/dbraw/zinc/37/70/33/1094377033.db2.gz IHBMSHGEOMAMJQ-XWTMOSNGSA-N 2 0 352.950 4.311 20 0 FIADRP CCC(CC)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1cccs1 ZINC000501028770 1094445849 /nfs/dbraw/zinc/44/58/49/1094445849.db2.gz JTIDVOZOBGWJAI-FQEVSTJZSA-N 2 0 351.604 4.231 20 0 FIADRP C[C@@H]1CC([NH2+]C2CCC(C[NH+](C)C)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041568 1094591508 /nfs/dbraw/zinc/59/15/08/1094591508.db2.gz TVKJWCBONPEYNY-RVEPMOMFSA-N 3 0 357.586 4.138 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000389222022 1094700090 /nfs/dbraw/zinc/70/00/90/1094700090.db2.gz WSEUTXIJKFPMOL-SESVDKBCSA-N 2 0 350.506 4.053 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000474876637 1094838752 /nfs/dbraw/zinc/83/87/52/1094838752.db2.gz DPIRSMLFCTXFEJ-QYZOEREBSA-N 2 0 362.558 4.153 20 0 FIADRP COc1ccc2c(c1)[C@@H]([N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1)CCO2 ZINC000420296733 1094856633 /nfs/dbraw/zinc/85/66/33/1094856633.db2.gz DRJNZFNXULHETF-AVRDEDQJSA-N 2 0 366.505 4.021 20 0 FIADRP CC[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccc(OCc2cccs2)c(OC)c1 ZINC000420299104 1094867898 /nfs/dbraw/zinc/86/78/98/1094867898.db2.gz GHEIWIXHZRURSC-KRWDZBQOSA-N 2 0 374.550 4.157 20 0 FIADRP Clc1ccccc1-c1csc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)n1 ZINC000420340937 1094884668 /nfs/dbraw/zinc/88/46/68/1094884668.db2.gz UCEBIFLRZNETCL-QGZVFWFLSA-N 2 0 361.942 4.428 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)nc(-c2ccc(Cl)cc2)n1 ZINC000420390976 1094909114 /nfs/dbraw/zinc/90/91/14/1094909114.db2.gz IEAXLRAAIHNERE-YLJYHZDGSA-N 2 0 370.928 4.069 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420397676 1094911530 /nfs/dbraw/zinc/91/15/30/1094911530.db2.gz XUTFNQAXFMYDPN-HNJNHCNJSA-N 2 0 357.325 4.273 20 0 FIADRP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420397678 1094911764 /nfs/dbraw/zinc/91/17/64/1094911764.db2.gz XUTFNQAXFMYDPN-MRAWALMUSA-N 2 0 357.325 4.273 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000501772291 1094915135 /nfs/dbraw/zinc/91/51/35/1094915135.db2.gz FIHOGTYWNNAKMW-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP COc1cccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)c1 ZINC000501770913 1094915830 /nfs/dbraw/zinc/91/58/30/1094915830.db2.gz QYHOHPYTRSMLRN-UHFFFAOYSA-N 2 0 373.566 4.373 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501784466 1094923417 /nfs/dbraw/zinc/92/34/17/1094923417.db2.gz GNSDUEODKKEAAA-MRXNPFEDSA-N 2 0 365.949 4.029 20 0 FIADRP C[C@H](C(=O)Nc1cccc2ccccc21)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501788019 1094924288 /nfs/dbraw/zinc/92/42/88/1094924288.db2.gz CDPKMPGOBRQIBB-GOSISDBHSA-N 2 0 367.537 4.221 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)CC1 ZINC000501982843 1095035535 /nfs/dbraw/zinc/03/55/35/1095035535.db2.gz VYRUBZVJKBXKCM-SMIHKQSGSA-N 2 0 369.597 4.061 20 0 FIADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000522551456 1095133713 /nfs/dbraw/zinc/13/37/13/1095133713.db2.gz JBOGHZBVTSFAQJ-FPOVZHCZSA-N 2 0 351.538 4.003 20 0 FIADRP CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ccc(CN2CCOCC2)cc1 ZINC000420932435 1095172827 /nfs/dbraw/zinc/17/28/27/1095172827.db2.gz HAVBXVKKYIGQRT-JOCHJYFZSA-N 2 0 368.521 4.158 20 0 FIADRP C[NH+]1CCC(CC[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000237157350 1095315995 /nfs/dbraw/zinc/31/59/95/1095315995.db2.gz LZMZOELOZWUGCP-UHFFFAOYSA-N 2 0 355.309 4.091 20 0 FIADRP CC[NH+](CC)Cc1cccc(CNCc2cnc(C(F)(F)F)s2)c1 ZINC000443978480 1095569596 /nfs/dbraw/zinc/56/95/96/1095569596.db2.gz KRPSISYMLZRQTJ-UHFFFAOYSA-N 2 0 357.445 4.294 20 0 FIADRP CCCOc1c(Cl)cc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1OC ZINC000421379868 1095580277 /nfs/dbraw/zinc/58/02/77/1095580277.db2.gz XPEDGJXJJVSIDQ-UHFFFAOYSA-N 2 0 354.922 4.100 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cnn(C2CCCC2)c1 ZINC000502685267 1095714445 /nfs/dbraw/zinc/71/44/45/1095714445.db2.gz PHXRHIUPVXXGQK-SFHVURJKSA-N 2 0 352.526 4.445 20 0 FIADRP CO[C@@H]1CCC[C@@H]2C[N@@H+](C3C[C@H](C)[NH+](Cc4ccccc4)[C@@H](C)C3)C[C@@H]21 ZINC001168050490 1095721350 /nfs/dbraw/zinc/72/13/50/1095721350.db2.gz BGGBUPCVJYQBFQ-SWCJPYALSA-N 2 0 356.554 4.175 20 0 FIADRP C[C@H](c1ncc(C(C)(C)C)o1)N1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000281952744 1095776200 /nfs/dbraw/zinc/77/62/00/1095776200.db2.gz FRFGAJNLIKLSGC-CVEARBPZSA-N 2 0 356.514 4.446 20 0 FIADRP COc1ccc(Cl)cc1C[C@H]1CCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000502880587 1095917782 /nfs/dbraw/zinc/91/77/82/1095917782.db2.gz QGNXQXUKYHZHSL-VQIMIIECSA-N 2 0 350.934 4.087 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccncc3Cl)CC2)cc1 ZINC000421825579 1095938738 /nfs/dbraw/zinc/93/87/38/1095938738.db2.gz OGQGEGASZMXOIO-MRXNPFEDSA-N 2 0 373.928 4.306 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000513762039 1096020515 /nfs/dbraw/zinc/02/05/15/1096020515.db2.gz PKHLWIHUUDUVMY-UHFFFAOYSA-N 2 0 374.532 4.421 20 0 FIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000414654330 1096349843 /nfs/dbraw/zinc/34/98/43/1096349843.db2.gz BYKPKUFMXQAMSH-RBUKOAKNSA-N 2 0 360.505 4.017 20 0 FIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422701439 1096456175 /nfs/dbraw/zinc/45/61/75/1096456175.db2.gz BYFITYQVRNNIKV-ODMLGRRDSA-N 2 0 354.469 4.338 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000422730678 1096464186 /nfs/dbraw/zinc/46/41/86/1096464186.db2.gz FDXQWCQFSBSEOQ-JKSUJKDBSA-N 2 0 355.526 4.264 20 0 FIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422732372 1096465153 /nfs/dbraw/zinc/46/51/53/1096465153.db2.gz PTEPOLOLCITCRB-OALUTQOASA-N 2 0 370.368 4.207 20 0 FIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000422715845 1096469387 /nfs/dbraw/zinc/46/93/87/1096469387.db2.gz MUSVDZGCJOFMBK-JXFKEZNVSA-N 2 0 354.473 4.024 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)CCc1ccc(OC(C)C)cc1 ZINC000422722131 1096471906 /nfs/dbraw/zinc/47/19/06/1096471906.db2.gz OWQJSDHMBPOSJL-SJORKVTESA-N 2 0 355.526 4.308 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000422726870 1096473860 /nfs/dbraw/zinc/47/38/60/1096473860.db2.gz GEEIILJOHPGFAJ-CQSZACIVSA-N 2 0 358.357 4.065 20 0 FIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000422736267 1096476290 /nfs/dbraw/zinc/47/62/90/1096476290.db2.gz GEEWHJCEEHIFFU-CGBQZSDPSA-N 2 0 355.345 4.092 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000422778216 1096489015 /nfs/dbraw/zinc/48/90/15/1096489015.db2.gz GUQGEEMPOIMKFL-GOSISDBHSA-N 3 0 366.553 4.076 20 0 FIADRP [NH3+][C@H]1C[C@H](NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)c2ccccc21 ZINC000422778906 1096489284 /nfs/dbraw/zinc/48/92/84/1096489284.db2.gz FGMKEJRPCHZNAT-SFTDATJTSA-N 2 0 355.913 4.039 20 0 FIADRP c1sc(-c2ccccc2)nc1CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422781371 1096490409 /nfs/dbraw/zinc/49/04/09/1096490409.db2.gz IQTQXJMKTIUZNT-XUVXKRRUSA-N 2 0 355.551 4.253 20 0 FIADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422789660 1096498146 /nfs/dbraw/zinc/49/81/46/1096498146.db2.gz OSNIGGZHYWPMTB-ZBFHGGJFSA-N 2 0 365.399 4.110 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000422825151 1096500433 /nfs/dbraw/zinc/50/04/33/1096500433.db2.gz JDLWIRLDHUATJE-YJYMSZOUSA-N 2 0 361.436 4.178 20 0 FIADRP Cc1ccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422857051 1096505980 /nfs/dbraw/zinc/50/59/80/1096505980.db2.gz GNKPNHGWLPPVTQ-YPAWHYETSA-N 2 0 366.505 4.034 20 0 FIADRP CCCOc1cc(C)ccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422863302 1096506852 /nfs/dbraw/zinc/50/68/52/1096506852.db2.gz RRTGNARVBGWFDB-OFNKIYASSA-N 2 0 366.505 4.129 20 0 FIADRP CSc1cc(C)ccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422882274 1096512412 /nfs/dbraw/zinc/51/24/12/1096512412.db2.gz ZVJZEAUITYSYGW-RXVVDRJESA-N 2 0 354.519 4.062 20 0 FIADRP Fc1ccc(Oc2ccnc(CN[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2)cc1 ZINC000422886277 1096513508 /nfs/dbraw/zinc/51/35/08/1096513508.db2.gz IRNMASFDOKZXPK-BHIFYINESA-N 2 0 369.484 4.413 20 0 FIADRP c1ccc(SC2(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)CC2)cc1 ZINC000422911330 1096521483 /nfs/dbraw/zinc/52/14/83/1096521483.db2.gz STNUIQFGXMMGJW-CTNGQTDRSA-N 2 0 366.530 4.157 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000422911232 1096521982 /nfs/dbraw/zinc/52/19/82/1096521982.db2.gz KKYSTLWMVXGMBE-AWEZNQCLSA-N 2 0 358.555 4.246 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2C[C@H]4CC[C@@H](C2)[NH2+]4)CCC3)cc1 ZINC000422913038 1096522263 /nfs/dbraw/zinc/52/22/63/1096522263.db2.gz XMVZLHCNWNBUDJ-ONYGOOLBSA-N 2 0 369.534 4.069 20 0 FIADRP C[C@H]1CCN(C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)[C@@H](C[NH3+])C1 ZINC000414704263 1096526309 /nfs/dbraw/zinc/52/63/09/1096526309.db2.gz DGFJNNHFVNNSNW-FXAWDEMLSA-N 2 0 372.557 4.042 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000422934844 1096529453 /nfs/dbraw/zinc/52/94/53/1096529453.db2.gz KGOHPKOMXRNNIN-VQIMIIECSA-N 2 0 367.320 4.426 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2cccc(Br)c2)CCC1 ZINC000422937949 1096530270 /nfs/dbraw/zinc/53/02/70/1096530270.db2.gz KDLWQNFQCQTJDF-CQSZACIVSA-N 2 0 374.326 4.341 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 ZINC000422938197 1096530386 /nfs/dbraw/zinc/53/03/86/1096530386.db2.gz GVSDTUOVZVXIBR-WOJBJXKFSA-N 2 0 356.897 4.123 20 0 FIADRP COc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)cc2)cc1 ZINC000422918031 1096531367 /nfs/dbraw/zinc/53/13/67/1096531367.db2.gz HDGVZZGLRIYIFV-MRXNPFEDSA-N 2 0 361.489 4.375 20 0 FIADRP Clc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422943033 1096531746 /nfs/dbraw/zinc/53/17/46/1096531746.db2.gz XOAWDASOTQOTHD-ZJOUEHCJSA-N 2 0 354.881 4.173 20 0 FIADRP COc1cc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)ccc1OC1CCCC1 ZINC000422944419 1096531771 /nfs/dbraw/zinc/53/17/71/1096531771.db2.gz SAKNRAPFVKKBKL-OAHLLOKOSA-N 2 0 369.509 4.030 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000422964613 1096533565 /nfs/dbraw/zinc/53/35/65/1096533565.db2.gz JBLIWVQFJFODAZ-UHFFFAOYSA-N 3 0 351.538 4.022 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](COc1ccccc1)c1ccccc1 ZINC000422959615 1096539811 /nfs/dbraw/zinc/53/98/11/1096539811.db2.gz SVSJRXIDUASOEX-WZONZLPQSA-N 2 0 361.489 4.320 20 0 FIADRP Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422993767 1096542298 /nfs/dbraw/zinc/54/22/98/1096542298.db2.gz GDYXQTIXXUMNKC-MTNREXPMSA-N 2 0 353.510 4.198 20 0 FIADRP Clc1ccc(COCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000423021798 1096551624 /nfs/dbraw/zinc/55/16/24/1096551624.db2.gz CXHLGRLQGKECLJ-JQHSSLGASA-N 2 0 357.325 4.020 20 0 FIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000423035613 1096556237 /nfs/dbraw/zinc/55/62/37/1096556237.db2.gz SADHWNIFUKZMTA-HNAYVOBHSA-N 2 0 370.368 4.065 20 0 FIADRP CC(C)N1CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])[C@@H]1c1ccc(Cl)c(F)c1 ZINC000423043161 1096558283 /nfs/dbraw/zinc/55/82/83/1096558283.db2.gz NNVPEBRAWYAWSK-ZMYBRWDISA-N 2 0 355.929 4.110 20 0 FIADRP CC(C)N1CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])[C@H]1c1ccc(Cl)c(F)c1 ZINC000423043160 1096558568 /nfs/dbraw/zinc/55/85/68/1096558568.db2.gz NNVPEBRAWYAWSK-NIKGAXFTSA-N 2 0 355.929 4.110 20 0 FIADRP FC(F)(F)COc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423096248 1096573261 /nfs/dbraw/zinc/57/32/61/1096573261.db2.gz OHLVEJJDIVZPAB-CEXWTWQISA-N 2 0 370.459 4.071 20 0 FIADRP Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423122713 1096578460 /nfs/dbraw/zinc/57/84/60/1096578460.db2.gz LAVLJJWDVHFAEP-ZHZIRGLKSA-N 2 0 374.326 4.180 20 0 FIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC000423123981 1096579767 /nfs/dbraw/zinc/57/97/67/1096579767.db2.gz NUAZONLUVXHSEW-ZSYWTGECSA-N 2 0 354.460 4.308 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000423106709 1096583935 /nfs/dbraw/zinc/58/39/35/1096583935.db2.gz OUCBJASLRSCBPW-XZBHBCHMSA-N 3 0 363.977 4.361 20 0 FIADRP Brc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423144831 1096587130 /nfs/dbraw/zinc/58/71/30/1096587130.db2.gz ZNGMICYPQNWMJN-WSIUPNEHSA-N 2 0 363.343 4.205 20 0 FIADRP Clc1cccc(CC2([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000423154809 1096589901 /nfs/dbraw/zinc/58/99/01/1096589901.db2.gz JXFAJDITCNMGTQ-DENIHFKCSA-N 2 0 368.908 4.261 20 0 FIADRP FC(F)O[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000503950469 1096602180 /nfs/dbraw/zinc/60/21/80/1096602180.db2.gz UHFIVSARMDGUJI-CENDIDJXSA-N 2 0 364.480 4.037 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@@H]1CCC[NH2+]C1 ZINC000423209412 1096609037 /nfs/dbraw/zinc/60/90/37/1096609037.db2.gz FFQDULLZEDMYJW-YSVLISHTSA-N 2 0 359.514 4.304 20 0 FIADRP Cc1ncsc1C[N@H+](C[C@H](C)CCc1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC000414722872 1096609835 /nfs/dbraw/zinc/60/98/35/1096609835.db2.gz GOEOUVSQBFTHFU-YLJYHZDGSA-N 2 0 357.567 4.132 20 0 FIADRP Brc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423248783 1096629389 /nfs/dbraw/zinc/62/93/89/1096629389.db2.gz NUOXRKWHDNFYNP-KXBFYZLASA-N 2 0 359.311 4.128 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1cc(Cl)ccc1Cl)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414727761 1096629454 /nfs/dbraw/zinc/62/94/54/1096629454.db2.gz BOBFDISXDLHNGK-KGLIPLIRSA-N 2 0 372.340 4.032 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423256436 1096631979 /nfs/dbraw/zinc/63/19/79/1096631979.db2.gz DZZVBFLCSOVHKV-OXJNMPFZSA-N 2 0 360.448 4.357 20 0 FIADRP Fc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423258702 1096632757 /nfs/dbraw/zinc/63/27/57/1096632757.db2.gz MMPQJPDWJSMZBN-GAJHUEQPSA-N 2 0 363.480 4.443 20 0 FIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@]3(C)CCC[NH2+]C3)s2)cc1 ZINC000423315747 1096641478 /nfs/dbraw/zinc/64/14/78/1096641478.db2.gz AELSGHKQDWOJJH-XOBRGWDASA-N 2 0 359.539 4.167 20 0 FIADRP CC1(C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]CC1 ZINC000423315706 1096642047 /nfs/dbraw/zinc/64/20/47/1096642047.db2.gz AASSGWQUVRURRN-IBGZPJMESA-N 2 0 360.448 4.357 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423300347 1096645333 /nfs/dbraw/zinc/64/53/33/1096645333.db2.gz RJARRCIXGBXMJK-GHMZBOCLSA-N 2 0 368.344 4.126 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)C(C)(C)[C@H]([NH3+])c2ccccc2)c1 ZINC000423330394 1096648995 /nfs/dbraw/zinc/64/89/95/1096648995.db2.gz NQJDHCFVHGIFTL-HXUWFJFHSA-N 2 0 353.510 4.193 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)C(C)(C)[C@@H]([NH3+])c2ccccc2)c1 ZINC000423330370 1096648999 /nfs/dbraw/zinc/64/89/99/1096648999.db2.gz NQJDHCFVHGIFTL-FQEVSTJZSA-N 2 0 353.510 4.193 20 0 FIADRP Brc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423392414 1096663812 /nfs/dbraw/zinc/66/38/12/1096663812.db2.gz QBVXLPLTJCSZDX-SFHVURJKSA-N 2 0 373.294 4.056 20 0 FIADRP CC1CC[NH+](CCC[C@H](N[C@H]2CC[NH2+][C@@H](C)C2)c2ccc(F)cc2)CC1 ZINC000423392994 1096665032 /nfs/dbraw/zinc/66/50/32/1096665032.db2.gz XZGCYOQZVXGOTK-NYVOZVTQSA-N 2 0 361.549 4.109 20 0 FIADRP COCC1(C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]CC1 ZINC000423396340 1096666519 /nfs/dbraw/zinc/66/65/19/1096666519.db2.gz BIHVPGBBWIVKMN-HXUWFJFHSA-N 2 0 358.913 4.035 20 0 FIADRP CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1Cl)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414739240 1096668524 /nfs/dbraw/zinc/66/85/24/1096668524.db2.gz PXUZRDQLVRJUMJ-ZIAGYGMSSA-N 2 0 372.340 4.032 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)cc(Br)c1 ZINC000423402168 1096671065 /nfs/dbraw/zinc/67/10/65/1096671065.db2.gz WIXPNCQSOAEPHE-SFHVURJKSA-N 2 0 363.274 4.432 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cnn1-c1cc(C)ccc1C ZINC000423406087 1096673160 /nfs/dbraw/zinc/67/31/60/1096673160.db2.gz YLORBAMSFJNCPQ-QGZVFWFLSA-N 2 0 360.505 4.252 20 0 FIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423407444 1096673555 /nfs/dbraw/zinc/67/35/55/1096673555.db2.gz VVMKIARZVPCOHZ-BHDSKKPTSA-N 2 0 354.338 4.373 20 0 FIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423434959 1096685906 /nfs/dbraw/zinc/68/59/06/1096685906.db2.gz KVWNMLAIJXLQQQ-ZOCIIQOWSA-N 2 0 355.551 4.466 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC000423438113 1096686805 /nfs/dbraw/zinc/68/68/05/1096686805.db2.gz MPOZMJLJMPHJHJ-XGXHKWSGSA-N 2 0 352.444 4.319 20 0 FIADRP Cc1c([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cnn1-c1ccc(Cl)cc1Cl ZINC000423458603 1096689946 /nfs/dbraw/zinc/68/99/46/1096689946.db2.gz QGYSLERVXVWONQ-VXGBXAGGSA-N 2 0 355.313 4.266 20 0 FIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(OC(F)F)cc1OC(F)F ZINC000423471310 1096694238 /nfs/dbraw/zinc/69/42/38/1096694238.db2.gz FAQOMAMDXURKLH-NWDGAFQWSA-N 2 0 364.383 4.072 20 0 FIADRP FC(F)Oc1ccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423483138 1096703576 /nfs/dbraw/zinc/70/35/76/1096703576.db2.gz PYMUUJKFJKSYBC-ICSRJNTNSA-N 2 0 360.448 4.499 20 0 FIADRP NC1(C[NH2+][C@H]2CCCCC23CCCC3)CC[NH+](Cc2ccccc2)CC1 ZINC000423528009 1096707435 /nfs/dbraw/zinc/70/74/35/1096707435.db2.gz NHKPYTGJHFGVFU-NRFANRHFSA-N 2 0 355.570 4.073 20 0 FIADRP COc1cc(OC)c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1Cl ZINC000423496702 1096707730 /nfs/dbraw/zinc/70/77/30/1096707730.db2.gz FKDMDSNMELJTKH-RDTXWAMCSA-N 2 0 362.901 4.488 20 0 FIADRP COc1ccc([C@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423540863 1096716585 /nfs/dbraw/zinc/71/65/85/1096716585.db2.gz QXYKQIJAVJSEOO-NRFANRHFSA-N 2 0 356.897 4.337 20 0 FIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc2cc(Br)ccc2o1 ZINC000423541719 1096716643 /nfs/dbraw/zinc/71/66/43/1096716643.db2.gz LNOBYULSJLNJMJ-KLZCAUPSSA-N 2 0 363.299 4.234 20 0 FIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423539356 1096716687 /nfs/dbraw/zinc/71/66/87/1096716687.db2.gz IEFBDQWZFCOHHH-NASSWSRMSA-N 2 0 350.506 4.401 20 0 FIADRP COc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2ccccc2Cl)c1 ZINC000423542233 1096717615 /nfs/dbraw/zinc/71/76/15/1096717615.db2.gz MEUXNVLJQQEPPS-AYMMHLMVSA-N 2 0 370.924 4.416 20 0 FIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423550588 1096719233 /nfs/dbraw/zinc/71/92/33/1096719233.db2.gz SWNURGWCDFOWTC-AEIBSFOJSA-N 2 0 352.444 4.319 20 0 FIADRP Cc1ncsc1CN(C[C@@H]1CC[NH2+]C1)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000436056240 1098681722 /nfs/dbraw/zinc/68/17/22/1098681722.db2.gz SHVRXDGYWQIURJ-UONOGXRCSA-N 2 0 367.921 4.417 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H](c2ccnn2C)C1 ZINC000515591804 1098758635 /nfs/dbraw/zinc/75/86/35/1098758635.db2.gz AYROVRJGKKNTME-GHTZIAJQSA-N 2 0 354.542 4.078 20 0 FIADRP CSC1(C[NH2+][C@H]2CCCOc3c(C(C)C)cccc32)CC[NH+](C)CC1 ZINC000515716976 1098868610 /nfs/dbraw/zinc/86/86/10/1098868610.db2.gz XNCCFGKGJABURO-IBGZPJMESA-N 2 0 362.583 4.441 20 0 FIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436296565 1098910152 /nfs/dbraw/zinc/91/01/52/1098910152.db2.gz UYJKUPRRHYLOGV-BHIYHBOVSA-N 2 0 356.485 4.363 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@@H](C)C1 ZINC000436302385 1098915471 /nfs/dbraw/zinc/91/54/71/1098915471.db2.gz UEADMBQOXNCXAC-BVPXEZJJSA-N 2 0 364.961 4.313 20 0 FIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000515900790 1099019809 /nfs/dbraw/zinc/01/98/09/1099019809.db2.gz YVBVXXIVKHIQHY-DHIUTWEWSA-N 2 0 368.496 4.023 20 0 FIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)co2)cc1 ZINC000533469086 1099079227 /nfs/dbraw/zinc/07/92/27/1099079227.db2.gz AMJNGQIDUNMTRA-UHFFFAOYSA-N 2 0 371.525 4.293 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000505925548 1099506075 /nfs/dbraw/zinc/50/60/75/1099506075.db2.gz USIZCAVTWHOTKN-SFTDATJTSA-N 2 0 365.606 4.002 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000467352572 1099538075 /nfs/dbraw/zinc/53/80/75/1099538075.db2.gz HXTGFDOOBFGJSW-NRFANRHFSA-N 2 0 356.485 4.453 20 0 FIADRP c1cc2c(s1)CCC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000161937953 1099547805 /nfs/dbraw/zinc/54/78/05/1099547805.db2.gz DCMPOXYECWVJQA-HXUWFJFHSA-N 2 0 356.535 4.390 20 0 FIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000516620387 1099660959 /nfs/dbraw/zinc/66/09/59/1099660959.db2.gz KIKCWIASHAENLH-YXIAPDDASA-N 2 0 356.554 4.365 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000162498711 1099810725 /nfs/dbraw/zinc/81/07/25/1099810725.db2.gz CXVUWZXMBKUAPO-FQEVSTJZSA-N 2 0 374.912 4.284 20 0 FIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000162497776 1099811305 /nfs/dbraw/zinc/81/13/05/1099811305.db2.gz URKPEPRFDHYEPR-HNNXBMFYSA-N 2 0 361.555 4.366 20 0 FIADRP COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)cc1O ZINC000437350643 1099821286 /nfs/dbraw/zinc/82/12/86/1099821286.db2.gz WHSKDSNIMSRXHC-PXNSSMCTSA-N 2 0 360.542 4.109 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000508695414 1099826636 /nfs/dbraw/zinc/82/66/36/1099826636.db2.gz FKIRDUFWWYDLQR-TWWGPRNNSA-N 2 0 350.506 4.051 20 0 FIADRP CC(C)c1nc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC000508693240 1099827079 /nfs/dbraw/zinc/82/70/79/1099827079.db2.gz CPNJAKCBBLYOLJ-IEBWSBKVSA-N 2 0 357.567 4.309 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508697997 1099831557 /nfs/dbraw/zinc/83/15/57/1099831557.db2.gz KPYCSKMQAGRMIZ-GIWBLDEGSA-N 3 0 357.586 4.141 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508702250 1099857286 /nfs/dbraw/zinc/85/72/86/1099857286.db2.gz VZBCVXKACOATEQ-KHUIQGCPSA-N 3 0 371.613 4.245 20 0 FIADRP CCOCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508703570 1099857347 /nfs/dbraw/zinc/85/73/47/1099857347.db2.gz YWTAGFDSYRTLEB-RBBKRZOGSA-N 2 0 358.570 4.474 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508702248 1099858458 /nfs/dbraw/zinc/85/84/58/1099858458.db2.gz VZBCVXKACOATEQ-HYVLGVRCSA-N 3 0 371.613 4.245 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000508714827 1099885201 /nfs/dbraw/zinc/88/52/01/1099885201.db2.gz CAAKPCUOZVVPQH-VJBMBRPKSA-N 2 0 351.538 4.321 20 0 FIADRP Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508708805 1099888227 /nfs/dbraw/zinc/88/82/27/1099888227.db2.gz DVUPAKPBNYOWIJ-SIKLNZKXSA-N 2 0 351.538 4.379 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000508722915 1099943207 /nfs/dbraw/zinc/94/32/07/1099943207.db2.gz YXOWVJJDWMAJFH-XUZZJYLKSA-N 3 0 371.613 4.245 20 0 FIADRP CC1CC[NH+](C[C@@H]2CCCN(Cc3c[nH]nc3-c3ccsc3)C2)CC1 ZINC000437703799 1100112710 /nfs/dbraw/zinc/11/27/10/1100112710.db2.gz WRWRJWWLQZPMQM-KRWDZBQOSA-N 2 0 358.555 4.082 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2c(O)cccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000517187775 1100159422 /nfs/dbraw/zinc/15/94/22/1100159422.db2.gz YKJJSRKGZYWFHP-LQBOVUBWSA-N 2 0 350.506 4.270 20 0 FIADRP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+]Cc1cc(C2CC[NH2+]CC2)no1 ZINC000425894017 1100186078 /nfs/dbraw/zinc/18/60/78/1100186078.db2.gz FOFPDAINXSXDPO-GOSISDBHSA-N 2 0 373.566 4.419 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000459452685 1100190998 /nfs/dbraw/zinc/19/09/98/1100190998.db2.gz WJTYIUOYGRVQLJ-AWEZNQCLSA-N 2 0 365.399 4.300 20 0 FIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000536696804 1100201493 /nfs/dbraw/zinc/20/14/93/1100201493.db2.gz OLPUPTLDUPHHGB-UHFFFAOYSA-N 2 0 368.569 4.102 20 0 FIADRP COc1cccc([C@@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000536703541 1100208332 /nfs/dbraw/zinc/20/83/32/1100208332.db2.gz ROBGJFMOZXXRDJ-GOSISDBHSA-N 2 0 353.510 4.390 20 0 FIADRP COc1ccc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1OC ZINC000379625507 1100223087 /nfs/dbraw/zinc/22/30/87/1100223087.db2.gz FTKGDRYMPCTUHC-MSOLQXFVSA-N 2 0 356.510 4.265 20 0 FIADRP C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000379628434 1100245325 /nfs/dbraw/zinc/24/53/25/1100245325.db2.gz JAOGPJPPFIUSTM-WFXMLNOXSA-N 2 0 366.505 4.162 20 0 FIADRP CCOc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc(Cl)c1O ZINC000459509925 1100263539 /nfs/dbraw/zinc/26/35/39/1100263539.db2.gz WKJVILMRYDCJLS-KRWDZBQOSA-N 2 0 374.912 4.056 20 0 FIADRP Brc1ccc(/C=C\C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459586656 1100309451 /nfs/dbraw/zinc/30/94/51/1100309451.db2.gz VSRZQMJTJACURY-UPHRSURJSA-N 2 0 372.310 4.116 20 0 FIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+][C@H]4CC[N@H+](C)[C@@H](C)C4)cc3)ccc2O1 ZINC000536842171 1100355421 /nfs/dbraw/zinc/35/54/21/1100355421.db2.gz WLQHAHIDKNDPLD-JKSBSHDWSA-N 2 0 350.506 4.249 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCOC3(CCSCC3)C2)CC1 ZINC000536851253 1100365013 /nfs/dbraw/zinc/36/50/13/1100365013.db2.gz KJSZXNWYDSNYLX-MISYRCLQSA-N 2 0 366.615 4.064 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCOC3(CCSCC3)C2)CC1 ZINC000536851258 1100365620 /nfs/dbraw/zinc/36/56/20/1100365620.db2.gz KJSZXNWYDSNYLX-YZGWKJHDSA-N 2 0 366.615 4.064 20 0 FIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536856344 1100371842 /nfs/dbraw/zinc/37/18/42/1100371842.db2.gz FBMUOYAUHUYHBN-ZACQAIPSSA-N 2 0 372.475 4.115 20 0 FIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000536860372 1100376855 /nfs/dbraw/zinc/37/68/55/1100376855.db2.gz YZWLFHBEWJDTLU-MDZRGWNJSA-N 2 0 370.484 4.218 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536864390 1100381169 /nfs/dbraw/zinc/38/11/69/1100381169.db2.gz SPUDSRPOTZXEIU-KRWDZBQOSA-N 2 0 360.546 4.084 20 0 FIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000459652835 1100396409 /nfs/dbraw/zinc/39/64/09/1100396409.db2.gz QVRQBYIKQFPSJM-NHCUHLMSSA-N 2 0 365.565 4.478 20 0 FIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000438093289 1100416307 /nfs/dbraw/zinc/41/63/07/1100416307.db2.gz BUIKPXMIUOOSRJ-GMAHTHKFSA-N 2 0 358.570 4.320 20 0 FIADRP Cc1ccc2cc(C[N@H+](C)C[C@H]3CC[NH+](Cc4ccccc4)C3)ccc2n1 ZINC000438110084 1100435486 /nfs/dbraw/zinc/43/54/86/1100435486.db2.gz NLTXICFRGHWFBD-JOCHJYFZSA-N 2 0 359.517 4.497 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC[NH2+]1 ZINC000414946494 1100902495 /nfs/dbraw/zinc/90/24/95/1100902495.db2.gz JSJLFUFZGSNCSF-GOEBONIOSA-N 2 0 360.933 4.189 20 0 FIADRP C[C@@H](CCCO)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000438836874 1100954909 /nfs/dbraw/zinc/95/49/09/1100954909.db2.gz ORXWCCUVLFKORH-RXVVDRJESA-N 2 0 350.522 4.130 20 0 FIADRP O=C(Nc1cccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1)c1ccccc1Cl ZINC000414970419 1101035493 /nfs/dbraw/zinc/03/54/93/1101035493.db2.gz KLYNAWLQRGLYGX-QGZVFWFLSA-N 2 0 371.912 4.214 20 0 FIADRP c1ccc(C[NH+]2CCCCC2)c(CNc2cc(N3CCCCC3)ncn2)c1 ZINC000518351283 1101113457 /nfs/dbraw/zinc/11/34/57/1101113457.db2.gz ROQMZOQJTQWLSF-UHFFFAOYSA-N 2 0 365.525 4.065 20 0 FIADRP Brc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)s1 ZINC000439146573 1101200961 /nfs/dbraw/zinc/20/09/61/1101200961.db2.gz NCKPQBPJXULECY-WOSRLPQWSA-N 2 0 355.345 4.178 20 0 FIADRP COc1ccc2c(c1)c(C[C@H](C)[NH3+])cn2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167963749 1101206196 /nfs/dbraw/zinc/20/61/96/1101206196.db2.gz CGVYFFWRYURRSX-LATSOQNDSA-N 2 0 367.537 4.118 20 0 FIADRP CC(C)(C)OC(=O)c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167963809 1101238490 /nfs/dbraw/zinc/23/84/90/1101238490.db2.gz FELCFSNZTGCPQX-SEJPIABJSA-N 2 0 370.537 4.137 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)C1 ZINC000414991873 1101285987 /nfs/dbraw/zinc/28/59/87/1101285987.db2.gz BHBZWQSPAQDPMZ-GXFFZTMASA-N 2 0 365.237 4.075 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1OCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000426342644 1101316550 /nfs/dbraw/zinc/31/65/50/1101316550.db2.gz MUULIVRPXLEGQR-CKJXQJPGSA-N 2 0 374.550 4.042 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC(Nc2cnn(-c3cc[nH+]cc3)c2)CC1 ZINC000671119265 1101325258 /nfs/dbraw/zinc/32/52/58/1101325258.db2.gz CUZOSNBCWAKFOQ-UHFFFAOYSA-N 2 0 361.493 4.122 20 0 FIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)C1 ZINC000414998959 1101458579 /nfs/dbraw/zinc/45/85/79/1101458579.db2.gz REUJRKLOLOYQIL-HZMBPMFUSA-N 2 0 365.237 4.075 20 0 FIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2C[C@@H](C)[C@H](C)C2)cc1)c1cncs1 ZINC000537093173 1101460496 /nfs/dbraw/zinc/46/04/96/1101460496.db2.gz AANNPMVQVYOPRD-KURKYZTESA-N 2 0 373.566 4.003 20 0 FIADRP C[N@@H+](Cc1cn(-c2ccccc2)nc1-c1cccs1)CC1CC[NH2+]CC1 ZINC000178955963 1101540366 /nfs/dbraw/zinc/54/03/66/1101540366.db2.gz HIJOSRFBMVBUCT-UHFFFAOYSA-N 2 0 366.534 4.032 20 0 FIADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190011 1101541021 /nfs/dbraw/zinc/54/10/21/1101541021.db2.gz OBZABMVZXSLYRQ-DWLFOUALSA-N 2 0 372.553 4.015 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]C[C@@H]2CCCOC2)c1 ZINC000537242037 1101580687 /nfs/dbraw/zinc/58/06/87/1101580687.db2.gz PRGNUWRCOSKZCX-NRFANRHFSA-N 2 0 364.533 4.466 20 0 FIADRP CN(c1ccccc1C[N@H+](Cc1cccs1)C1CC1)C1CC[NH+](C)CC1 ZINC000506619640 1101584459 /nfs/dbraw/zinc/58/44/59/1101584459.db2.gz YAGQSLHDQLMOQS-UHFFFAOYSA-N 2 0 369.578 4.443 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000518981166 1101797161 /nfs/dbraw/zinc/79/71/61/1101797161.db2.gz MQWFJHIUTDJECH-UHFFFAOYSA-N 2 0 352.522 4.130 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(C)c1 ZINC000519168601 1101983280 /nfs/dbraw/zinc/98/32/80/1101983280.db2.gz KTKIIAJAILBIIQ-GOTSBHOMSA-N 2 0 352.522 4.193 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(C)c1 ZINC000519168603 1101983907 /nfs/dbraw/zinc/98/39/07/1101983907.db2.gz KTKIIAJAILBIIQ-XZOQPEGZSA-N 2 0 352.522 4.193 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(CC[NH+](C)C)cc2)cc1)C(C)C ZINC000102731301 1101988358 /nfs/dbraw/zinc/98/83/58/1101988358.db2.gz MFAGUJMWFREOHJ-UHFFFAOYSA-N 2 0 367.537 4.273 20 0 FIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(OC)cc2OC)cc1 ZINC000120582462 1102234868 /nfs/dbraw/zinc/23/48/68/1102234868.db2.gz ZTIZQJZMVYCTKO-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccccc1OC(F)F ZINC000120890965 1102262452 /nfs/dbraw/zinc/26/24/52/1102262452.db2.gz DTRFVQIKNBDZKW-ZDUSSCGKSA-N 2 0 352.400 4.340 20 0 FIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000415015992 1102262742 /nfs/dbraw/zinc/26/27/42/1102262742.db2.gz ORWSQMSVOMHECR-OAHLLOKOSA-N 2 0 359.901 4.199 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](CCc2cccc(OC(F)(F)F)c2)CC1 ZINC001168201228 1102362365 /nfs/dbraw/zinc/36/23/65/1102362365.db2.gz KBRIGDKUBAJWSD-UHFFFAOYSA-N 2 0 358.448 4.182 20 0 FIADRP CC[NH+]1CCC(C[NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000044517723 1102366843 /nfs/dbraw/zinc/36/68/43/1102366843.db2.gz IXZTYMMAUZPCEF-UHFFFAOYSA-N 2 0 351.332 4.017 20 0 FIADRP [NH3+]CC1CCC([NH2+]C2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1 ZINC000415127530 1102372443 /nfs/dbraw/zinc/37/24/43/1102372443.db2.gz VWBPBVDBNYEMOG-UHFFFAOYSA-N 2 0 370.368 4.065 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cccc(CO)c1 ZINC000121545866 1102413985 /nfs/dbraw/zinc/41/39/85/1102413985.db2.gz SLJVRSUFWVFCDR-LJQANCHMSA-N 2 0 352.522 4.406 20 0 FIADRP c1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc(OCC2CCC2)c1 ZINC001167970556 1102425069 /nfs/dbraw/zinc/42/50/69/1102425069.db2.gz MTNBHWFTADFLKM-FRIKZZABSA-N 2 0 354.538 4.361 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000532483213 1102425381 /nfs/dbraw/zinc/42/53/81/1102425381.db2.gz ZALBTJIERXERET-CXUUEIJPSA-N 2 0 369.372 4.304 20 0 FIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000120026674 1102430185 /nfs/dbraw/zinc/43/01/85/1102430185.db2.gz NYBOMVNQOPYACS-INIZCTEOSA-N 2 0 359.558 4.426 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H](CC2CC2)c2ccccc2)CC1 ZINC000532550287 1102464668 /nfs/dbraw/zinc/46/46/68/1102464668.db2.gz DVVOIBDKDDTJIB-DEOSSOPVSA-N 2 0 364.533 4.274 20 0 FIADRP CC[N@@H+]1CCC[C@H](C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000060366855 1102538800 /nfs/dbraw/zinc/53/88/00/1102538800.db2.gz WJUXIUPAOXTACM-CYBMUJFWSA-N 2 0 355.309 4.091 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cccc(C(F)(F)F)n2)CC1 ZINC000550857307 1102578093 /nfs/dbraw/zinc/57/80/93/1102578093.db2.gz REGLPBHHCNWWOC-CRAIPNDOSA-N 2 0 369.475 4.276 20 0 FIADRP CC[NH+]1CCC([NH2+]CC2(c3ccc(Br)cc3Cl)CC2)CC1 ZINC000550881793 1102651546 /nfs/dbraw/zinc/65/15/46/1102651546.db2.gz CURCLCZHWBPPLU-UHFFFAOYSA-N 2 0 371.750 4.208 20 0 FIADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885788 1102657099 /nfs/dbraw/zinc/65/70/99/1102657099.db2.gz JIWFAVASLGRRDV-SKWRMQMOSA-N 2 0 370.581 4.330 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)ccn1 ZINC000550886010 1102658247 /nfs/dbraw/zinc/65/82/47/1102658247.db2.gz AWFJFXYFTZUTET-QZTJIDSGSA-N 2 0 353.510 4.315 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cn2ccccc2n1 ZINC000550886246 1102658340 /nfs/dbraw/zinc/65/83/40/1102658340.db2.gz NOKFQIKJNQAKAT-RTBURBONSA-N 2 0 362.521 4.417 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)ccn1 ZINC000550889754 1102661314 /nfs/dbraw/zinc/66/13/14/1102661314.db2.gz CZSLAWDJDWZNAK-FHWLQOOXSA-N 2 0 367.537 4.419 20 0 FIADRP c1ccc(Oc2cccc(CC[NH2+]C3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC001168353075 1102687147 /nfs/dbraw/zinc/68/71/47/1102687147.db2.gz JGMUMTUCDUCOJT-UHFFFAOYSA-N 2 0 350.506 4.485 20 0 FIADRP [NH3+]CCc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2cc(Cl)ccc12 ZINC001167979119 1102737283 /nfs/dbraw/zinc/73/72/83/1102737283.db2.gz VRDVOPITVCSGHQ-DFNIBXOVSA-N 2 0 357.929 4.374 20 0 FIADRP COc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167978248 1102741633 /nfs/dbraw/zinc/74/16/33/1102741633.db2.gz NDVGABZZKYFCDS-SEJPIABJSA-N 2 0 354.538 4.013 20 0 FIADRP COCCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000123019123 1102745957 /nfs/dbraw/zinc/74/59/57/1102745957.db2.gz KQUVIUCIOJOQJW-LJQANCHMSA-N 2 0 368.521 4.158 20 0 FIADRP CC(C)(C)n1cc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c(-c2ccccc2Cl)n1 ZINC000666953866 1102748037 /nfs/dbraw/zinc/74/80/37/1102748037.db2.gz JRMBMAUFVYUMIR-GOSISDBHSA-N 2 0 372.944 4.190 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(-n2ccnc2)cc1 ZINC000123045348 1102757196 /nfs/dbraw/zinc/75/71/96/1102757196.db2.gz RZFVXYRDCNGSHV-LJQANCHMSA-N 2 0 360.505 4.319 20 0 FIADRP Cc1nocc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000550217258 1102767377 /nfs/dbraw/zinc/76/73/77/1102767377.db2.gz RHWOVPNMWFLNBD-HAYQSNGGSA-N 2 0 359.901 4.340 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000551004569 1102772973 /nfs/dbraw/zinc/77/29/73/1102772973.db2.gz BZGGFRQNIAGNPE-DNQXCXABSA-N 2 0 365.565 4.454 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)cc2)cs1 ZINC000061554958 1102780629 /nfs/dbraw/zinc/78/06/29/1102780629.db2.gz HXLXOGCVGRQMTR-UHFFFAOYSA-N 2 0 373.566 4.429 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000551013468 1102789396 /nfs/dbraw/zinc/78/93/96/1102789396.db2.gz BYUFYGOVVRKVIV-BJKOFHAPSA-N 2 0 365.565 4.452 20 0 FIADRP Cc1nccn1CCCC[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000551051622 1102864524 /nfs/dbraw/zinc/86/45/24/1102864524.db2.gz TWCMQKAGWNNRLS-ZDUSSCGKSA-N 2 0 354.317 4.073 20 0 FIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000459358599 1102912456 /nfs/dbraw/zinc/91/24/56/1102912456.db2.gz BKTSKKLISONWFQ-ZMTJCJBESA-N 2 0 362.517 4.353 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133011801 1102928575 /nfs/dbraw/zinc/92/85/75/1102928575.db2.gz SHGOWHAWPXISPN-ZWKOTPCHSA-N 2 0 362.583 4.339 20 0 FIADRP CCCC[NH+]1CCC(N[C@H]2CCc3sc(Br)cc32)CC1 ZINC000312368695 1102970772 /nfs/dbraw/zinc/97/07/72/1102970772.db2.gz LZEKEFWMSNBOIP-AWEZNQCLSA-N 2 0 357.361 4.352 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000551268257 1103030942 /nfs/dbraw/zinc/03/09/42/1103030942.db2.gz TUTDAZRFHPIWGH-JOCHJYFZSA-N 2 0 368.521 4.280 20 0 FIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000427053893 1103216611 /nfs/dbraw/zinc/21/66/11/1103216611.db2.gz LQTALQCZVDAADC-UHFFFAOYSA-N 2 0 357.542 4.041 20 0 FIADRP COc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1OCc1ccccc1 ZINC000666996879 1103355595 /nfs/dbraw/zinc/35/55/95/1103355595.db2.gz JZPSCISUHPAUSR-FQEVSTJZSA-N 2 0 366.505 4.039 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000507403542 1103359728 /nfs/dbraw/zinc/35/97/28/1103359728.db2.gz NSZHUTRWUZZODL-CZUORRHYSA-N 2 0 351.332 4.319 20 0 FIADRP C[C@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(Br)c21 ZINC000507403531 1103360565 /nfs/dbraw/zinc/36/05/65/1103360565.db2.gz NSZHUTRWUZZODL-BBRMVZONSA-N 2 0 351.332 4.319 20 0 FIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CC(c4ccccc4F)C3)cc2)CC1 ZINC000551572514 1103378209 /nfs/dbraw/zinc/37/82/09/1103378209.db2.gz ZQEIMMCXNYUTSL-UHFFFAOYSA-N 2 0 368.496 4.335 20 0 FIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)[C@H]1CCCOC1 ZINC000507489104 1103437852 /nfs/dbraw/zinc/43/78/52/1103437852.db2.gz WENFUIDYFDDMHJ-OFNKIYASSA-N 2 0 358.570 4.126 20 0 FIADRP C[C@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000551617831 1103442843 /nfs/dbraw/zinc/44/28/43/1103442843.db2.gz ZGFRSQHDDQXEME-QGZVFWFLSA-N 2 0 356.485 4.192 20 0 FIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000551787841 1103659051 /nfs/dbraw/zinc/65/90/51/1103659051.db2.gz MOXBOTYGBNJCJR-NLSFWIRASA-N 2 0 365.521 4.088 20 0 FIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)CC2 ZINC000551812450 1103692840 /nfs/dbraw/zinc/69/28/40/1103692840.db2.gz DPVCGKCRFVFIND-QHCPKHFHSA-N 2 0 350.506 4.245 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000551908462 1103776257 /nfs/dbraw/zinc/77/62/57/1103776257.db2.gz VXVZTXCZSZCDJT-UHFFFAOYSA-N 2 0 367.537 4.213 20 0 FIADRP C[C@@H](Cc1cccs1)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538295261 1104113306 /nfs/dbraw/zinc/11/33/06/1104113306.db2.gz BILCWCWOROWOPR-LPHOPBHVSA-N 2 0 356.535 4.257 20 0 FIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc(Cl)c1OC ZINC000520205085 1104170462 /nfs/dbraw/zinc/17/04/62/1104170462.db2.gz SYLCACUSHHPGJD-MRXNPFEDSA-N 2 0 368.949 4.349 20 0 FIADRP Brc1cc(CNCCC[N@@H+]2CCc3ccccc3C2)cs1 ZINC000520206812 1104172501 /nfs/dbraw/zinc/17/25/01/1104172501.db2.gz PESGBNVERJKLKM-UHFFFAOYSA-N 2 0 365.340 4.049 20 0 FIADRP FC(F)(F)c1ccc(OCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441419876 1104383370 /nfs/dbraw/zinc/38/33/70/1104383370.db2.gz YFDRUTRGUOWKNY-KXBFYZLASA-N 2 0 368.443 4.033 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc2ccccc2s1 ZINC000188446040 1104469153 /nfs/dbraw/zinc/46/91/53/1104469153.db2.gz XUCAOQDJHDBBGP-UZLBHIALSA-N 2 0 366.530 4.319 20 0 FIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(OCCC[NH+](C)C)cc3)ccc2n1 ZINC000189314541 1104794552 /nfs/dbraw/zinc/79/45/52/1104794552.db2.gz IKEZHFGHUSXMRP-UHFFFAOYSA-N 2 0 363.505 4.164 20 0 FIADRP Brc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)s1 ZINC000190582833 1104934165 /nfs/dbraw/zinc/93/41/65/1104934165.db2.gz XLJZIAMMGFUNAK-ZBEGNZNMSA-N 2 0 355.345 4.036 20 0 FIADRP CN(C1CC[NH+](C2CCCCC2)CC1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001168001803 1104945635 /nfs/dbraw/zinc/94/56/35/1104945635.db2.gz HYKULEFZCFBINS-AIZNXBIQSA-N 2 0 359.602 4.121 20 0 FIADRP COc1cccc(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001168002034 1104960485 /nfs/dbraw/zinc/96/04/85/1104960485.db2.gz CDEAJMHVFZEQHO-AIZNXBIQSA-N 2 0 368.565 4.355 20 0 FIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(Cl)c4ccccc34)C2)CC1 ZINC000520561120 1104997747 /nfs/dbraw/zinc/99/77/47/1104997747.db2.gz WYWGOTOZWMRXCG-IBGZPJMESA-N 2 0 371.956 4.094 20 0 FIADRP CCO[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C12CCC2 ZINC000390719030 1106752297 /nfs/dbraw/zinc/75/22/97/1106752297.db2.gz YVPPHYQGSVHOBB-GLHNNUHNSA-N 2 0 354.538 4.119 20 0 FIADRP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000301780583 1107147706 /nfs/dbraw/zinc/14/77/06/1107147706.db2.gz IQPVQJJJURUEDT-CQSZACIVSA-N 2 0 351.416 4.422 20 0 FIADRP Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c2ccccc2[nH+]1 ZINC000302880772 1107474207 /nfs/dbraw/zinc/47/42/07/1107474207.db2.gz INWHJLSIWAOJCW-HXUWFJFHSA-N 2 0 361.489 4.112 20 0 FIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCS2 ZINC000152441489 1107649104 /nfs/dbraw/zinc/64/91/04/1107649104.db2.gz VWIAIXUZTJBYFR-WBMJQRKESA-N 2 0 367.356 4.060 20 0 FIADRP COc1cc2c(c(C[NH2+]Cc3cccc(C[N@H+](C)C(C)C)c3)c1)O[C@@H](C)C2 ZINC000237477516 1107745682 /nfs/dbraw/zinc/74/56/82/1107745682.db2.gz YXGWSHJKVQTBID-KRWDZBQOSA-N 2 0 368.521 4.149 20 0 FIADRP CSc1cc(Br)ccc1CNC1CC([NH+]2CCCCC2)C1 ZINC000475568314 1107756893 /nfs/dbraw/zinc/75/68/93/1107756893.db2.gz USXVAYGHKVOBMU-UHFFFAOYSA-N 2 0 369.372 4.278 20 0 FIADRP Clc1ccccc1OC[C@@H]1CCC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000444610661 1108018438 /nfs/dbraw/zinc/01/84/38/1108018438.db2.gz DLODYRWKPWQBQX-GOSISDBHSA-N 2 0 350.934 4.307 20 0 FIADRP c1cc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)cc2)cs1 ZINC000444645643 1108045747 /nfs/dbraw/zinc/04/57/47/1108045747.db2.gz XKCCYSWFMAKMKV-UHFFFAOYSA-N 2 0 370.562 4.492 20 0 FIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CCOC4(CCC4)C3)[C@@H]3CCC[C@H]32)cc1 ZINC000453155335 1108224637 /nfs/dbraw/zinc/22/46/37/1108224637.db2.gz BASAEAOBKMMIDY-CLAROIROSA-N 2 0 354.538 4.121 20 0 FIADRP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000523440564 1108225046 /nfs/dbraw/zinc/22/50/46/1108225046.db2.gz PDYHRSZWKDEDKU-CKJXQJPGSA-N 2 0 366.496 4.237 20 0 FIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21)c1nccs1 ZINC000453204121 1108275121 /nfs/dbraw/zinc/27/51/21/1108275121.db2.gz VTZSLLVIJNCCBA-MDNKFWRPSA-N 2 0 355.551 4.279 20 0 FIADRP C[C@@H](CCCc1cccnc1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000453214353 1108284592 /nfs/dbraw/zinc/28/45/92/1108284592.db2.gz QYWPZDHNLHKCOT-IBGZPJMESA-N 2 0 367.537 4.056 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000453224705 1108297512 /nfs/dbraw/zinc/29/75/12/1108297512.db2.gz UZERQUUTKPOIMZ-WMZOPIPTSA-N 2 0 356.535 4.167 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC(C)(C)c2ccccn2)CC1 ZINC000453288066 1108365540 /nfs/dbraw/zinc/36/55/40/1108365540.db2.gz JPGKWRBIJIOIST-UHFFFAOYSA-N 2 0 351.538 4.392 20 0 FIADRP FCC1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000453316455 1108405293 /nfs/dbraw/zinc/40/52/93/1108405293.db2.gz WVOFXCWRWJQXOW-BHDDXSALSA-N 2 0 374.544 4.033 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000531939569 1108415892 /nfs/dbraw/zinc/41/58/92/1108415892.db2.gz KVRHFABHVYHCPQ-FQEVSTJZSA-N 2 0 357.586 4.413 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2cccnc21 ZINC000531941916 1108419656 /nfs/dbraw/zinc/41/96/56/1108419656.db2.gz UDABSPUSPICMEQ-AUSIDOKSSA-N 2 0 359.517 4.278 20 0 FIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C)cc1 ZINC000531965334 1108460426 /nfs/dbraw/zinc/46/04/26/1108460426.db2.gz XGXSXDYIYLLBRF-GOTSBHOMSA-N 2 0 351.538 4.024 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCCOc2ccc(Br)cc21)C1CC1 ZINC000453386108 1108471216 /nfs/dbraw/zinc/47/12/16/1108471216.db2.gz AAASRRDEYDHDCO-KRWDZBQOSA-N 2 0 367.331 4.127 20 0 FIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000531989153 1108474745 /nfs/dbraw/zinc/47/47/45/1108474745.db2.gz HUXKTHPFDDYRJR-QHCPKHFHSA-N 2 0 350.506 4.458 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cnn1-c1cccc(Cl)c1 ZINC000453399234 1108501777 /nfs/dbraw/zinc/50/17/77/1108501777.db2.gz LEJOORHYANPUBE-HNNXBMFYSA-N 2 0 360.933 4.359 20 0 FIADRP C[N@H+](CCCC[NH2+]Cc1cnc(-c2c(F)cccc2F)s1)C1CC1 ZINC000453594985 1108630729 /nfs/dbraw/zinc/63/07/29/1108630729.db2.gz JFTGAQDAVHWFBC-UHFFFAOYSA-N 2 0 351.466 4.052 20 0 FIADRP CN(c1ccccc1CNc1ccc2c[nH+]ccc2c1)C1CC[NH+](C)CC1 ZINC000453612394 1108660223 /nfs/dbraw/zinc/66/02/23/1108660223.db2.gz JLEQDLIRLMRPHE-UHFFFAOYSA-N 2 0 360.505 4.377 20 0 FIADRP COc1ccc(C2(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)CCCCC2)cc1OC ZINC000532223334 1108722139 /nfs/dbraw/zinc/72/21/39/1108722139.db2.gz KCCIVBBCVYPITK-CMKODMSKSA-N 2 0 374.569 4.224 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(Cc2ccccc2)c1 ZINC000532228540 1108724864 /nfs/dbraw/zinc/72/48/64/1108724864.db2.gz CYYJDXGVJJXIJF-FQEVSTJZSA-N 2 0 354.542 4.238 20 0 FIADRP COc1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(OC(F)F)c1 ZINC000524457899 1109020757 /nfs/dbraw/zinc/02/07/57/1109020757.db2.gz LAYFRJZDLLSBAO-HZPDHXFCSA-N 2 0 370.484 4.144 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000524876259 1109187952 /nfs/dbraw/zinc/18/79/52/1109187952.db2.gz QUDXRJRBHHAWQT-OAQYLSRUSA-N 2 0 373.585 4.012 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1cccc(F)c1 ZINC000446745656 1109327096 /nfs/dbraw/zinc/32/70/96/1109327096.db2.gz SPZGCEKOJFHUJH-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP CC[C@@H](c1ccc(F)cc1F)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000525308524 1109333702 /nfs/dbraw/zinc/33/37/02/1109333702.db2.gz BZWDLEQTSKGCGX-FQEVSTJZSA-N 2 0 354.485 4.239 20 0 FIADRP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)C2CCCC2)cc1 ZINC000446935832 1109394582 /nfs/dbraw/zinc/39/45/82/1109394582.db2.gz IDIFMYFMXKPRML-DNVJHFABSA-N 2 0 356.554 4.194 20 0 FIADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000428463720 1109406787 /nfs/dbraw/zinc/40/67/87/1109406787.db2.gz PTQNLNLZXMGBPV-VXSCBNMQSA-N 2 0 358.570 4.064 20 0 FIADRP COCCN1CCC([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000447071583 1109435096 /nfs/dbraw/zinc/43/50/96/1109435096.db2.gz ADVGYASTMXWXRE-UHFFFAOYSA-N 2 0 371.352 4.116 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000367373270 1109483044 /nfs/dbraw/zinc/48/30/44/1109483044.db2.gz BFYRZWKWNZBQGX-OAHLLOKOSA-N 2 0 360.448 4.289 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(C)o1 ZINC000447543375 1109573874 /nfs/dbraw/zinc/57/38/74/1109573874.db2.gz RXSGRZYEZGNEMS-KSZLIROESA-N 2 0 356.510 4.356 20 0 FIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cnn1-c1cccc(Cl)c1 ZINC000447556147 1109580684 /nfs/dbraw/zinc/58/06/84/1109580684.db2.gz FFQGENIMGMFLLU-OAHLLOKOSA-N 2 0 372.944 4.359 20 0 FIADRP COC[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447563482 1109582823 /nfs/dbraw/zinc/58/28/23/1109582823.db2.gz QAAAYCKXEVCNRD-YCAMKHIRSA-N 2 0 364.533 4.029 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447567799 1109584929 /nfs/dbraw/zinc/58/49/29/1109584929.db2.gz FIDCAUHTNVIRGV-HSZRJFAPSA-N 2 0 350.506 4.249 20 0 FIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c2ccccc21 ZINC000447582094 1109585525 /nfs/dbraw/zinc/58/55/25/1109585525.db2.gz XWGUKZSINZXSSW-MYDTUXCISA-N 2 0 356.554 4.229 20 0 FIADRP Fc1cccc(NCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000447601991 1109599116 /nfs/dbraw/zinc/59/91/16/1109599116.db2.gz RZJKEOXMVDOTMJ-WBDAEOGXSA-N 2 0 367.512 4.413 20 0 FIADRP FC(F)c1ccc(C[NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000527524031 1109774645 /nfs/dbraw/zinc/77/46/45/1109774645.db2.gz LYEAVCGBNVXNGD-UHFFFAOYSA-N 2 0 374.475 4.431 20 0 FIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CCC[C@H](c4ccccc4)CC3)CC2)CC1 ZINC000527651166 1109796083 /nfs/dbraw/zinc/79/60/83/1109796083.db2.gz UBARSTHTNWSPSS-FCHUYYIVSA-N 2 0 369.597 4.251 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H]2CCC[NH+](CC(C)C)C2)cc1)C(C)C ZINC000448430319 1109796513 /nfs/dbraw/zinc/79/65/13/1109796513.db2.gz MPWQRMQGKJBRMK-OAQYLSRUSA-N 2 0 373.585 4.015 20 0 FIADRP COc1cccc([C@H](C[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)OC)c1 ZINC000527732914 1109813807 /nfs/dbraw/zinc/81/38/07/1109813807.db2.gz BOGCHZXLPSRYPP-JZWVFAODSA-N 2 0 368.521 4.025 20 0 FIADRP CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1 ZINC000527852922 1109839192 /nfs/dbraw/zinc/83/91/92/1109839192.db2.gz PKYYSBQDQUYXCO-MOPGFXCFSA-N 2 0 366.553 4.198 20 0 FIADRP Cc1cccc([C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)C(C)C)c1 ZINC000527865457 1109843579 /nfs/dbraw/zinc/84/35/79/1109843579.db2.gz GUADCPRXDBGDEM-XMMPIXPASA-N 2 0 366.549 4.439 20 0 FIADRP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000527849887 1109847097 /nfs/dbraw/zinc/84/70/97/1109847097.db2.gz MCHSDCNUPFETFS-RTBURBONSA-N 2 0 366.553 4.198 20 0 FIADRP CC(C)c1cccc([C@@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000527897330 1109852995 /nfs/dbraw/zinc/85/29/95/1109852995.db2.gz GFLIJMAIIRHOOB-GOSISDBHSA-N 2 0 355.526 4.386 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC/C=C/c1ccc(Br)cc1 ZINC000527932583 1109870239 /nfs/dbraw/zinc/87/02/39/1109870239.db2.gz NKZPDANFWUYYQR-OOPDTJFMSA-N 2 0 351.332 4.171 20 0 FIADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000527969785 1109877715 /nfs/dbraw/zinc/87/77/15/1109877715.db2.gz RMEWOXMBZXMFOW-JTSKRJEESA-N 2 0 353.510 4.214 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cn1 ZINC000528044865 1109897643 /nfs/dbraw/zinc/89/76/43/1109897643.db2.gz VZSDJAAORDKGNB-JWNTYJGQSA-N 2 0 365.521 4.042 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000449084108 1109970375 /nfs/dbraw/zinc/97/03/75/1109970375.db2.gz WOAVNHSDEOZESG-VXKWHMMOSA-N 3 0 371.613 4.184 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)OCCCCO3)c1 ZINC000449100220 1109975977 /nfs/dbraw/zinc/97/59/77/1109975977.db2.gz QBIJWSMFHJBGQB-UHFFFAOYSA-N 2 0 368.521 4.368 20 0 FIADRP Cc1csc(CCCC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)n1 ZINC000449116276 1109979458 /nfs/dbraw/zinc/97/94/58/1109979458.db2.gz KSCIUMNMWKNLNR-IBGZPJMESA-N 2 0 371.594 4.459 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccccc2-c2ccccc2C)CC1 ZINC000449129772 1109981805 /nfs/dbraw/zinc/98/18/05/1109981805.db2.gz DGFYZLNSNAXMCX-FQEVSTJZSA-N 2 0 365.565 4.025 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000449133154 1109982165 /nfs/dbraw/zinc/98/21/65/1109982165.db2.gz XISBYQJYSHBPLN-UHFFFAOYSA-N 2 0 365.493 4.300 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc3c(OC)cccc23)[C@H](C)C1 ZINC000449137082 1109983738 /nfs/dbraw/zinc/98/37/38/1109983738.db2.gz DJJXNOLKXCRUQB-GCJKJVERSA-N 2 0 370.537 4.075 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCc2ccc(O)cc2)CC1 ZINC000449138771 1109984466 /nfs/dbraw/zinc/98/44/66/1109984466.db2.gz DFRIHPLRVWRPRF-LJQANCHMSA-N 2 0 352.522 4.010 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](CCO)c2ccccc2)CC1 ZINC000449164567 1109990373 /nfs/dbraw/zinc/99/03/73/1109990373.db2.gz ZPTOHXKVOGJKOB-HXUWFJFHSA-N 2 0 360.586 4.421 20 0 FIADRP CO[C@@H](C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000449168257 1109990960 /nfs/dbraw/zinc/99/09/60/1109990960.db2.gz ARGDFKAZQUPJSQ-JPYJTQIMSA-N 2 0 370.512 4.198 20 0 FIADRP Cc1cccc(CCC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)n1 ZINC000449316003 1110031310 /nfs/dbraw/zinc/03/13/10/1110031310.db2.gz LEXATPPDRQODNP-HXUWFJFHSA-N 2 0 351.538 4.008 20 0 FIADRP CC[C@@H](COCC(F)(F)F)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449377434 1110050968 /nfs/dbraw/zinc/05/09/68/1110050968.db2.gz AEDRFJZXTJOIKY-AEFFLSMTSA-N 2 0 372.475 4.029 20 0 FIADRP C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449440409 1110079609 /nfs/dbraw/zinc/07/96/09/1110079609.db2.gz ZHJBMHVCMPIKGA-MAUKXSAKSA-N 2 0 363.427 4.101 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCOC3(CCC3)C2)CC1 ZINC000449480505 1110085192 /nfs/dbraw/zinc/08/51/92/1110085192.db2.gz OQKFAQPRNGOVOK-FPOVZHCZSA-N 2 0 356.554 4.021 20 0 FIADRP Cc1ccc(OCc2nc(C[NH2+]C(C)(C)CCC[NH+](C)C)cs2)cc1 ZINC000449529254 1110096036 /nfs/dbraw/zinc/09/60/36/1110096036.db2.gz VVSCPUFGZBBPOP-UHFFFAOYSA-N 2 0 361.555 4.241 20 0 FIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccccc2)CC1 ZINC000538409034 1111129848 /nfs/dbraw/zinc/12/98/48/1111129848.db2.gz AUTFZFKDQKJTMX-XPWALMASSA-N 2 0 356.554 4.275 20 0 FIADRP Cc1cccc2ncc(C[NH+]3CCC(CC[N@H+]4CCCC[C@H]4C)CC3)n21 ZINC000538724278 1111263621 /nfs/dbraw/zinc/26/36/21/1111263621.db2.gz AWWDYJNQBPXPOE-GOSISDBHSA-N 2 0 354.542 4.119 20 0 FIADRP c1[nH]nc2cc(CN3CC[C@@H]4[C@@H](CCC[N@@H+]4Cc4ccccc4)C3)ccc12 ZINC000538798626 1111294910 /nfs/dbraw/zinc/29/49/10/1111294910.db2.gz PTPUWHFPLYNRIS-JTHBVZDNSA-N 2 0 360.505 4.049 20 0 FIADRP CCCOc1ccc(Oc2ncccc2CNC2CC[NH+](CC)CC2)cc1 ZINC000461802184 1111368004 /nfs/dbraw/zinc/36/80/04/1111368004.db2.gz QFMCVDLFYWPAFN-UHFFFAOYSA-N 2 0 369.509 4.237 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccccc2Br)[C@H](C)C1 ZINC000539053396 1111401628 /nfs/dbraw/zinc/40/16/28/1111401628.db2.gz FYAWWTPEQSRAGQ-RHSMWYFYSA-N 2 0 353.348 4.047 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1csc(C(C)(C)C)n1 ZINC000539045028 1111410229 /nfs/dbraw/zinc/41/02/29/1111410229.db2.gz ZAVNLMPCWNDJNH-PXNSSMCTSA-N 2 0 371.594 4.483 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)Nc2ccc(F)cc2)c1 ZINC000539071353 1111418780 /nfs/dbraw/zinc/41/87/80/1111418780.db2.gz JJUGFANQRVKMOZ-QGZVFWFLSA-N 2 0 371.500 4.173 20 0 FIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C[C@H](C)O1 ZINC000539260745 1111498072 /nfs/dbraw/zinc/49/80/72/1111498072.db2.gz HGIFUDCIVZITRY-FCEWJHQRSA-N 2 0 366.933 4.033 20 0 FIADRP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000462115124 1111502564 /nfs/dbraw/zinc/50/25/64/1111502564.db2.gz CTYPBONWJOSNPA-HXUWFJFHSA-N 2 0 366.977 4.122 20 0 FIADRP COC[C@@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)c1ccc(F)c(F)c1 ZINC000539316842 1111509983 /nfs/dbraw/zinc/50/99/83/1111509983.db2.gz IYBLYFTWHXFMOA-HXUWFJFHSA-N 2 0 354.485 4.000 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@H]1CCc3ccccc31)c1ccccc1O2 ZINC000539396677 1111552751 /nfs/dbraw/zinc/55/27/51/1111552751.db2.gz MLBCNNOPGHAKSZ-DENIHFKCSA-N 2 0 362.517 4.294 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(OCC[NH+](C)C)cc1 ZINC000477857899 1111580121 /nfs/dbraw/zinc/58/01/21/1111580121.db2.gz RRLPBZKXROPFHE-GHTZIAJQSA-N 2 0 360.542 4.160 20 0 FIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2n[nH]cc2c1 ZINC000552099307 1111585458 /nfs/dbraw/zinc/58/54/58/1111585458.db2.gz DSOQLZXNMQBHDG-IRNNPGBSSA-N 2 0 360.505 4.409 20 0 FIADRP COc1cc([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1OC(F)F ZINC000477907777 1111595496 /nfs/dbraw/zinc/59/54/96/1111595496.db2.gz AGHHVQOZGHEVNK-AWEZNQCLSA-N 2 0 356.457 4.069 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2nc3ccccc3n2C)CC1 ZINC000478051470 1111666061 /nfs/dbraw/zinc/66/60/61/1111666061.db2.gz CAHNXSJNXDOBBM-LJQANCHMSA-N 2 0 368.569 4.092 20 0 FIADRP CCn1nc(C)c(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1C ZINC000552326346 1111670841 /nfs/dbraw/zinc/67/08/41/1111670841.db2.gz NFRORXGCRLMLQB-UHFFFAOYSA-N 2 0 366.553 4.008 20 0 FIADRP CCOc1cc2[nH+]ccc(N(C)C3C[C@H]4CC[C@@H](C3)[N@H+]4C)c2cc1OCC ZINC000553295037 1111942601 /nfs/dbraw/zinc/94/26/01/1111942601.db2.gz CNOWWOIISYFIRR-SJPCQFCGSA-N 2 0 369.509 4.094 20 0 FIADRP Brc1ccc2c(c1)CCC[C@@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000479072525 1111944100 /nfs/dbraw/zinc/94/41/00/1111944100.db2.gz BRSRTJXNKVEVKC-IBGZPJMESA-N 2 0 363.343 4.433 20 0 FIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccncc3)s2)c1 ZINC000553367005 1111959116 /nfs/dbraw/zinc/95/91/16/1111959116.db2.gz VBBKVONLNVZYSY-UHFFFAOYSA-N 2 0 366.534 4.335 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccc(Br)cc2)C1 ZINC000479290018 1111986392 /nfs/dbraw/zinc/98/63/92/1111986392.db2.gz XFGXJRFNDLCHCK-WBVHZDCISA-N 2 0 353.348 4.090 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000479331906 1111994412 /nfs/dbraw/zinc/99/44/12/1111994412.db2.gz SFMRNBJMCPLHRW-DENIHFKCSA-N 2 0 366.553 4.494 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000479463033 1112033579 /nfs/dbraw/zinc/03/35/79/1112033579.db2.gz HUWVMKYEFSKFQQ-PZJWPPBQSA-N 2 0 366.505 4.021 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@@H](C)C1 ZINC000479535720 1112059992 /nfs/dbraw/zinc/05/99/92/1112059992.db2.gz IUBNQSUBOMGGHZ-BVPXEZJJSA-N 2 0 364.961 4.313 20 0 FIADRP C[C@@H](NC1CC([NH+]2CCCCC2)C1)c1ccc(F)c(Br)c1 ZINC000479542227 1112063154 /nfs/dbraw/zinc/06/31/54/1112063154.db2.gz WFXRMHFOSLMNRH-LRVUVFPRSA-N 2 0 355.295 4.256 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000479765605 1112135297 /nfs/dbraw/zinc/13/52/97/1112135297.db2.gz DIDHZRUVWPDPEY-HNAYVOBHSA-N 2 0 373.368 4.263 20 0 FIADRP COc1cc2c(NCc3ccc(C[NH+](C)C)c(F)c3)cc[nH+]c2cc1F ZINC000480067005 1112267084 /nfs/dbraw/zinc/26/70/84/1112267084.db2.gz GEXIYCWGZPTTTR-UHFFFAOYSA-N 2 0 357.404 4.195 20 0 FIADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000480160199 1112307759 /nfs/dbraw/zinc/30/77/59/1112307759.db2.gz NTSAAAFMZWLLQV-CXAGYDPISA-N 2 0 351.332 4.461 20 0 FIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CCC[NH+]1CCCC1)CCC2 ZINC000480159995 1112307904 /nfs/dbraw/zinc/30/79/04/1112307904.db2.gz NJZFGNKAAXCKGU-KRWDZBQOSA-N 2 0 359.514 4.402 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480241362 1112345962 /nfs/dbraw/zinc/34/59/62/1112345962.db2.gz MVPITPLIZVICAJ-HSALFYBXSA-N 2 0 352.522 4.455 20 0 FIADRP C[C@H]([NH2+]CCCN1CCN(c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000480251953 1112351244 /nfs/dbraw/zinc/35/12/44/1112351244.db2.gz ULBNXIUUFRCQMJ-FQEVSTJZSA-N 2 0 374.532 4.098 20 0 FIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]Cc3ccc(OCC4CC4)cc3)C2)cc1 ZINC000480369855 1112407875 /nfs/dbraw/zinc/40/78/75/1112407875.db2.gz JJGZCEGZMWIBRO-QHCPKHFHSA-N 2 0 364.533 4.130 20 0 FIADRP Cc1nc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)oc1-c1ccc(Cl)cc1 ZINC000567392435 1112424582 /nfs/dbraw/zinc/42/45/82/1112424582.db2.gz QNVMSCBWHNUADA-KRWDZBQOSA-N 2 0 359.901 4.125 20 0 FIADRP CO[C@H](C)[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000480538333 1112466962 /nfs/dbraw/zinc/46/69/62/1112466962.db2.gz IHXGZOWKHICHEI-RBUKOAKNSA-N 2 0 352.522 4.462 20 0 FIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000554742522 1112467534 /nfs/dbraw/zinc/46/75/34/1112467534.db2.gz XUBKGVOWGCOGSW-FGZHOGPDSA-N 2 0 367.537 4.228 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)nnn1-c1ccc(C)cc1 ZINC000480607213 1112507414 /nfs/dbraw/zinc/50/74/14/1112507414.db2.gz DYBFLBAOWRAVDB-IBGZPJMESA-N 2 0 369.557 4.047 20 0 FIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000480618635 1112511053 /nfs/dbraw/zinc/51/10/53/1112511053.db2.gz YDGVTWPKCHUBPC-UXHICEINSA-N 2 0 351.538 4.030 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000480618629 1112511323 /nfs/dbraw/zinc/51/13/23/1112511323.db2.gz YDGVTWPKCHUBPC-PMACEKPBSA-N 2 0 351.538 4.030 20 0 FIADRP CCN(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cn1 ZINC000480657193 1112533327 /nfs/dbraw/zinc/53/33/27/1112533327.db2.gz DNXPZIPSHIGRGC-IBGZPJMESA-N 2 0 366.553 4.202 20 0 FIADRP C[C@H]([NH2+]CCCNc1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480690154 1112547238 /nfs/dbraw/zinc/54/72/38/1112547238.db2.gz ACEXOFQEMKBSFW-AZUAARDMSA-N 2 0 355.501 4.128 20 0 FIADRP C[C@@H]([NH2+]CCCNc1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480690157 1112547467 /nfs/dbraw/zinc/54/74/67/1112547467.db2.gz ACEXOFQEMKBSFW-UYAOXDASSA-N 2 0 355.501 4.128 20 0 FIADRP C[C@@H]([NH2+]CCCNc1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480690156 1112547703 /nfs/dbraw/zinc/54/77/03/1112547703.db2.gz ACEXOFQEMKBSFW-QUCCMNQESA-N 2 0 355.501 4.128 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccccc2Cl)CC1 ZINC000480694780 1112557809 /nfs/dbraw/zinc/55/78/09/1112557809.db2.gz PVLXBOICIZPBAJ-SFHVURJKSA-N 2 0 371.956 4.328 20 0 FIADRP C[C@@H](C[NH+]1CCCCCC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000480701932 1112561952 /nfs/dbraw/zinc/56/19/52/1112561952.db2.gz VCHTZRKNOSJPNO-ZSJMHYJMSA-N 2 0 355.570 4.036 20 0 FIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccc(F)cc1 ZINC000480733669 1112569330 /nfs/dbraw/zinc/56/93/30/1112569330.db2.gz USLFSESKXIZJJY-QHCPKHFHSA-N 2 0 369.528 4.204 20 0 FIADRP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCCCC1 ZINC000480757680 1112589641 /nfs/dbraw/zinc/58/96/41/1112589641.db2.gz LTMRCFMMPGWCGT-IRLDBZIGSA-N 2 0 358.570 4.474 20 0 FIADRP CC(C)(Cc1cccc(C(F)(F)F)c1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168364254 1112590137 /nfs/dbraw/zinc/59/01/37/1112590137.db2.gz APFFNZFPZZBQSR-UHFFFAOYSA-N 2 0 354.460 4.491 20 0 FIADRP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000554993509 1112604673 /nfs/dbraw/zinc/60/46/73/1112604673.db2.gz BZVQMSKNBJWLDF-FPOVZHCZSA-N 2 0 351.538 4.310 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1OC(F)F ZINC000480900115 1112662837 /nfs/dbraw/zinc/66/28/37/1112662837.db2.gz MHFOJOFTQUHWMC-LSDHHAIUSA-N 2 0 356.457 4.069 20 0 FIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2CO[C@@H](C3CC3)C2)cc1 ZINC000667778285 1112671115 /nfs/dbraw/zinc/67/11/15/1112671115.db2.gz ZFWXMVVPDCICIP-JTHBVZDNSA-N 2 0 350.506 4.072 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1 ZINC000162883861 1113028848 /nfs/dbraw/zinc/02/88/48/1113028848.db2.gz SYZWGKVDOJDFEG-UHFFFAOYSA-N 2 0 356.416 4.480 20 0 FIADRP CC(C)[NH+]1CCC(Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC1 ZINC000899874605 1113037479 /nfs/dbraw/zinc/03/74/79/1113037479.db2.gz FSBALVRZBCJHIN-UHFFFAOYSA-N 2 0 353.388 4.418 20 0 FIADRP C[NH+](C)[C@@H]1CCCN(c2cc[nH+]c3cc(OC(F)(F)F)ccc32)CC1 ZINC000899876056 1113039687 /nfs/dbraw/zinc/03/96/87/1113039687.db2.gz JUQGVRVDGJRXHB-CYBMUJFWSA-N 2 0 353.388 4.054 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1cc[nH+]c2cc(OC(F)(F)F)ccc21 ZINC000899877861 1113041361 /nfs/dbraw/zinc/04/13/61/1113041361.db2.gz JXZQXCSZNDSYBO-ZIAGYGMSSA-N 2 0 365.399 4.196 20 0 FIADRP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(OC(F)(F)F)ccc43)CC[C@H]21 ZINC000899878675 1113041904 /nfs/dbraw/zinc/04/19/04/1113041904.db2.gz VULSJPLFMPSWHW-CXAGYDPISA-N 2 0 365.399 4.054 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1cccc(OCC[NH+](C)C)c1 ZINC000481715780 1113052622 /nfs/dbraw/zinc/05/26/22/1113052622.db2.gz JHNYVTUCIRBBMQ-GOSISDBHSA-N 2 0 363.505 4.069 20 0 FIADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732138 1113059317 /nfs/dbraw/zinc/05/93/17/1113059317.db2.gz DWZRYNCQVUZFRU-IRXDYDNUSA-N 2 0 355.295 4.113 20 0 FIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)CC1 ZINC000481941121 1113135192 /nfs/dbraw/zinc/13/51/92/1113135192.db2.gz AEBVUGYUURKJRA-KRWDZBQOSA-N 2 0 360.546 4.132 20 0 FIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000481989376 1113145662 /nfs/dbraw/zinc/14/56/62/1113145662.db2.gz ANZJRWQMIXAGDY-MRXNPFEDSA-N 2 0 369.484 4.141 20 0 FIADRP CCc1nc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)sc1C ZINC000482076175 1113172112 /nfs/dbraw/zinc/17/21/12/1113172112.db2.gz CTWAVPBLZWTTGH-UZLBHIALSA-N 2 0 357.567 4.057 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc4c(c3)CCCO4)cc2)CC[N@@H+]1C ZINC000482121604 1113181537 /nfs/dbraw/zinc/18/15/37/1113181537.db2.gz DCSBZUIGEAFHPB-VGOFRKELSA-N 2 0 350.506 4.251 20 0 FIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCCO3)cc1 ZINC000482127661 1113183915 /nfs/dbraw/zinc/18/39/15/1113183915.db2.gz ORJIPHNLNIBYTG-HTAPYJJXSA-N 2 0 350.506 4.108 20 0 FIADRP c1csc(CN2CCC[C@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)c1 ZINC000482131243 1113184677 /nfs/dbraw/zinc/18/46/77/1113184677.db2.gz WWAVYYGBNOUZGL-XLIONFOSSA-N 2 0 356.535 4.464 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000482333083 1113228139 /nfs/dbraw/zinc/22/81/39/1113228139.db2.gz ZCYABYSJPOXUOV-HZPDHXFCSA-N 2 0 358.448 4.399 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000162927074 1113250018 /nfs/dbraw/zinc/25/00/18/1113250018.db2.gz BVQSALOFNOVEES-LJQANCHMSA-N 3 0 360.505 4.319 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000482438624 1113255370 /nfs/dbraw/zinc/25/53/70/1113255370.db2.gz MTPPNJBBWAZZIL-AZUAARDMSA-N 2 0 369.528 4.107 20 0 FIADRP CC(C)CC[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Cl)cc1 ZINC000482537494 1113289674 /nfs/dbraw/zinc/28/96/74/1113289674.db2.gz NLDNDHCVUVXBFP-HXUWFJFHSA-N 2 0 352.950 4.111 20 0 FIADRP COCc1csc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000668189923 1113419208 /nfs/dbraw/zinc/41/92/08/1113419208.db2.gz UCYFPKROXPHNNK-UHFFFAOYSA-N 2 0 370.562 4.383 20 0 FIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483183255 1113459185 /nfs/dbraw/zinc/45/91/85/1113459185.db2.gz JFHQAMIMBAFLJD-QFBILLFUSA-N 2 0 362.562 4.234 20 0 FIADRP Cc1nn(-c2ccccc2)cc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486376491 1113556523 /nfs/dbraw/zinc/55/65/23/1113556523.db2.gz OYSGEFHMBCYIHN-SIKLNZKXSA-N 2 0 374.532 4.181 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486487857 1113579729 /nfs/dbraw/zinc/57/97/29/1113579729.db2.gz KNNYKMKWXKOREK-LPHOPBHVSA-N 2 0 360.448 4.288 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CS[C@@H](C(C)C)C3)CC2)cc1 ZINC000488415352 1113927279 /nfs/dbraw/zinc/92/72/79/1113927279.db2.gz AKJVBBFSWFQFQV-TZIWHRDSSA-N 2 0 362.583 4.027 20 0 FIADRP CCc1cccc(CC)c1NC(=O)[C@@H](C)[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000488433626 1113929536 /nfs/dbraw/zinc/92/95/36/1113929536.db2.gz JLZCFFRCHJTCCS-GOSISDBHSA-N 2 0 373.585 4.192 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000488434795 1113929571 /nfs/dbraw/zinc/92/95/71/1113929571.db2.gz NKMXWNXAAIXMLO-INIZCTEOSA-N 2 0 374.504 4.299 20 0 FIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cnn(-c3ccccc3)c2)CC1 ZINC000489652646 1114145654 /nfs/dbraw/zinc/14/56/54/1114145654.db2.gz XMSJEBBOBMARDL-UHFFFAOYSA-N 2 0 374.532 4.216 20 0 FIADRP COc1ccc(OC)c(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000489650215 1114150241 /nfs/dbraw/zinc/15/02/41/1114150241.db2.gz QJMSZONFEOGQJF-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@H](N2CC[NH+](C)CC2)[C@H](C)C1 ZINC000490988136 1114359503 /nfs/dbraw/zinc/35/95/03/1114359503.db2.gz OOAFNTGYNCUZIE-DXIQSLLYSA-N 2 0 357.586 4.003 20 0 FIADRP Cc1ccc(-c2noc([C@@H](N)CCCC[NH2+]C(C)C)n2)c2ccccc12 ZINC001212145011 1114417069 /nfs/dbraw/zinc/41/70/69/1114417069.db2.gz JDBUGPSOAJUIAU-IBGZPJMESA-N 2 0 352.482 4.366 20 0 FIADRP COCCC[NH+]1CCC([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC1 ZINC000588910582 1114672261 /nfs/dbraw/zinc/67/22/61/1114672261.db2.gz BLMACFQAOMXOBF-UHFFFAOYSA-N 2 0 367.537 4.045 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2csc(Br)c2)C1 ZINC000589837004 1114847349 /nfs/dbraw/zinc/84/73/49/1114847349.db2.gz UUHLPYSVDRZWTE-ZIAGYGMSSA-N 2 0 359.377 4.358 20 0 FIADRP CCCc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000591713827 1115120283 /nfs/dbraw/zinc/12/02/83/1115120283.db2.gz QPUMLVLLOYBBSW-SFHVURJKSA-N 2 0 369.528 4.381 20 0 FIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(O)(c3ccccc3)CC2)CC1 ZINC000760909936 1115171943 /nfs/dbraw/zinc/17/19/43/1115171943.db2.gz TWPMYSOORWFSMM-ZOGZRVJRSA-N 2 0 370.581 4.450 20 0 FIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2[nH]nc3ccccc32)CC1 ZINC000592464466 1115234880 /nfs/dbraw/zinc/23/48/80/1115234880.db2.gz TVFOBBHDDUJJAR-UHFFFAOYSA-N 2 0 368.912 4.218 20 0 FIADRP CCOC(=O)C(C)(C)CCC[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000593608245 1115335351 /nfs/dbraw/zinc/33/53/51/1115335351.db2.gz KPHSEZSZLBULDB-KRWDZBQOSA-N 2 0 352.563 4.131 20 0 FIADRP CSC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)CC[NH+](C)CC1 ZINC000593630416 1115336656 /nfs/dbraw/zinc/33/66/56/1115336656.db2.gz NQNIZEBQJMAPJG-KRWDZBQOSA-N 2 0 355.551 4.227 20 0 FIADRP COc1cccc(CNCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1F ZINC000669679703 1115773836 /nfs/dbraw/zinc/77/38/36/1115773836.db2.gz DGHVSJHRLXQPTK-KRWDZBQOSA-N 2 0 356.485 4.356 20 0 FIADRP FC1(F)CCC(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000669686123 1115786601 /nfs/dbraw/zinc/78/66/01/1115786601.db2.gz MXXAEEKLECOVJZ-UHFFFAOYSA-N 2 0 352.469 4.076 20 0 FIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)c1 ZINC000605400857 1115894127 /nfs/dbraw/zinc/89/41/27/1115894127.db2.gz IWYXWFYSNKUZBD-UHFFFAOYSA-N 2 0 374.488 4.341 20 0 FIADRP COc1c(C)cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1C ZINC000062426472 1115925868 /nfs/dbraw/zinc/92/58/68/1115925868.db2.gz UAMWNASKRXVXJV-OAQYLSRUSA-N 2 0 352.522 4.314 20 0 FIADRP C[C@H]1CC[C@H](C)[NH+]1CC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000607279433 1116014580 /nfs/dbraw/zinc/01/45/80/1116014580.db2.gz WCWIBVQGGQTPHU-ROUUACIJSA-N 2 0 357.542 4.262 20 0 FIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Cl)c(F)c1 ZINC000534328841 1116185295 /nfs/dbraw/zinc/18/52/95/1116185295.db2.gz MAHCNNLWUKMTOY-INIZCTEOSA-N 2 0 367.940 4.080 20 0 FIADRP C[N@H+](CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)Cc1ccccc1 ZINC000534354019 1116187990 /nfs/dbraw/zinc/18/79/90/1116187990.db2.gz XCCIWSHIFYVRDX-GMAHTHKFSA-N 2 0 352.522 4.266 20 0 FIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000534793791 1116237493 /nfs/dbraw/zinc/23/74/93/1116237493.db2.gz PRHPDXBFRUDQNU-BDJLRTHQSA-N 2 0 357.723 4.021 20 0 FIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000535083315 1116265974 /nfs/dbraw/zinc/26/59/74/1116265974.db2.gz WQMDAEGZFVDRJF-UHFFFAOYSA-N 2 0 368.569 4.100 20 0 FIADRP CCCc1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1 ZINC000539791670 1116380869 /nfs/dbraw/zinc/38/08/69/1116380869.db2.gz DUJWKMHGNIAYOK-UHFFFAOYSA-N 2 0 371.613 4.267 20 0 FIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)[C@H](C)C1 ZINC000539835167 1116388758 /nfs/dbraw/zinc/38/87/58/1116388758.db2.gz HSUCKNYYWSUSRN-QVKFZJNVSA-N 2 0 374.960 4.305 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)CC1 ZINC000462675453 1116389254 /nfs/dbraw/zinc/38/92/54/1116389254.db2.gz GSYAWHCNWREAAE-NRFANRHFSA-N 2 0 365.565 4.086 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC000539899549 1117740959 /nfs/dbraw/zinc/74/09/59/1117740959.db2.gz FSVZNYHYQNVTKE-RLLQIKCJSA-N 2 0 356.535 4.099 20 0 FIADRP Cc1[nH+]c2ccc(Br)cc2c(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c1C ZINC000462784366 1117762508 /nfs/dbraw/zinc/76/25/08/1117762508.db2.gz DZHZBQHUJSJJMX-HOTGVXAUSA-N 2 0 374.326 4.075 20 0 FIADRP CC[NH+]1CCC(CC[NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000462770702 1117767338 /nfs/dbraw/zinc/76/73/38/1117767338.db2.gz XUSOZQIYSBQTJM-UHFFFAOYSA-N 2 0 352.522 4.477 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000462797800 1117768815 /nfs/dbraw/zinc/76/88/15/1117768815.db2.gz GRXNTSIVVBFFKW-SFHVURJKSA-N 2 0 354.542 4.437 20 0 FIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)ccc1F ZINC000462791124 1117773202 /nfs/dbraw/zinc/77/32/02/1117773202.db2.gz KRJGQMQSHPUGPI-UHFFFAOYSA-N 2 0 372.484 4.132 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccccc2-c2cnn(C)c2)CC1 ZINC000540148665 1117900094 /nfs/dbraw/zinc/90/00/94/1117900094.db2.gz YDJFOBHQQLVSEE-WZONZLPQSA-N 2 0 366.553 4.220 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000540136990 1117900611 /nfs/dbraw/zinc/90/06/11/1117900611.db2.gz COYFFVYXDSICKS-VGSGFSFPSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(-c2cccs2)cc1 ZINC000540159220 1117903311 /nfs/dbraw/zinc/90/33/11/1117903311.db2.gz ZVDMVJMKQZJWNT-ORYQWCPZSA-N 2 0 370.562 4.444 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000540160368 1117904413 /nfs/dbraw/zinc/90/44/13/1117904413.db2.gz CTFZGLIRYTXFBB-MTNREXPMSA-N 2 0 358.570 4.403 20 0 FIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000540173119 1117913421 /nfs/dbraw/zinc/91/34/21/1117913421.db2.gz CVEPVEROSQGXDF-BBWFWOEESA-N 2 0 370.484 4.136 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCCOc3c(Cl)cccc32)C[C@@H](C)O1 ZINC000540175434 1117915672 /nfs/dbraw/zinc/91/56/72/1117915672.db2.gz IJWNCXBTOIOHQF-GPMSIDNRSA-N 2 0 366.933 4.033 20 0 FIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCCOc3c(Cl)cccc32)C[C@@H](C)O1 ZINC000540175437 1117915823 /nfs/dbraw/zinc/91/58/23/1117915823.db2.gz IJWNCXBTOIOHQF-MDZRGWNJSA-N 2 0 366.933 4.033 20 0 FIADRP Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000540178854 1117923380 /nfs/dbraw/zinc/92/33/80/1117923380.db2.gz HQZIPQCHYAWGRM-LAUBAEHRSA-N 2 0 354.494 4.028 20 0 FIADRP CC(C)O[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1(C)C ZINC000463023056 1117927724 /nfs/dbraw/zinc/92/77/24/1117927724.db2.gz GKSXCCGLTZTMBH-MOPGFXCFSA-N 2 0 350.572 4.142 20 0 FIADRP C[C@H](C[NH2+]C1CCN(Cc2ccccc2Cl)CC1)C[NH+]1CCCCC1 ZINC000463073767 1117957703 /nfs/dbraw/zinc/95/77/03/1117957703.db2.gz XOUKKXGQBHUPAV-GOSISDBHSA-N 2 0 363.977 4.016 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCCn2c(C)nc3ccccc32)C[C@H]1C ZINC000463105735 1117966635 /nfs/dbraw/zinc/96/66/35/1117966635.db2.gz HCRAKCGXIWYQQO-QUCCMNQESA-N 2 0 356.558 4.320 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(C(F)(F)F)cc1 ZINC000540301463 1117976444 /nfs/dbraw/zinc/97/64/44/1117976444.db2.gz ZRUQXZBZZNPQEN-MOPGFXCFSA-N 2 0 372.475 4.229 20 0 FIADRP COc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000540302004 1117976759 /nfs/dbraw/zinc/97/67/59/1117976759.db2.gz MHHQNCUBVRHZEM-YKSBVNFPSA-N 2 0 364.533 4.301 20 0 FIADRP Cc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+](C)C)cc1 ZINC000463120470 1117979235 /nfs/dbraw/zinc/97/92/35/1117979235.db2.gz VYRKYIMYTZSIKZ-QDSKXPNFSA-N 2 0 365.565 4.240 20 0 FIADRP CCc1ccc([C@@H]([NH2+]Cc2ccnc(OCC[NH+](C)C)c2)C(C)C)cc1 ZINC000540319357 1117982018 /nfs/dbraw/zinc/98/20/18/1117982018.db2.gz ZQZPSUVAIZIKHI-QFIPXVFZSA-N 2 0 355.526 4.071 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCN(c2ccccc2)CC1 ZINC000463147447 1117991282 /nfs/dbraw/zinc/99/12/82/1117991282.db2.gz VTKMCMYZVQVMDG-UHFFFAOYSA-N 2 0 351.538 4.287 20 0 FIADRP C[C@H]1C[C@@H](N[C@H]2CCOc3c(F)cccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463263602 1118058299 /nfs/dbraw/zinc/05/82/99/1118058299.db2.gz DDMOZZNRDNMIRY-MDKPJZGXSA-N 2 0 354.469 4.292 20 0 FIADRP C[C@@H]1CCCC[C@H]1OCC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540475538 1118078145 /nfs/dbraw/zinc/07/81/45/1118078145.db2.gz NUQIKHOWSDQYTG-HMXCVIKNSA-N 2 0 372.553 4.160 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000463291130 1118085862 /nfs/dbraw/zinc/08/58/62/1118085862.db2.gz WAXNSURLYBTVQS-WNXIRNOKSA-N 2 0 365.565 4.321 20 0 FIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000463291128 1118086204 /nfs/dbraw/zinc/08/62/04/1118086204.db2.gz WAXNSURLYBTVQS-UWXQAFAOSA-N 2 0 365.565 4.321 20 0 FIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCc3ccc(F)cc31)c1ccccc1O2 ZINC000540494728 1118092091 /nfs/dbraw/zinc/09/20/91/1118092091.db2.gz ISXDTFSKBMWCTP-NHCUHLMSSA-N 2 0 366.480 4.391 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(COc3cccc(COC)c3)CCC2)C[C@H]1C ZINC000540548436 1118120719 /nfs/dbraw/zinc/12/07/19/1118120719.db2.gz UXEDXITUXVNQAH-CTNGQTDRSA-N 2 0 374.569 4.187 20 0 FIADRP CCN1CCC([NH2+][C@@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540778303 1118240944 /nfs/dbraw/zinc/24/09/44/1118240944.db2.gz HWGASQFLBXCVKT-UXHICEINSA-N 2 0 367.940 4.077 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](CC2CCC2)c2ccccc2)C1 ZINC000540988117 1118339930 /nfs/dbraw/zinc/33/99/30/1118339930.db2.gz GKEMNGJJZGSXCX-RPWUZVMVSA-N 2 0 364.533 4.274 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)CC2)c1 ZINC000464073782 1118431857 /nfs/dbraw/zinc/43/18/57/1118431857.db2.gz JKOCYOXZVMMEOE-XUVXKRRUSA-N 2 0 362.583 4.145 20 0 FIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000464077503 1118433715 /nfs/dbraw/zinc/43/37/15/1118433715.db2.gz RZVHQZLPBZSDKN-UHFFFAOYSA-N 2 0 354.542 4.438 20 0 FIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H](c2ccco2)c2ccccc2)cc1 ZINC000541544598 1118550005 /nfs/dbraw/zinc/55/00/05/1118550005.db2.gz WXSMVSSPHKZGRP-QHCPKHFHSA-N 2 0 364.489 4.142 20 0 FIADRP O=C1CC[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)c2ccccc2N1 ZINC000541545904 1118550553 /nfs/dbraw/zinc/55/05/53/1118550553.db2.gz PPIOJLUXVYWVIE-IBGZPJMESA-N 2 0 369.534 4.023 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000541536195 1118553817 /nfs/dbraw/zinc/55/38/17/1118553817.db2.gz DLXXPRJKYABIRL-OAQYLSRUSA-N 2 0 350.441 4.442 20 0 FIADRP C[C@H]([NH2+]CCOc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541602838 1118583555 /nfs/dbraw/zinc/58/35/55/1118583555.db2.gz BKNIUIWLKDUNRG-GJZGRUSLSA-N 2 0 354.897 4.101 20 0 FIADRP COc1cccc(CCC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464843898 1118718940 /nfs/dbraw/zinc/71/89/40/1118718940.db2.gz ZKRZLWDQAFDRIR-QFIPXVFZSA-N 2 0 352.522 4.082 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(F)c1 ZINC000173903105 1119078298 /nfs/dbraw/zinc/07/82/98/1119078298.db2.gz KFHIMBYBYCLRKO-KURKYZTESA-N 2 0 356.485 4.286 20 0 FIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000173949799 1119081934 /nfs/dbraw/zinc/08/19/34/1119081934.db2.gz NDCDIRHHSGOXJQ-MRXNPFEDSA-N 2 0 370.459 4.343 20 0 FIADRP Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000178117198 1119372479 /nfs/dbraw/zinc/37/24/79/1119372479.db2.gz IVXNCBWEANWBPH-FGTMMUONSA-N 2 0 354.542 4.057 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2sc(C)nc2C)cc1 ZINC000178131330 1119373037 /nfs/dbraw/zinc/37/30/37/1119373037.db2.gz IAQDODLVUNMVBA-HNNXBMFYSA-N 2 0 361.555 4.331 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1sc(C)nc1C ZINC000178132166 1119373165 /nfs/dbraw/zinc/37/31/65/1119373165.db2.gz KFUZIEADYNNREM-OAHLLOKOSA-N 2 0 361.555 4.331 20 0 FIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000311493634 1119376900 /nfs/dbraw/zinc/37/69/00/1119376900.db2.gz KDEPGAVFBZOWDW-CVDCTZTESA-N 2 0 350.506 4.184 20 0 FIADRP COc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311633982 1119382687 /nfs/dbraw/zinc/38/26/87/1119382687.db2.gz JRNBNYBUULODQP-IPJJNNNSSA-N 2 0 352.522 4.126 20 0 FIADRP Cc1cc(N2CCC([NH2+][C@H]3CC(C)(C)c4ccccc43)CC2)nc(C)n1 ZINC000178322285 1119384118 /nfs/dbraw/zinc/38/41/18/1119384118.db2.gz FDJYQCUQUWUUCG-FQEVSTJZSA-N 2 0 350.510 4.074 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1ccc(OCc2ccccc2)cc1 ZINC000311821915 1119390590 /nfs/dbraw/zinc/39/05/90/1119390590.db2.gz QOIJKFPAGQKHEI-PWHSHALESA-N 2 0 352.522 4.126 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(Cc2cccc(F)c2)CC1 ZINC000542469062 1119483128 /nfs/dbraw/zinc/48/31/28/1119483128.db2.gz JIBBJSFGUINOHM-UHFFFAOYSA-N 2 0 364.468 4.170 20 0 FIADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493923711 1119509496 /nfs/dbraw/zinc/50/94/96/1119509496.db2.gz DKJNDPWZBOCARB-CCRGXQTGSA-N 2 0 351.332 4.158 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493935285 1119511945 /nfs/dbraw/zinc/51/19/45/1119511945.db2.gz HZUOJBCBPKFGMR-DMKPSLHHSA-N 2 0 365.359 4.405 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCO2 ZINC000183187600 1119568396 /nfs/dbraw/zinc/56/83/96/1119568396.db2.gz DOUOGQBRRUXTQT-POAQFYNOSA-N 2 0 358.526 4.152 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000186574135 1119737301 /nfs/dbraw/zinc/73/73/01/1119737301.db2.gz STIFEHJBHNKHCK-VQTJNVASSA-N 2 0 367.537 4.156 20 0 FIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000187101700 1119766442 /nfs/dbraw/zinc/76/64/42/1119766442.db2.gz NZUYVZAIINIBRU-UHFFFAOYSA-N 2 0 361.489 4.109 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(N(C)C(C)C)nc2)c1 ZINC000190789716 1119949291 /nfs/dbraw/zinc/94/92/91/1119949291.db2.gz GVWSETAIBAPKJD-UHFFFAOYSA-N 2 0 354.542 4.058 20 0 FIADRP CC(C)N(C)c1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cn1 ZINC000190889718 1119952418 /nfs/dbraw/zinc/95/24/18/1119952418.db2.gz FCDUSSXPLWGVNF-UHFFFAOYSA-N 2 0 354.542 4.056 20 0 FIADRP COc1ccc([C@H]2CCCCC[N@@H+]2CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000191401601 1119975408 /nfs/dbraw/zinc/97/54/08/1119975408.db2.gz ZNKHXVMLUGWKNU-HSZRJFAPSA-N 2 0 373.585 4.028 20 0 FIADRP CC[NH+](CC)Cc1ccc(NC2CC[NH+](CCC(F)(F)F)CC2)cc1 ZINC000191583611 1119985305 /nfs/dbraw/zinc/98/53/05/1119985305.db2.gz HYMMEMOYBYAICQ-UHFFFAOYSA-N 2 0 357.464 4.357 20 0 FIADRP C[C@H]1COCC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000192542772 1120066815 /nfs/dbraw/zinc/06/68/15/1120066815.db2.gz XYBQQVPHHVOUTH-MBSDFSHPSA-N 2 0 361.489 4.113 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc(Br)cs1 ZINC000193950092 1120218484 /nfs/dbraw/zinc/21/84/84/1120218484.db2.gz IQRLZCNRWUHPPQ-LBPRGKRZSA-N 2 0 353.329 4.423 20 0 FIADRP C[N@H+](CCCOCc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000542508522 1120289223 /nfs/dbraw/zinc/28/92/23/1120289223.db2.gz VWXAAYGKBVEDJD-HSZRJFAPSA-N 2 0 352.522 4.047 20 0 FIADRP CCOc1c(Cl)cccc1C[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000494934202 1120377274 /nfs/dbraw/zinc/37/72/74/1120377274.db2.gz GDKFNIVXPXJOMP-UHFFFAOYSA-N 2 0 368.949 4.062 20 0 FIADRP C[C@@H]([NH2+]CCOc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542532755 1120429330 /nfs/dbraw/zinc/42/93/30/1120429330.db2.gz PTCHHTCADZOSSH-HZPDHXFCSA-N 2 0 370.459 4.327 20 0 FIADRP C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495186297 1120531784 /nfs/dbraw/zinc/53/17/84/1120531784.db2.gz WORFMZLOALWTKN-PZJWPPBQSA-N 2 0 356.554 4.226 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000495438870 1120824466 /nfs/dbraw/zinc/82/44/66/1120824466.db2.gz JDVARZFWOKBHOZ-ZYSHUDEJSA-N 2 0 355.551 4.329 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4ccccc43)cc2)C[C@H](C)O1 ZINC000495547034 1120882529 /nfs/dbraw/zinc/88/25/29/1120882529.db2.gz KTJZRJXPKCGOMJ-YDIMBITNSA-N 2 0 364.533 4.463 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccccc2C)CC1 ZINC000236982929 1120972159 /nfs/dbraw/zinc/97/21/59/1120972159.db2.gz FQVWOWYJTDIDER-GOSISDBHSA-N 2 0 355.501 4.127 20 0 FIADRP Clc1ncccc1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762925085 1120997866 /nfs/dbraw/zinc/99/78/66/1120997866.db2.gz BCEUJUJHWSCAIT-UHFFFAOYSA-N 2 0 355.913 4.223 20 0 FIADRP C[NH+](C)CCCC1CC[NH+](Cc2coc(-c3ccc(F)c(F)c3)n2)CC1 ZINC000123350084 1121445231 /nfs/dbraw/zinc/44/52/31/1121445231.db2.gz QTIYYFCRBVYLEQ-UHFFFAOYSA-N 2 0 363.452 4.174 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc(C)cc(C)c3)CC2)cc1 ZINC000063319554 1121558859 /nfs/dbraw/zinc/55/88/59/1121558859.db2.gz DKMZFQDWTMDXFE-UHFFFAOYSA-N 2 0 352.522 4.314 20 0 FIADRP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000542595999 1121586449 /nfs/dbraw/zinc/58/64/49/1121586449.db2.gz PSIUBPWAKMNYFW-FQEVSTJZSA-N 2 0 363.977 4.141 20 0 FIADRP C[C@@H]1C[C@@H](Nc2ccncc2Br)CC[N@@H+]1Cc1ccccc1 ZINC000306604996 1121598447 /nfs/dbraw/zinc/59/84/47/1121598447.db2.gz ZRPMZWOFUMKLKC-ZBFHGGJFSA-N 2 0 360.299 4.309 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(OC)cc32)c1 ZINC000123900026 1121642888 /nfs/dbraw/zinc/64/28/88/1121642888.db2.gz CPNINQADEUDCOK-NRFANRHFSA-N 2 0 354.494 4.150 20 0 FIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc2c(c1)OCCO2 ZINC000123923328 1121646947 /nfs/dbraw/zinc/64/69/47/1121646947.db2.gz JPPZNHJZUYXFQP-FQEVSTJZSA-N 2 0 354.494 4.150 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCc4ccccc43)cc2)C[C@H](C)O1 ZINC000124593063 1121707384 /nfs/dbraw/zinc/70/73/84/1121707384.db2.gz QNSFWKMFYYHING-IEGUWTFLSA-N 2 0 350.506 4.073 20 0 FIADRP C[C@@H]([NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC000671764618 1121796872 /nfs/dbraw/zinc/79/68/72/1121796872.db2.gz KLSXMBDLIZOTEY-QRWLVFNGSA-N 2 0 350.934 4.128 20 0 FIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)C1 ZINC000125802110 1121840956 /nfs/dbraw/zinc/84/09/56/1121840956.db2.gz HHPSNINGHSDYAY-GOSISDBHSA-N 2 0 363.977 4.014 20 0 FIADRP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OCc2nccn2C)cc1 ZINC000125895278 1121863414 /nfs/dbraw/zinc/86/34/14/1121863414.db2.gz JXZSWGRMBAHIIS-YLJYHZDGSA-N 2 0 372.557 4.016 20 0 FIADRP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000069753261 1121879252 /nfs/dbraw/zinc/87/92/52/1121879252.db2.gz CPNIJHJHOLVFNF-DYESRHJHSA-N 2 0 354.494 4.167 20 0 FIADRP c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)c(C[NH2+]CC2=CCCOC2)c1 ZINC000126414891 1121952557 /nfs/dbraw/zinc/95/25/57/1121952557.db2.gz JJAHKVAKJSFACI-UHFFFAOYSA-N 2 0 362.517 4.386 20 0 FIADRP C[C@H](CSC(C)(C)C)[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765781862 1121992301 /nfs/dbraw/zinc/99/23/01/1121992301.db2.gz XOWUKRHQEHTCHU-HZPDHXFCSA-N 2 0 367.578 4.148 20 0 FIADRP C[C@@H](CSC(C)(C)C)[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000765781859 1121992470 /nfs/dbraw/zinc/99/24/70/1121992470.db2.gz XOWUKRHQEHTCHU-HOTGVXAUSA-N 2 0 367.578 4.148 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3c(F)cccc3F)cc2)C1 ZINC000917008896 1121997448 /nfs/dbraw/zinc/99/74/48/1121997448.db2.gz USPYFVWZCSGBGR-HRAATJIYSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cc(F)ccc3F)cc2)C1 ZINC000917007716 1121999440 /nfs/dbraw/zinc/99/94/40/1121999440.db2.gz AUISTQCXZGVBRZ-KSFYIVLOSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccccc3F)cc2)C1 ZINC000917006698 1121999584 /nfs/dbraw/zinc/99/95/84/1121999584.db2.gz UQXFLZGXLSOVHN-PNCHPQGNSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2cc(F)ccc2F)cc1 ZINC000917008176 1122000186 /nfs/dbraw/zinc/00/01/86/1122000186.db2.gz GNSWOZCQQZCBSB-KSFYIVLOSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccccc1 ZINC000497318813 1122021882 /nfs/dbraw/zinc/02/18/82/1122021882.db2.gz CEPODQUPWSNGHU-LJQANCHMSA-N 2 0 365.521 4.179 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@@H](O)c2ccc3ccccc3c2)CC1 ZINC000917069745 1122075686 /nfs/dbraw/zinc/07/56/86/1122075686.db2.gz ZXLHCJLWKFPOJC-HSZRJFAPSA-N 2 0 354.538 4.317 20 0 FIADRP CC(C)C[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000127409586 1122091416 /nfs/dbraw/zinc/09/14/16/1122091416.db2.gz ISXCCJJQYQGGIC-LPHOPBHVSA-N 2 0 371.491 4.018 20 0 FIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168616195 1122108576 /nfs/dbraw/zinc/10/85/76/1122108576.db2.gz QPIRGRHMCAWEOK-NFBKMPQASA-N 2 0 374.569 4.406 20 0 FIADRP COc1ccc([C@H]2C[C@H]([N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)CCO2)cc1 ZINC001168626996 1122187750 /nfs/dbraw/zinc/18/77/50/1122187750.db2.gz ZVRJXQBEBCIYRH-NXLVEIQXSA-N 2 0 360.542 4.143 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000497387225 1122199662 /nfs/dbraw/zinc/19/96/62/1122199662.db2.gz QTELJIRKRUWCAA-DLTYFMDKSA-N 2 0 364.533 4.264 20 0 FIADRP CCOc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)ccc1OCc1ccccc1 ZINC000655825565 1122203166 /nfs/dbraw/zinc/20/31/66/1122203166.db2.gz HTCADLZTUWGEQI-OYRHEFFESA-N 2 0 368.521 4.094 20 0 FIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000128565792 1122346564 /nfs/dbraw/zinc/34/65/64/1122346564.db2.gz RGJQQJBYOVONRQ-HXUWFJFHSA-N 2 0 351.538 4.032 20 0 FIADRP CC(C)[C@H](C[NH2+][C@@H](c1cc2ccccc2o1)C(C)(C)C)N1CC[NH+](C)CC1 ZINC000497833595 1122430095 /nfs/dbraw/zinc/43/00/95/1122430095.db2.gz WHCJECCXGDAWKR-UGKGYDQZSA-N 2 0 371.569 4.382 20 0 FIADRP C[C@@H](c1cccc(Br)c1)[NH+]1CCC(Cc2nccn2C)CC1 ZINC000128907120 1122457945 /nfs/dbraw/zinc/45/79/45/1122457945.db2.gz RGLPZDKSCPVJSB-AWEZNQCLSA-N 2 0 362.315 4.198 20 0 FIADRP FC(F)(F)c1cc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc(C(F)(F)F)c1 ZINC000129473411 1122610337 /nfs/dbraw/zinc/61/03/37/1122610337.db2.gz CWUGMMVQUPMBBT-NSHDSACASA-N 2 0 366.349 4.298 20 0 FIADRP CSc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000069833299 1122690397 /nfs/dbraw/zinc/69/03/97/1122690397.db2.gz UDRXLYBRMGWCJJ-ROUUACIJSA-N 2 0 370.562 4.308 20 0 FIADRP CC(C)CC[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231514 1122748911 /nfs/dbraw/zinc/74/89/11/1122748911.db2.gz WFPYVTVTSFAHED-RBBKRZOGSA-N 2 0 358.570 4.330 20 0 FIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cc(C(F)(F)F)ccn2)CC1 ZINC000556233359 1122751421 /nfs/dbraw/zinc/75/14/21/1122751421.db2.gz NRIWHJSECBUIIC-HNAYVOBHSA-N 2 0 369.475 4.276 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000556239183 1122756575 /nfs/dbraw/zinc/75/65/75/1122756575.db2.gz BBJPJCHBRZKPCU-DENIHFKCSA-N 2 0 362.533 4.395 20 0 FIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230733 1122757052 /nfs/dbraw/zinc/75/70/52/1122757052.db2.gz ANFIPZXFMCDWRS-ZLNRFVROSA-N 2 0 370.581 4.474 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC(C)(C)CCO)c2ccc(F)cc2)CC1 ZINC000556247340 1122760844 /nfs/dbraw/zinc/76/08/44/1122760844.db2.gz VZOIDXHXPYHAIB-OAQYLSRUSA-N 2 0 364.549 4.377 20 0 FIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)ccn1 ZINC000556248438 1122762013 /nfs/dbraw/zinc/76/20/13/1122762013.db2.gz ZXGOCMOZMQYKIR-GOSISDBHSA-N 2 0 353.510 4.173 20 0 FIADRP CCCOc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1 ZINC000556430808 1122886679 /nfs/dbraw/zinc/88/66/79/1122886679.db2.gz RWTZSSSZZJPOSH-UHFFFAOYSA-N 2 0 368.521 4.238 20 0 FIADRP C[N@@H+](CCC(=O)Nc1c(Cl)cccc1Cl)CC[C@@H]1CCCC[NH+]1C ZINC000072725481 1123133446 /nfs/dbraw/zinc/13/34/46/1123133446.db2.gz SGQPNZQQQVLVRT-AWEZNQCLSA-N 2 0 372.340 4.128 20 0 FIADRP COc1ccccc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000556883460 1123158838 /nfs/dbraw/zinc/15/88/38/1123158838.db2.gz JZAXOIOVVYYTPQ-UHFFFAOYSA-N 2 0 350.506 4.183 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCSCC(F)(F)F)CC1 ZINC000556884282 1123160492 /nfs/dbraw/zinc/16/04/92/1123160492.db2.gz ANNVMYPEOITHCS-UHFFFAOYSA-N 2 0 360.489 4.315 20 0 FIADRP C[C@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@H]1CCC[NH2+]C1 ZINC000556951940 1123262258 /nfs/dbraw/zinc/26/22/58/1123262258.db2.gz FCCPJIXOKDKMIA-GJZGRUSLSA-N 2 0 371.352 4.019 20 0 FIADRP CN(CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000499146005 1123287937 /nfs/dbraw/zinc/28/79/37/1123287937.db2.gz IYAJIMFFOSHVNT-ULPXVVAUSA-N 2 0 363.549 4.298 20 0 FIADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499191625 1123319892 /nfs/dbraw/zinc/31/98/92/1123319892.db2.gz MGRSUAFKIOKRIM-WBDAEOGXSA-N 2 0 352.497 4.462 20 0 FIADRP C[NH+](C)CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000499217782 1123333552 /nfs/dbraw/zinc/33/35/52/1123333552.db2.gz WONJHVRJFMLZTB-YUMYIRISSA-N 3 0 357.586 4.138 20 0 FIADRP CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1c(C)nn(C)c1C ZINC000499245972 1123363573 /nfs/dbraw/zinc/36/35/73/1123363573.db2.gz BQVRPDHXXTYRTJ-YUMYIRISSA-N 2 0 366.553 4.273 20 0 FIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1C ZINC000132819498 1123365275 /nfs/dbraw/zinc/36/52/75/1123365275.db2.gz USGIQEVLHBBYLK-FQEVSTJZSA-N 2 0 366.549 4.419 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3F)cc2)C1 ZINC000920181372 1123398245 /nfs/dbraw/zinc/39/82/45/1123398245.db2.gz UDIROUXUTWJUSJ-IBGZPJMESA-N 2 0 356.485 4.226 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1cnn(C)c1 ZINC000133398012 1123483618 /nfs/dbraw/zinc/48/36/18/1123483618.db2.gz VOJKNIHEIDOJNZ-HSZRJFAPSA-N 2 0 362.521 4.390 20 0 FIADRP CC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCOC1 ZINC000133412791 1123485216 /nfs/dbraw/zinc/48/52/16/1123485216.db2.gz GRRQWVOXZNZKRB-GGAORHGYSA-N 2 0 352.522 4.320 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccccc2OCc2cccnc2)cc1 ZINC000075734250 1123510221 /nfs/dbraw/zinc/51/02/21/1123510221.db2.gz PEOPGKLCFFAQGZ-UHFFFAOYSA-N 2 0 361.489 4.012 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccccc1 ZINC000615316036 1123988785 /nfs/dbraw/zinc/98/87/85/1123988785.db2.gz HXXRXNPFWLUMFE-OALUTQOASA-N 2 0 365.521 4.035 20 0 FIADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245655378 1124169900 /nfs/dbraw/zinc/16/99/00/1124169900.db2.gz DIPBLBRGIQDEHT-CCSDVLNMSA-N 2 0 356.554 4.223 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc2c(c1)OCO2 ZINC000245676152 1124186505 /nfs/dbraw/zinc/18/65/05/1124186505.db2.gz ICOQGBIDZGCHQU-DVWBAYGPSA-N 2 0 364.489 4.262 20 0 FIADRP CCc1nc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC000245702193 1124209912 /nfs/dbraw/zinc/20/99/12/1124209912.db2.gz MAHBLWOIVAUIIR-OWZKRDHZSA-N 2 0 355.551 4.033 20 0 FIADRP O[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000180106128 1124227994 /nfs/dbraw/zinc/22/79/94/1124227994.db2.gz JSNSZOWWXUAFAC-KBRMVUAJSA-N 2 0 370.924 4.159 20 0 FIADRP OCCC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000245737511 1124228594 /nfs/dbraw/zinc/22/85/94/1124228594.db2.gz RAFRUBAGZDADFU-UEQSERJNSA-N 2 0 364.533 4.285 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)c1ccc2ccccc2c1 ZINC000765881161 1124326840 /nfs/dbraw/zinc/32/68/40/1124326840.db2.gz NMYMKODQZMAEFV-WVQWTBLQSA-N 2 0 374.528 4.373 20 0 FIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC000542848570 1124448834 /nfs/dbraw/zinc/44/88/34/1124448834.db2.gz RWLYHQQSGKKLPQ-PGRDOPGGSA-N 2 0 370.924 4.074 20 0 FIADRP c1nc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)sc1-c1ccccc1 ZINC000246563735 1124534141 /nfs/dbraw/zinc/53/41/41/1124534141.db2.gz LAXNWMHQZQUJOA-HKUYNNGSSA-N 2 0 353.535 4.259 20 0 FIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)cn1 ZINC000246808140 1124562086 /nfs/dbraw/zinc/56/20/86/1124562086.db2.gz AKCSLIJQUAIGOP-QRVBRYPASA-N 2 0 354.542 4.232 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1ccc(OCC[NH+](C)C)cc1 ZINC000248157381 1124747302 /nfs/dbraw/zinc/74/73/02/1124747302.db2.gz RNVFCHYFWGXLNM-HFSMHLIXSA-N 2 0 362.558 4.119 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCOC5(CCCC5)C4)[C@H]3C2)cc1 ZINC000248394686 1124760246 /nfs/dbraw/zinc/76/02/46/1124760246.db2.gz FSSFORPZGSYMIX-MLCQCVOFSA-N 2 0 368.565 4.369 20 0 FIADRP COc1cc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000248403793 1124762824 /nfs/dbraw/zinc/76/28/24/1124762824.db2.gz PDHLEFUGGIWOCK-BZSNNMDCSA-N 2 0 360.542 4.316 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC000248432106 1124767288 /nfs/dbraw/zinc/76/72/88/1124767288.db2.gz CNMVMILHGIRBSW-IFMALSPDSA-N 2 0 370.562 4.336 20 0 FIADRP CC(C)[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(F)c(F)c1 ZINC000248444569 1124769556 /nfs/dbraw/zinc/76/95/56/1124769556.db2.gz MCBOYSBVGUGYKN-NJYVYQBISA-N 2 0 366.496 4.019 20 0 FIADRP c1ccc(CN2CCCO[C@@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000248744932 1124808110 /nfs/dbraw/zinc/80/81/10/1124808110.db2.gz FHYUHVLWIDXNBR-FPOVZHCZSA-N 2 0 368.546 4.104 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000248814207 1124815977 /nfs/dbraw/zinc/81/59/77/1124815977.db2.gz KVFZEADHQIFNBR-QTGUNEKASA-N 2 0 368.521 4.198 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000248913061 1124827842 /nfs/dbraw/zinc/82/78/42/1124827842.db2.gz VRQYRZLSQRZEDT-MTNREXPMSA-N 2 0 374.569 4.282 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3occc32)C[C@@H](C)O1 ZINC000249056670 1124839962 /nfs/dbraw/zinc/83/99/62/1124839962.db2.gz YTGGMVWXUQBVIS-LZJOCLMNSA-N 2 0 354.494 4.056 20 0 FIADRP CC[C@H](Cc1ccccc1Br)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000542937151 1124925003 /nfs/dbraw/zinc/92/50/03/1124925003.db2.gz WUTQPJRRURNICJ-MRXNPFEDSA-N 2 0 353.348 4.233 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3Br)c1 ZINC000091281257 1125060635 /nfs/dbraw/zinc/06/06/35/1125060635.db2.gz KUTMGRGMJBTDCB-IBGZPJMESA-N 2 0 359.311 4.288 20 0 FIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3Br)c1 ZINC000091281256 1125060869 /nfs/dbraw/zinc/06/08/69/1125060869.db2.gz KUTMGRGMJBTDCB-LJQANCHMSA-N 2 0 359.311 4.288 20 0 FIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1 ZINC000091285093 1125061521 /nfs/dbraw/zinc/06/15/21/1125061521.db2.gz UMNSKCCKPYBTPY-LJQANCHMSA-N 2 0 371.491 4.020 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000091285187 1125061614 /nfs/dbraw/zinc/06/16/14/1125061614.db2.gz DVSKSWQERARFEB-JOCHJYFZSA-N 2 0 361.549 4.064 20 0 FIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000091285188 1125062492 /nfs/dbraw/zinc/06/24/92/1125062492.db2.gz DVSKSWQERARFEB-QFIPXVFZSA-N 2 0 361.549 4.064 20 0 FIADRP COc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C(C)C)cc1 ZINC000091372378 1125069825 /nfs/dbraw/zinc/06/98/25/1125069825.db2.gz LEWGRALAGUMVNR-JOCHJYFZSA-N 2 0 353.510 4.294 20 0 FIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1nc2ccccc2n1C ZINC000091403723 1125070434 /nfs/dbraw/zinc/07/04/34/1125070434.db2.gz QSGFHNHAARHYEM-VIQWUECVSA-N 2 0 354.542 4.267 20 0 FIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000093399091 1125319158 /nfs/dbraw/zinc/31/91/58/1125319158.db2.gz SKBLFVHHFBCZRX-OAQYLSRUSA-N 2 0 356.510 4.185 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCCC1CCOCC1 ZINC000499625399 1125389536 /nfs/dbraw/zinc/38/95/36/1125389536.db2.gz LRZDVKRFYSSHHA-NPHXMPSESA-N 2 0 358.570 4.330 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)c2nc(-c3ccccc3)no2)CC1 ZINC000066960841 568072368 /nfs/dbraw/zinc/07/23/68/568072368.db2.gz IDKWCPFRISYKGO-KRWDZBQOSA-N 2 0 356.514 4.242 20 0 FIADRP CC(C)(C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccs1 ZINC000603949606 568186908 /nfs/dbraw/zinc/18/69/08/568186908.db2.gz LBGDUUKVSKGYNX-UHFFFAOYSA-N 2 0 358.551 4.290 20 0 FIADRP COc1cc2cc[nH+]c(N3CCCC[C@@H]3CC[NH+]3CCCC3)c2cc1OC ZINC001165048303 721971388 /nfs/dbraw/zinc/97/13/88/721971388.db2.gz NPLRWGCERRCXDT-GOSISDBHSA-N 2 0 369.509 4.097 20 0 FIADRP Clc1ccccc1SCCC[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000670987495 1125506869 /nfs/dbraw/zinc/50/68/69/1125506869.db2.gz VKFUXLUFBDVCOO-QGZVFWFLSA-N 2 0 368.974 4.009 20 0 FIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cccc(Br)c2Cl)CC1 ZINC000715561146 1124189875 /nfs/dbraw/zinc/18/98/75/1124189875.db2.gz HSSYXDWLXFSRCV-UHFFFAOYSA-N 2 0 359.739 4.455 20 0 FIADRP CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000544827690 1079544511 /nfs/dbraw/zinc/54/45/11/1079544511.db2.gz IJWKWLVUTXJVKL-MGPUTAFESA-N 2 0 350.934 4.413 20 0 FIADRP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC001648785836 1079569168 /nfs/dbraw/zinc/56/91/68/1079569168.db2.gz HSNLNFXWOWAOLG-HYBUGGRVSA-N 2 0 363.549 4.287 20 0 FIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4c3CCC4)cc2)C[C@H](C)O1 ZINC001648785904 1079577474 /nfs/dbraw/zinc/57/74/74/1079577474.db2.gz LBLOSJDIVYPRAN-KDURUIRLSA-N 2 0 364.533 4.074 20 0 FIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[NH2+]C4(CCC4)C2)CCC3)cc1 ZINC000643545820 1079658579 /nfs/dbraw/zinc/65/85/79/1079658579.db2.gz COQXRDOZAYJNDF-DLBZAZTESA-N 2 0 353.535 4.452 20 0 FIADRP COc1cccc(C[C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)c1 ZINC000643546859 1079671655 /nfs/dbraw/zinc/67/16/55/1079671655.db2.gz VWTMCQSANITNGA-RBBKRZOGSA-N 2 0 350.506 4.243 20 0 FIADRP Brc1ccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C2CC2)s1 ZINC000643548329 1079680195 /nfs/dbraw/zinc/68/01/95/1079680195.db2.gz NWNINSVZBIBDBG-WFASDCNBSA-N 2 0 355.345 4.226 20 0 FIADRP C[NH+]1CCC(CC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000544833164 1079753039 /nfs/dbraw/zinc/75/30/39/1079753039.db2.gz QCUZNTITENIMDK-NRFANRHFSA-N 2 0 357.929 4.340 20 0 FIADRP Cc1ccc(F)cc1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000180094096 1080440865 /nfs/dbraw/zinc/44/08/65/1080440865.db2.gz DUQIIYWMMSKEQM-HDICACEKSA-N 2 0 356.485 4.033 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(C(C)(C)C)cc1 ZINC000180641783 1080531715 /nfs/dbraw/zinc/53/17/15/1080531715.db2.gz QYFMMWWUCQWJLZ-JPYJTQIMSA-N 2 0 366.549 4.402 20 0 FIADRP CCOc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC ZINC000312519845 1080965287 /nfs/dbraw/zinc/96/52/87/1080965287.db2.gz OIRGYUJSQYDGPM-GHTZIAJQSA-N 2 0 368.521 4.094 20 0 FIADRP CCOc1cncc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)c1 ZINC001648808661 1081114113 /nfs/dbraw/zinc/11/41/13/1081114113.db2.gz YYKMENCLEGULEY-RTBURBONSA-N 2 0 367.537 4.248 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001648811441 1081126316 /nfs/dbraw/zinc/12/63/16/1081126316.db2.gz NXKCKGNBBGCZSW-HOTGVXAUSA-N 2 0 361.480 4.361 20 0 FIADRP CC(C)(C)c1ccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397534212 1081187046 /nfs/dbraw/zinc/18/70/46/1081187046.db2.gz GNTXQQNPZIUERT-UHFFFAOYSA-N 2 0 366.549 4.101 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C(Cc2ccccc2F)Cc2ccccc2F)C1 ZINC000655805732 1081213748 /nfs/dbraw/zinc/21/37/48/1081213748.db2.gz RSDKCDZGFPETLH-MOBUCQHHSA-N 2 0 358.476 4.048 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCCC(C)(C)CC3)cc2)CC1 ZINC001648815010 1081227833 /nfs/dbraw/zinc/22/78/33/1081227833.db2.gz YDWVDZNOUBMNIP-QFIPXVFZSA-N 2 0 357.586 4.273 20 0 FIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000655827639 1081233233 /nfs/dbraw/zinc/23/32/33/1081233233.db2.gz VVDKZHAOYWGQOH-VDISTLRHSA-N 2 0 354.338 4.154 20 0 FIADRP CO[C@H](Cc1ccccc1)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC001167310134 1081271210 /nfs/dbraw/zinc/27/12/10/1081271210.db2.gz NWKRCYXZDIJCPJ-XMMPIXPASA-N 2 0 366.549 4.088 20 0 FIADRP CC1CCC([N@H+](CCCc2cncn2C)Cc2ccc3c(c2)OCO3)CC1 ZINC001167310167 1081272635 /nfs/dbraw/zinc/27/26/35/1081272635.db2.gz OSYIFMURYXWSLK-UHFFFAOYSA-N 2 0 369.509 4.162 20 0 FIADRP c1[nH]c2ccccc2c1CC[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000580073583 1081571556 /nfs/dbraw/zinc/57/15/56/1081571556.db2.gz PDWQHMHLULWPRQ-OAQYLSRUSA-N 2 0 359.517 4.497 20 0 FIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000683816223 1081618301 /nfs/dbraw/zinc/61/83/01/1081618301.db2.gz NBZSUICJKYXKQM-WPYKKVEZSA-N 2 0 352.522 4.264 20 0 FIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000580226551 1081764666 /nfs/dbraw/zinc/76/46/66/1081764666.db2.gz JLYXNLJFMKAMHM-XXBNENTESA-N 2 0 367.537 4.228 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683927562 1081929563 /nfs/dbraw/zinc/92/95/63/1081929563.db2.gz LICOIAZUJVGAQI-UHFFFAOYSA-N 2 0 351.494 4.178 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(Br)cn2)CC1 ZINC000580685433 1082082575 /nfs/dbraw/zinc/08/25/75/1082082575.db2.gz FIBWENCYNWFMSV-HNNXBMFYSA-N 2 0 368.363 4.253 20 0 FIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000471611344 1082093063 /nfs/dbraw/zinc/09/30/63/1082093063.db2.gz PPQLEUZMJRRHCA-FDFHNCONSA-N 2 0 356.554 4.038 20 0 FIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000312974723 1082108853 /nfs/dbraw/zinc/10/88/53/1082108853.db2.gz KSVRTPXZODJCHA-NPPFBWRTSA-N 2 0 365.521 4.206 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000510354045 1082157548 /nfs/dbraw/zinc/15/75/48/1082157548.db2.gz JRYXASJNAGSSOM-XDJHFCHBSA-N 2 0 356.554 4.481 20 0 FIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000580909616 1082217300 /nfs/dbraw/zinc/21/73/00/1082217300.db2.gz ASSGVENGGZELMO-KNQAVFIVSA-N 2 0 355.570 4.209 20 0 FIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000580909617 1082218153 /nfs/dbraw/zinc/21/81/53/1082218153.db2.gz ASSGVENGGZELMO-SIKLNZKXSA-N 2 0 355.570 4.209 20 0 FIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)cc1 ZINC000684110869 1082225054 /nfs/dbraw/zinc/22/50/54/1082225054.db2.gz CNLRJYDQDBOHQK-UHFFFAOYSA-N 2 0 368.452 4.316 20 0 FIADRP CC[NH2+]CC1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000430574703 1082505533 /nfs/dbraw/zinc/50/55/33/1082505533.db2.gz ORAWWLXNFVEBHY-UHFFFAOYSA-N 2 0 352.522 4.114 20 0 FIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc([C@H](C)[NH3+])cc1)c1ccccc1Cl ZINC000581544904 1082652967 /nfs/dbraw/zinc/65/29/67/1082652967.db2.gz KGQGYDMSHKJKPM-MGPUTAFESA-N 2 0 373.928 4.173 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)c(Cl)c1 ZINC000656683963 1082717663 /nfs/dbraw/zinc/71/76/63/1082717663.db2.gz QUZCTRLDRFIZOP-HNNXBMFYSA-N 2 0 361.892 4.437 20 0 FIADRP CCC[NH+]1CCC([NH2+]Cc2cc(C)c(OCc3ccccn3)c(C)c2)CC1 ZINC000075734262 1082722580 /nfs/dbraw/zinc/72/25/80/1082722580.db2.gz INANNMUMHDDTBC-UHFFFAOYSA-N 2 0 367.537 4.241 20 0 FIADRP Cc1ncc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)s1 ZINC000090401644 1082765566 /nfs/dbraw/zinc/76/55/66/1082765566.db2.gz UXJXBVNWALDMND-SFHVURJKSA-N 2 0 372.582 4.013 20 0 FIADRP Fc1ccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)cc1 ZINC000656784356 1082768290 /nfs/dbraw/zinc/76/82/90/1082768290.db2.gz CPTFGGAWLLLILN-KRWDZBQOSA-N 2 0 359.514 4.161 20 0 FIADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000684394903 1082828499 /nfs/dbraw/zinc/82/84/99/1082828499.db2.gz OAHLTNVATQNGQA-TZRRMPRUSA-N 2 0 363.549 4.213 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cnc(C)s3)CC2)cc1 ZINC000090406345 1082909220 /nfs/dbraw/zinc/90/92/20/1082909220.db2.gz GMHXBMGVMLWHDL-OAHLLOKOSA-N 2 0 359.539 4.023 20 0 FIADRP CCC[NH+]1CCC(N(C)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000510467053 1082915851 /nfs/dbraw/zinc/91/58/51/1082915851.db2.gz FYMOTNGCGNHXHH-UHFFFAOYSA-N 2 0 374.960 4.449 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCc3ccc(O)cc32)CC1 ZINC000658237983 1083368053 /nfs/dbraw/zinc/36/80/53/1083368053.db2.gz ONLXLQWAILZHGE-XPJNUEMQSA-N 2 0 350.506 4.412 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2-n2ccnc2)cc1)C1CC1 ZINC000510900910 1083369890 /nfs/dbraw/zinc/36/98/90/1083369890.db2.gz UESUYBXYKNVUAS-UHFFFAOYSA-N 2 0 360.461 4.109 20 0 FIADRP Cc1ncc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)s1 ZINC000658319517 1083405627 /nfs/dbraw/zinc/40/56/27/1083405627.db2.gz DSRAMHYCPDJCHQ-VQIMIIECSA-N 2 0 355.551 4.404 20 0 FIADRP C[C@@H](O)[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000658358937 1083429535 /nfs/dbraw/zinc/42/95/35/1083429535.db2.gz BBEDRGGYTHCJFC-AULURCSPSA-N 2 0 352.522 4.141 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1 ZINC000092561386 1083438770 /nfs/dbraw/zinc/43/87/70/1083438770.db2.gz BZRYKOGFUJCBJK-LMDPOFIKSA-N 2 0 352.563 4.131 20 0 FIADRP C[C@@H]([NH2+]CCc1ccc2ccccc2n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483248 1083459228 /nfs/dbraw/zinc/45/92/28/1083459228.db2.gz LDZMCXSEAWMRSX-KNQAVFIVSA-N 2 0 359.517 4.278 20 0 FIADRP CCC(=O)Nc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000548483511 1083467924 /nfs/dbraw/zinc/46/79/24/1083467924.db2.gz ATFUGWZMQXYKNF-WIYYLYMNSA-N 2 0 365.521 4.035 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(-c2ccccc2F)s1 ZINC000535809887 1083697486 /nfs/dbraw/zinc/69/74/86/1083697486.db2.gz OCLLZWBGWZWIFE-UIAACRFSSA-N 2 0 374.525 4.238 20 0 FIADRP Cc1cc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)ccc1C[NH+](C)C ZINC000458288068 1083804505 /nfs/dbraw/zinc/80/45/05/1083804505.db2.gz PVKDAOQXCWMAJE-UHFFFAOYSA-N 2 0 365.477 4.117 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCOc2c(F)cccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000181323629 1083865889 /nfs/dbraw/zinc/86/58/89/1083865889.db2.gz QPOXMXQRYIWFIJ-HRAATJIYSA-N 2 0 372.484 4.331 20 0 FIADRP c1ccc(C2([NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)CCC2)cc1 ZINC000236653311 1083890215 /nfs/dbraw/zinc/89/02/15/1083890215.db2.gz WDZIGHCXNRYLMF-UHFFFAOYSA-N 2 0 350.506 4.330 20 0 FIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511020375 1084205875 /nfs/dbraw/zinc/20/58/75/1084205875.db2.gz XOBAAASKWNGHEQ-IEBWSBKVSA-N 2 0 358.476 4.398 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N(CC(C)C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000511029338 1084256714 /nfs/dbraw/zinc/25/67/14/1084256714.db2.gz LZUVTIMSRMGELD-UHFFFAOYSA-N 2 0 373.585 4.109 20 0 FIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)C1 ZINC000472509440 1084369616 /nfs/dbraw/zinc/36/96/16/1084369616.db2.gz XSQWIOCWLQUXQQ-QGZVFWFLSA-N 2 0 370.459 4.138 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2c(C3CC3)cnn2C)C1 ZINC000657312879 1084449180 /nfs/dbraw/zinc/44/91/80/1084449180.db2.gz OXLAUKROGBKWER-QZTJIDSGSA-N 2 0 366.553 4.065 20 0 FIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000613274011 1084533204 /nfs/dbraw/zinc/53/32/04/1084533204.db2.gz SOSCXDCFJNSSNL-FQEVSTJZSA-N 2 0 356.510 4.332 20 0 FIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cnn1-c1cc(C)ccc1C ZINC000414180141 1084755629 /nfs/dbraw/zinc/75/56/29/1084755629.db2.gz KYZJFOSZZODMQV-QGZVFWFLSA-N 2 0 359.477 4.296 20 0 FIADRP COCc1csc(C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000657400356 1084908274 /nfs/dbraw/zinc/90/82/74/1084908274.db2.gz XASVASYQMOWOKW-IRXDYDNUSA-N 2 0 358.551 4.141 20 0 FIADRP CCC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000414295678 1084986967 /nfs/dbraw/zinc/98/69/67/1084986967.db2.gz DLXGSGCGXCTKIR-HXUWFJFHSA-N 2 0 358.551 4.206 20 0 FIADRP O[C@H](C[C@H]1CCCCC[N@@H+]1CCC[NH+]1CCCCC1)c1cccs1 ZINC000161401238 1085002397 /nfs/dbraw/zinc/00/23/97/1085002397.db2.gz KUFUJPWLNSLKDW-RTBURBONSA-N 2 0 350.572 4.292 20 0 FIADRP CSc1ccccc1[C@H](C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414306239 1085006904 /nfs/dbraw/zinc/00/69/04/1085006904.db2.gz NYDFGBOBIILWTO-SFHVURJKSA-N 2 0 370.562 4.086 20 0 FIADRP CSc1ccccc1[C@@H](C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414306236 1085007696 /nfs/dbraw/zinc/00/76/96/1085007696.db2.gz NYDFGBOBIILWTO-GOSISDBHSA-N 2 0 370.562 4.086 20 0 FIADRP Cc1nc(C)c(C[N@@H+]2CCC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)[nH]1 ZINC001167575954 1085025184 /nfs/dbraw/zinc/02/51/84/1085025184.db2.gz JUTXRFHGKDUPET-AWEZNQCLSA-N 2 0 354.281 4.377 20 0 FIADRP COCC[C@H](Cc1ccco1)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000582486513 1085063089 /nfs/dbraw/zinc/06/30/89/1085063089.db2.gz MMTBVBQFADEVRA-NHCUHLMSSA-N 2 0 368.521 4.014 20 0 FIADRP C[C@@H](C[NH2+]Cc1ccnn1-c1cc[nH+]cc1)c1ccc(C(F)(F)F)cc1 ZINC000657447796 1085082359 /nfs/dbraw/zinc/08/23/59/1085082359.db2.gz SJJSFLVBGZCBCV-AWEZNQCLSA-N 2 0 360.383 4.179 20 0 FIADRP COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000511146764 1085088395 /nfs/dbraw/zinc/08/83/95/1085088395.db2.gz QKQYNTOZEJQBBE-BOPFTXTBSA-N 2 0 356.485 4.227 20 0 FIADRP FC1(c2cccc(Cl)c2)CC([NH2+]Cc2ccnn2-c2cc[nH+]cc2)C1 ZINC000657453908 1085107834 /nfs/dbraw/zinc/10/78/34/1085107834.db2.gz ISHBCQAOXFDODB-UHFFFAOYSA-N 2 0 356.832 4.038 20 0 FIADRP CC[NH+](CC)CCOC1CCN(c2c(C)c(C)[nH+]c3ccccc32)CC1 ZINC000544142933 1085136070 /nfs/dbraw/zinc/13/60/70/1085136070.db2.gz DQTACCQUAIEYBU-UHFFFAOYSA-N 2 0 355.526 4.179 20 0 FIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)C2)cc1 ZINC000684928074 1085195227 /nfs/dbraw/zinc/19/52/27/1085195227.db2.gz YQVCYVVFHVGJSS-BXXSPATCSA-N 2 0 356.554 4.084 20 0 FIADRP C[NH+]1CCN(C(C)(C)C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000684953845 1085302239 /nfs/dbraw/zinc/30/22/39/1085302239.db2.gz NTROCDDOCOGALQ-HXUWFJFHSA-N 2 0 363.977 4.187 20 0 FIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)C1 ZINC001167601286 1085412380 /nfs/dbraw/zinc/41/23/80/1085412380.db2.gz APJGDNIVZNYRME-GOSISDBHSA-N 2 0 368.949 4.060 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C[C@H](c2ccccc2)C1 ZINC000657537415 1085452991 /nfs/dbraw/zinc/45/29/91/1085452991.db2.gz KBVYEOBKIXWBTJ-WWPVKYPJSA-N 2 0 370.581 4.439 20 0 FIADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000657537414 1085453402 /nfs/dbraw/zinc/45/34/02/1085453402.db2.gz KBVYEOBKIXWBTJ-VJBMBRPKSA-N 2 0 370.581 4.439 20 0 FIADRP Clc1scc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c1Cl ZINC000657537797 1085460683 /nfs/dbraw/zinc/46/06/83/1085460683.db2.gz SWJBOTXSJTVGOV-UHFFFAOYSA-N 2 0 363.354 4.036 20 0 FIADRP CC(C)COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000657613126 1085691484 /nfs/dbraw/zinc/69/14/84/1085691484.db2.gz WHWDHKVUXFHXNP-UHFFFAOYSA-N 2 0 367.537 4.118 20 0 FIADRP C[C@H](CCc1ccccc1)C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613934 1085699446 /nfs/dbraw/zinc/69/94/46/1085699446.db2.gz XPHKIHVQWMDPLI-HXUWFJFHSA-N 2 0 351.538 4.152 20 0 FIADRP Cc1nc2ccccc2nc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000048562153 1085900343 /nfs/dbraw/zinc/90/03/43/1085900343.db2.gz XOXCICCKGDONKQ-UHFFFAOYSA-N 2 0 352.526 4.026 20 0 FIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000652351491 1085937295 /nfs/dbraw/zinc/93/72/95/1085937295.db2.gz ABSRUFKJRPBAIS-NYDSKATKSA-N 2 0 363.505 4.061 20 0 FIADRP O=C(CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)Nc1ccc(Cl)cc1 ZINC000582960075 1085966890 /nfs/dbraw/zinc/96/68/90/1085966890.db2.gz YSNRBQUFTXRPGW-UHFFFAOYSA-N 2 0 363.933 4.055 20 0 FIADRP COCc1ccccc1/C=C(\C)C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000511952633 1086046657 /nfs/dbraw/zinc/04/66/57/1086046657.db2.gz AEGIGPRAEGYFEG-XDJHFCHBSA-N 2 0 365.521 4.138 20 0 FIADRP Brc1ccc2oc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cc2c1 ZINC000583096041 1086184580 /nfs/dbraw/zinc/18/45/80/1086184580.db2.gz ZMSNITKJBNMFNH-UHFFFAOYSA-N 2 0 363.299 4.159 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000583135294 1086258350 /nfs/dbraw/zinc/25/83/50/1086258350.db2.gz VMRCMQRPRCZVJV-HNNXBMFYSA-N 2 0 360.448 4.289 20 0 FIADRP Fc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662282624 1086392817 /nfs/dbraw/zinc/39/28/17/1086392817.db2.gz PEBHHQGISLTZLK-SFHVURJKSA-N 2 0 352.375 4.255 20 0 FIADRP Clc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)co2)cc1 ZINC000662290456 1086396981 /nfs/dbraw/zinc/39/69/81/1086396981.db2.gz DBGRIMQQCHFZMX-QGZVFWFLSA-N 2 0 359.901 4.207 20 0 FIADRP Clc1ccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)co2)cc1 ZINC000662290454 1086398128 /nfs/dbraw/zinc/39/81/28/1086398128.db2.gz DBGRIMQQCHFZMX-KRWDZBQOSA-N 2 0 359.901 4.207 20 0 FIADRP C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293727 1086398752 /nfs/dbraw/zinc/39/87/52/1086398752.db2.gz MMNVSZOITBJOGU-GOEBONIOSA-N 2 0 362.468 4.204 20 0 FIADRP c1ccc(Oc2cccnc2)c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000662294204 1086399005 /nfs/dbraw/zinc/39/90/05/1086399005.db2.gz PUFJFIKFTAKLEA-IBGZPJMESA-N 2 0 351.494 4.086 20 0 FIADRP C[C@@H]1CCC[N@H+](CCC(=O)Nc2c(Cl)cccc2Cl)[C@@H]1CCC[NH3+] ZINC000662317017 1086411977 /nfs/dbraw/zinc/41/19/77/1086411977.db2.gz ZFNNNGZYHDUGOD-CZUORRHYSA-N 2 0 372.340 4.161 20 0 FIADRP C[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2-c2ccccc2)[C@@H]1CCC[NH3+] ZINC000662313501 1086412792 /nfs/dbraw/zinc/41/27/92/1086412792.db2.gz SREZGIDZTZHYJC-XMSQKQJNSA-N 2 0 365.521 4.132 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(OCc3cccnc3)cc2)[C@@H]1CCC[NH3+] ZINC000662313953 1086413470 /nfs/dbraw/zinc/41/34/70/1086413470.db2.gz AGOWDHRTSGKEJF-XMSQKQJNSA-N 2 0 353.510 4.000 20 0 FIADRP CC1CC[NH+](Cc2ccc(NC(=O)C[C@@H]3[NH2+]Cc4ccccc43)cc2)CC1 ZINC000662387513 1086429265 /nfs/dbraw/zinc/42/92/65/1086429265.db2.gz GXSXGLYROWQQRG-QFIPXVFZSA-N 2 0 363.505 4.092 20 0 FIADRP Cc1ccc(-c2nc(CNC[C@@H]3CCC[N@H+](CC4CC4)C3)cs2)cc1 ZINC000663345529 1086446488 /nfs/dbraw/zinc/44/64/88/1086446488.db2.gz KJAAZBAITNFWIR-SFHVURJKSA-N 2 0 355.551 4.330 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Br)s1 ZINC000663346894 1086447485 /nfs/dbraw/zinc/44/74/85/1086447485.db2.gz WTAVIWDJWHUEBS-OCCSQVGLSA-N 2 0 357.361 4.283 20 0 FIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCSc2ccc(Br)cc21 ZINC000663438129 1086541329 /nfs/dbraw/zinc/54/13/29/1086541329.db2.gz FHCUGQBYYCIOCD-OAHLLOKOSA-N 2 0 357.361 4.308 20 0 FIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCSc3ccc(Br)cc32)CC1 ZINC000663443862 1086545880 /nfs/dbraw/zinc/54/58/80/1086545880.db2.gz RYYYSZYGJOUWHC-INIZCTEOSA-N 2 0 367.356 4.228 20 0 FIADRP C[C@@H](C[NH2+]C1CCN([C@@H]2CCOC2)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000657751327 1086561121 /nfs/dbraw/zinc/56/11/21/1086561121.db2.gz QBQHXJGERFKSMZ-XMSQKQJNSA-N 2 0 358.570 4.006 20 0 FIADRP Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000663466734 1086568808 /nfs/dbraw/zinc/56/88/08/1086568808.db2.gz XHSBAJAZPWSXRM-JQVVWYNYSA-N 2 0 360.517 4.005 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)ccc1OC(F)F ZINC000663467000 1086568910 /nfs/dbraw/zinc/56/89/10/1086568910.db2.gz CIXFMAVQVREVOC-GOEBONIOSA-N 2 0 368.468 4.069 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCc2ncnc(-c3ccsc3)c2CC1 ZINC001167821037 1086582349 /nfs/dbraw/zinc/58/23/49/1086582349.db2.gz AAOLVCJPTRGHCW-QGZVFWFLSA-N 2 0 372.582 4.116 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@H]2CCC[C@@]2(COc2ccccn2)C1 ZINC001167825025 1086611032 /nfs/dbraw/zinc/61/10/32/1086611032.db2.gz PSWNAARNUISHOH-VWPQPMDRSA-N 2 0 359.558 4.073 20 0 FIADRP c1ccc(CN2CC[C@@H]([NH2+]CCCCC[NH+]3CCCC3)CC23CC3)cc1 ZINC000583380788 1086627184 /nfs/dbraw/zinc/62/71/84/1086627184.db2.gz DYEBUZCRHCBQHH-JOCHJYFZSA-N 2 0 355.570 4.039 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001167833374 1086664905 /nfs/dbraw/zinc/66/49/05/1086664905.db2.gz AMOSSNKZFOOGFR-OALUTQOASA-N 2 0 369.594 4.218 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@@H]2C[C@H](C1)c1cc3nccnc3cc12 ZINC001167837520 1086711492 /nfs/dbraw/zinc/71/14/92/1086711492.db2.gz MBEOKWYYPPCVEM-OKZBNKHCSA-N 2 0 352.526 4.027 20 0 FIADRP CSC1(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)CC[NH+](C)CC1 ZINC000569630504 1086725250 /nfs/dbraw/zinc/72/52/50/1086725250.db2.gz YGSVUWVUIDXSHQ-FUHWJXTLSA-N 2 0 352.975 4.393 20 0 FIADRP COc1ccccc1[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)C1CCCC1 ZINC000432407066 1086728615 /nfs/dbraw/zinc/72/86/15/1086728615.db2.gz JYTXBMDEGLXHNT-GCJKJVERSA-N 2 0 360.542 4.017 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001167841367 1086734931 /nfs/dbraw/zinc/73/49/31/1086734931.db2.gz LMOCSOPUWNDZIS-ISKFKSNPSA-N 3 0 371.613 4.485 20 0 FIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 ZINC001167841615 1086737790 /nfs/dbraw/zinc/73/77/90/1086737790.db2.gz NDJQVMKAMNNORW-NQIIRXRSSA-N 2 0 369.594 4.218 20 0 FIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000432418034 1086744166 /nfs/dbraw/zinc/74/41/66/1086744166.db2.gz YCRXEVQBDMFSSX-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000650706805 1086759820 /nfs/dbraw/zinc/75/98/20/1086759820.db2.gz SOWKFFSQKQLNQZ-RZQQEMMASA-N 2 0 374.525 4.273 20 0 FIADRP CCC1(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CCOCC1 ZINC000657771794 1086819286 /nfs/dbraw/zinc/81/92/86/1086819286.db2.gz GHBSADMVUYWFMB-NRFANRHFSA-N 2 0 356.554 4.085 20 0 FIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2cccc(Oc3ccccc3)c2)C1 ZINC000650722082 1086828018 /nfs/dbraw/zinc/82/80/18/1086828018.db2.gz KJIWZUBCGMBAHX-OIBXWCBGSA-N 2 0 366.505 4.340 20 0 FIADRP C[C@H](CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[C@H]1CCC[NH2+]C1 ZINC000246176529 1086903219 /nfs/dbraw/zinc/90/32/19/1086903219.db2.gz BQXVMTLWLBTFLN-HBFSDRIKSA-N 2 0 357.542 4.025 20 0 FIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000650757039 1086969598 /nfs/dbraw/zinc/96/95/98/1086969598.db2.gz NNBHWRSFMBMWIN-JOCHJYFZSA-N 2 0 350.506 4.288 20 0 FIADRP FC(F)(F)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCSCC1 ZINC001279642109 1087060010 /nfs/dbraw/zinc/06/00/10/1087060010.db2.gz FLQZTSLVAZKTGP-MQVJKMGUSA-N 2 0 350.494 4.057 20 0 FIADRP c1cc(Sc2ccccn2)oc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657813567 1087078486 /nfs/dbraw/zinc/07/84/86/1087078486.db2.gz RZCLVDWDKYINML-UHFFFAOYSA-N 2 0 357.523 4.037 20 0 FIADRP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000584077048 1087156660 /nfs/dbraw/zinc/15/66/60/1087156660.db2.gz YGQWPECGPFQRQC-UHFFFAOYSA-N 2 0 367.518 4.040 20 0 FIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)C(C)(C)C(F)F)CC2)c1 ZINC000657829716 1087177868 /nfs/dbraw/zinc/17/78/68/1087177868.db2.gz ZWHGHGWCSBPSPG-GOSISDBHSA-N 2 0 367.528 4.167 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cc1 ZINC000657839681 1087263383 /nfs/dbraw/zinc/26/33/83/1087263383.db2.gz YRRGLILZYPGHLZ-KRWDZBQOSA-N 2 0 367.493 4.399 20 0 FIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000080974190 1087290253 /nfs/dbraw/zinc/29/02/53/1087290253.db2.gz QINWVJWLMPBRCD-OCCSQVGLSA-N 2 0 357.845 4.054 20 0 FIADRP COc1cc(C)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1OC ZINC000083453574 1087340117 /nfs/dbraw/zinc/34/01/17/1087340117.db2.gz AZBRHRWUBVUNDY-UHFFFAOYSA-N 2 0 356.510 4.142 20 0 FIADRP c1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089214754 1087380103 /nfs/dbraw/zinc/38/01/03/1087380103.db2.gz GLZOBDYGTKHJMD-NZQKXSOJSA-N 2 0 365.521 4.056 20 0 FIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000563920252 1087524697 /nfs/dbraw/zinc/52/46/97/1087524697.db2.gz CTOXLEVRJYRQEG-QHCPKHFHSA-N 2 0 352.522 4.441 20 0 FIADRP C[N@H+](Cc1cc(-c2ccccc2)cs1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000685457894 1087573264 /nfs/dbraw/zinc/57/32/64/1087573264.db2.gz RSHSOVGWNIQBJY-NRFANRHFSA-N 2 0 369.578 4.015 20 0 FIADRP COc1ccc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1O ZINC000685649173 1087656557 /nfs/dbraw/zinc/65/65/57/1087656557.db2.gz CCLYFYQHCPYIOO-BZSNNMDCSA-N 2 0 368.521 4.208 20 0 FIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658065610 1087705627 /nfs/dbraw/zinc/70/56/27/1087705627.db2.gz RSWKYMQFHAUVBK-SFHVURJKSA-N 2 0 363.505 4.056 20 0 FIADRP Cc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CCC2)cc1 ZINC000658070451 1087711331 /nfs/dbraw/zinc/71/13/31/1087711331.db2.gz OWRYVNZLGWHQAV-QHCPKHFHSA-N 2 0 356.554 4.317 20 0 FIADRP C[C@@H]([NH2+]CCc1ccnc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658128242 1087734114 /nfs/dbraw/zinc/73/41/14/1087734114.db2.gz CCHFXPMRKMXOGU-DENIHFKCSA-N 2 0 359.517 4.278 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000658137318 1087741185 /nfs/dbraw/zinc/74/11/85/1087741185.db2.gz GLFMTADMPPNYJJ-IAGOWNOFSA-N 2 0 364.942 4.209 20 0 FIADRP O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+][C@H](CC3CCC3)c3ccccc3)cc2)C1 ZINC000658136277 1087741988 /nfs/dbraw/zinc/74/19/88/1087741988.db2.gz GMMGYRRLRAIDNE-DNQXCXABSA-N 2 0 364.533 4.274 20 0 FIADRP CC(C)CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccoc1 ZINC000658139241 1087744893 /nfs/dbraw/zinc/74/48/93/1087744893.db2.gz PMVQZBZRJBYDES-FCHUYYIVSA-N 2 0 356.510 4.113 20 0 FIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)c(F)c1 ZINC000658166286 1087762530 /nfs/dbraw/zinc/76/25/30/1087762530.db2.gz NNSRPLMGCAKZNV-HNNXBMFYSA-N 2 0 361.892 4.437 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168882 1087765250 /nfs/dbraw/zinc/76/52/50/1087765250.db2.gz ZWFAEHZMUMCAGT-QGZVFWFLSA-N 2 0 355.551 4.366 20 0 FIADRP Cc1cc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)nc(-c2ccc(Cl)cc2)n1 ZINC000424289553 1087897888 /nfs/dbraw/zinc/89/78/88/1087897888.db2.gz LZARORJERRGFRV-INIZCTEOSA-N 2 0 370.928 4.069 20 0 FIADRP CCC1(C[NH2+][C@@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)CC[NH+](Cc2ccccc2)CC1 ZINC000424274774 1087908613 /nfs/dbraw/zinc/90/86/13/1087908613.db2.gz ABFOAPYPWXZECU-MESAYYPLSA-N 2 0 370.581 4.472 20 0 FIADRP COc1ccccc1-c1cc(C[NH2+][C@H](C)c2ccc(-n3ccnc3)cc2)on1 ZINC000685933034 1088232757 /nfs/dbraw/zinc/23/27/57/1088232757.db2.gz LIZRAYPSWDURIW-MRXNPFEDSA-N 2 0 374.444 4.387 20 0 FIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(Br)c(Cl)c2)cc1 ZINC000414819631 1088274802 /nfs/dbraw/zinc/27/48/02/1088274802.db2.gz ZDUAKJLAMLYRIS-NSHDSACASA-N 2 0 353.691 4.412 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C[C@@H]2[NH2+]Cc3ccccc32)cc1 ZINC000659285867 1088416779 /nfs/dbraw/zinc/41/67/79/1088416779.db2.gz SMEXWIPTMJZDDG-JTSKRJEESA-N 2 0 363.505 4.234 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)C1(c2ccccc2)CCCC1 ZINC000472625954 1088490613 /nfs/dbraw/zinc/49/06/13/1088490613.db2.gz ZNGCWUCDRKFJBG-VJBMBRPKSA-N 2 0 370.581 4.244 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)C1(c2ccccc2)CCCC1 ZINC000472625952 1088491168 /nfs/dbraw/zinc/49/11/68/1088491168.db2.gz ZNGCWUCDRKFJBG-AJSBUHFISA-N 2 0 370.581 4.244 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1OC ZINC000514083023 1088722159 /nfs/dbraw/zinc/72/21/59/1088722159.db2.gz JGBRYRQPZJAQGD-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP COc1cccc(COc2cccc(Cl)c2C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000415015615 1089043105 /nfs/dbraw/zinc/04/31/05/1089043105.db2.gz AYNUOFLKBHJHSW-HNNXBMFYSA-N 2 0 362.901 4.145 20 0 FIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)o1 ZINC000415014065 1089050304 /nfs/dbraw/zinc/05/03/04/1089050304.db2.gz ZGFIYVSQRNJVOW-IEBWSBKVSA-N 2 0 364.493 4.048 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)ccc1OCc1ccc(Cl)cc1 ZINC000415041011 1089079389 /nfs/dbraw/zinc/07/93/89/1089079389.db2.gz PJFARCVDZAIBQX-QFBILLFUSA-N 2 0 374.912 4.145 20 0 FIADRP Cc1cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)ccc1Oc1cccnc1 ZINC000415055566 1089102351 /nfs/dbraw/zinc/10/23/51/1089102351.db2.gz RGEATKAOHIKKAO-FPOVZHCZSA-N 2 0 351.494 4.146 20 0 FIADRP CC(C)(C)n1cc(C[NH2+]CCC[NH2+]C2CC2)c(-c2ccccc2Cl)n1 ZINC000415064084 1089104795 /nfs/dbraw/zinc/10/47/95/1089104795.db2.gz BQDCKLKYODCPIO-UHFFFAOYSA-N 2 0 360.933 4.190 20 0 FIADRP c1ccc(COCc2ccccc2C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000415077273 1089126947 /nfs/dbraw/zinc/12/69/47/1089126947.db2.gz HETNQUDPYMGCFU-RBZQAINGSA-N 2 0 364.533 4.414 20 0 FIADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)Sc1ccc(Br)cc1 ZINC000415081854 1089138193 /nfs/dbraw/zinc/13/81/93/1089138193.db2.gz CKWJEVLRWSZWDP-OPFPJEHXSA-N 2 0 357.361 4.037 20 0 FIADRP c1ccc(COCc2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)c2)cc1 ZINC000415085988 1089146304 /nfs/dbraw/zinc/14/63/04/1089146304.db2.gz UBOZNGKRWBTMJD-TZRRMPRUSA-N 2 0 364.533 4.414 20 0 FIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1)[C@@H]1CCC[NH2+]C1 ZINC000414859982 1089148233 /nfs/dbraw/zinc/14/82/33/1089148233.db2.gz VBAIIFGSVFMYQT-CRAIPNDOSA-N 2 0 371.912 4.070 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1)[C@H]1CCC[NH2+]C1 ZINC000414859992 1089148524 /nfs/dbraw/zinc/14/85/24/1089148524.db2.gz VBAIIFGSVFMYQT-YJBOKZPZSA-N 2 0 371.912 4.070 20 0 FIADRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000415101392 1089161735 /nfs/dbraw/zinc/16/17/35/1089161735.db2.gz BITOOXXZUMJLIO-FPOVZHCZSA-N 2 0 374.525 4.273 20 0 FIADRP FC(F)(F)c1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000415103718 1089163826 /nfs/dbraw/zinc/16/38/26/1089163826.db2.gz JUNVTFOTYOVRMH-OKZBNKHCSA-N 2 0 352.444 4.247 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414861220 1089167257 /nfs/dbraw/zinc/16/72/57/1089167257.db2.gz RNUDYNRLFAZWJN-OAHLLOKOSA-N 2 0 351.922 4.007 20 0 FIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)C1 ZINC000415126536 1089178467 /nfs/dbraw/zinc/17/84/67/1089178467.db2.gz PMOUUAQJSGVSKE-OXJNMPFZSA-N 2 0 374.525 4.273 20 0 FIADRP COc1ccccc1CCC[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000505588260 1089191119 /nfs/dbraw/zinc/19/11/19/1089191119.db2.gz RJZMSCGMORUPJS-UHFFFAOYSA-N 2 0 367.537 4.261 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000435125088 1089304949 /nfs/dbraw/zinc/30/49/49/1089304949.db2.gz UVPKUSSOUXDQHK-KRWDZBQOSA-N 2 0 356.514 4.146 20 0 FIADRP CO[C@H](C)[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549237095 1089317718 /nfs/dbraw/zinc/31/77/18/1089317718.db2.gz JTVCHWFGUAHTKX-KAYQNVEMSA-N 2 0 350.934 4.267 20 0 FIADRP CCC(CC)(CNC(=O)c1ccc([C@@H](C)[NH3+])cc1)[NH2+][C@H](C)c1ccccc1 ZINC000514789611 1089469911 /nfs/dbraw/zinc/46/99/11/1089469911.db2.gz MFZXAZBQILXFFG-QZTJIDSGSA-N 2 0 367.537 4.346 20 0 FIADRP c1ccc(CN(Cc2cccc(-c3ccccn3)c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000435389299 1089594493 /nfs/dbraw/zinc/59/44/93/1089594493.db2.gz JVKXZQTXYRKVIQ-HSZRJFAPSA-N 2 0 372.516 4.288 20 0 FIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C(C)(C)[NH+]2CCCCC2)cc1 ZINC001625891499 1089768803 /nfs/dbraw/zinc/76/88/03/1089768803.db2.gz KMCYONFIJLDWLX-GOSISDBHSA-N 2 0 357.542 4.264 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(-c3ccccn3)nc2)CC1 ZINC000425407814 1089918399 /nfs/dbraw/zinc/91/83/99/1089918399.db2.gz QLJUXPPGPGPJGY-UHFFFAOYSA-N 2 0 352.526 4.088 20 0 FIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]CCCNCc1cccnc1 ZINC000414874582 1089979791 /nfs/dbraw/zinc/97/97/91/1089979791.db2.gz IGMYKJPQJGZUEQ-CQSZACIVSA-N 2 0 352.309 4.089 20 0 FIADRP CC[N@H+](CCCc1cnccc1C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000584806910 1090908600 /nfs/dbraw/zinc/90/86/00/1090908600.db2.gz RUDMXCHYNPJDDW-QFIPXVFZSA-N 2 0 351.538 4.167 20 0 FIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000500416084 1091469884 /nfs/dbraw/zinc/46/98/84/1091469884.db2.gz MWFMNIRGWZBYHN-MAUBAPBLSA-N 2 0 370.459 4.199 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000512312338 1092031714 /nfs/dbraw/zinc/03/17/14/1092031714.db2.gz CYTYUBXJWBYOPY-BQFCYCMXSA-N 2 0 369.553 4.220 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)c(OC)c1 ZINC000512314227 1092031858 /nfs/dbraw/zinc/03/18/58/1092031858.db2.gz NNOLVQRNNWGTJD-KPFFTGBYSA-N 2 0 360.542 4.398 20 0 FIADRP CC1CC[NH+](CCCN[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168011799 1092229013 /nfs/dbraw/zinc/22/90/13/1092229013.db2.gz SOLNAINOZJSUCL-IUTQVRIDSA-N 2 0 357.586 4.140 20 0 FIADRP COc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)ccc1OCc1ccccc1 ZINC000093089196 1092246606 /nfs/dbraw/zinc/24/66/06/1092246606.db2.gz IPLROHJSOVGGIZ-UHFFFAOYSA-N 2 0 368.521 4.048 20 0 FIADRP CCC[NH+]1CCC(N[C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428233112 1092273457 /nfs/dbraw/zinc/27/34/57/1092273457.db2.gz XUCPJZLBVDKYIN-QPTUXGOLSA-N 2 0 369.597 4.141 20 0 FIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-n3ccnc3)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011986 1092313843 /nfs/dbraw/zinc/31/38/43/1092313843.db2.gz USULPXHOVNEIBZ-JHDGKUDLSA-N 2 0 374.532 4.404 20 0 FIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442788576 1092768193 /nfs/dbraw/zinc/76/81/93/1092768193.db2.gz CMMPWZSMFOKCOZ-BHIYHBOVSA-N 2 0 372.475 4.288 20 0 FIADRP COCCC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000442797922 1092771795 /nfs/dbraw/zinc/77/17/95/1092771795.db2.gz XJFBYITZPOCAJC-JOCHJYFZSA-N 2 0 371.500 4.195 20 0 FIADRP C[N@@H+]1CCN(CC[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC1(C)C ZINC000442872950 1092820135 /nfs/dbraw/zinc/82/01/35/1092820135.db2.gz OGQYYCMMMGIAPL-HXUWFJFHSA-N 2 0 357.542 4.136 20 0 FIADRP COc1ccc(CC[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168014546 1092844721 /nfs/dbraw/zinc/84/47/21/1092844721.db2.gz LUQXEEUIQWKFOH-HATOLVCRSA-N 2 0 352.522 4.269 20 0 FIADRP COc1ccccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000521816152 1092934947 /nfs/dbraw/zinc/93/49/47/1092934947.db2.gz NCIAPQUSCPCQRW-RTBURBONSA-N 2 0 352.522 4.463 20 0 FIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2c(F)cccc2N2CCCC2)C1 ZINC000521818491 1092935931 /nfs/dbraw/zinc/93/59/31/1092935931.db2.gz UAYOJBDVMQYGBC-OALUTQOASA-N 2 0 361.549 4.274 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC2(c3cc(F)cc(C(F)(F)F)c3)CC2)CC1 ZINC000443102561 1092941983 /nfs/dbraw/zinc/94/19/83/1092941983.db2.gz IDUUXESLYRIYIH-UHFFFAOYSA-N 2 0 358.423 4.340 20 0 FIADRP C[C@@H](c1nc(-c2ccc(C[NH+]3CCCC3)cc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443218588 1092994090 /nfs/dbraw/zinc/99/40/90/1092994090.db2.gz FUEJLIUWRMUSMJ-ZACQAIPSSA-N 2 0 354.498 4.266 20 0 FIADRP CSc1cc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)ccn1 ZINC000512646707 1093067846 /nfs/dbraw/zinc/06/78/46/1093067846.db2.gz CMDHHHLYKSADDA-PWRODBHTSA-N 2 0 367.562 4.194 20 0 FIADRP CSc1cc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)ccn1 ZINC000512646708 1093068559 /nfs/dbraw/zinc/06/85/59/1093068559.db2.gz CMDHHHLYKSADDA-QHAWAJNXSA-N 2 0 367.562 4.194 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000191211480 1093116104 /nfs/dbraw/zinc/11/61/04/1093116104.db2.gz YOLVRZIDISFKOM-OAQYLSRUSA-N 2 0 357.567 4.127 20 0 FIADRP C[C@H](CC[N@@H+]1CCC[C@]2(CCSC2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000451963983 1093161699 /nfs/dbraw/zinc/16/16/99/1093161699.db2.gz IJUJKIBKINCSLS-HSALFYBXSA-N 2 0 368.656 4.203 20 0 FIADRP C[C@H]1CC([NH2+]Cc2ccc(-n3cccn3)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168018024 1093164551 /nfs/dbraw/zinc/16/45/51/1093164551.db2.gz YLYQWKPQAPNLAA-PMACEKPBSA-N 2 0 374.532 4.404 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000474070362 1093179989 /nfs/dbraw/zinc/17/99/89/1093179989.db2.gz AELKPALRAYHLQE-QFIPXVFZSA-N 2 0 368.521 4.148 20 0 FIADRP C[C@H]([NH2+]C1CCN([C@@H](C)c2ccncc2)CC1)C1CCC(F)(F)CC1 ZINC000474073818 1093188372 /nfs/dbraw/zinc/18/83/72/1093188372.db2.gz PKKFIISLUWYLJI-HOTGVXAUSA-N 2 0 351.485 4.411 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)c1cccc(C[NH+]2CCCCC2)c1 ZINC000411438448 1093308844 /nfs/dbraw/zinc/30/88/44/1093308844.db2.gz KINXOBJCCXXAJQ-FQEVSTJZSA-N 2 0 371.569 4.057 20 0 FIADRP COc1ccc(CC[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c(F)c1 ZINC001168024445 1093392350 /nfs/dbraw/zinc/39/23/50/1093392350.db2.gz GQWWVVRELIYIFP-QZTJIDSGSA-N 2 0 370.512 4.408 20 0 FIADRP COc1ccc(CC[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c(F)c1 ZINC001168024447 1093393372 /nfs/dbraw/zinc/39/33/72/1093393372.db2.gz GQWWVVRELIYIFP-ROUUACIJSA-N 2 0 370.512 4.408 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000389141373 1093454504 /nfs/dbraw/zinc/45/45/04/1093454504.db2.gz VHIMAEBOXPJVON-SQGPQFPESA-N 2 0 356.485 4.396 20 0 FIADRP COC1(C(F)(F)F)CC[NH+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000419294816 1093477743 /nfs/dbraw/zinc/47/77/43/1093477743.db2.gz BRDLHUJDBDKKGB-UHFFFAOYSA-N 2 0 370.459 4.216 20 0 FIADRP C[C@H](COc1ccccc1)[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168026948 1093507115 /nfs/dbraw/zinc/50/71/15/1093507115.db2.gz MMIFLQIAURYSOH-VAMGGRTRSA-N 2 0 352.522 4.485 20 0 FIADRP C[C@@H](C[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)CC(C)(C)CC[NH3+] ZINC001168028059 1093529745 /nfs/dbraw/zinc/52/97/45/1093529745.db2.gz ODKYILOMBLEUOK-XWSHUIEDSA-N 3 0 359.602 4.419 20 0 FIADRP CC(C)C[C@H](C[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1)c1ccccc1 ZINC000474280320 1093649979 /nfs/dbraw/zinc/64/99/79/1093649979.db2.gz VJLXOIPTMORFNO-HSZRJFAPSA-N 2 0 371.613 4.307 20 0 FIADRP C[C@@H]1C[C@@H](N[C@H]2CC[NH+](CC(C)(C)C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032288 1093652608 /nfs/dbraw/zinc/65/26/08/1093652608.db2.gz HHHDHVJVLRNGLS-MXNKGDRCSA-N 2 0 357.586 4.138 20 0 FIADRP CCC(CC)[N@@H+]1CC[C@H](NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168033368 1093713834 /nfs/dbraw/zinc/71/38/34/1093713834.db2.gz KRTQPGLOORYSOS-ZJOUEHCJSA-N 2 0 357.586 4.281 20 0 FIADRP COc1cc([C@H](C)NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)ccn1 ZINC001168033866 1093733237 /nfs/dbraw/zinc/73/32/37/1093733237.db2.gz MNTPWXOYTQTWQF-BZSNNMDCSA-N 2 0 353.510 4.182 20 0 FIADRP C[C@H]1CC(N[C@H]2CC[N@H+](CC3CCCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168034084 1093738942 /nfs/dbraw/zinc/73/89/42/1093738942.db2.gz OHFUEWBGNDUZNT-JTAQYXEDSA-N 2 0 369.597 4.282 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2coc(-c3cccc(F)c3)n2)CC1 ZINC000052209139 1093767901 /nfs/dbraw/zinc/76/79/01/1093767901.db2.gz YQCSPOOALBKWTF-UHFFFAOYSA-N 2 0 359.489 4.425 20 0 FIADRP CC[NH+](CC)[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000513078920 1093780787 /nfs/dbraw/zinc/78/07/87/1093780787.db2.gz XNNNSPANOYARGD-KSEOMHKRSA-N 2 0 369.553 4.305 20 0 FIADRP Cc1ccc(CCC[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)cn1 ZINC000474465922 1093812193 /nfs/dbraw/zinc/81/21/93/1093812193.db2.gz ASTULRDXRMZKLA-IBGZPJMESA-N 2 0 351.538 4.344 20 0 FIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000474479510 1093814972 /nfs/dbraw/zinc/81/49/72/1093814972.db2.gz RMNSUAZRLLOYPP-OALUTQOASA-N 2 0 362.558 4.298 20 0 FIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2OC)c1 ZINC000163568035 1093883061 /nfs/dbraw/zinc/88/30/61/1093883061.db2.gz RGXQCMCQBSESLX-KRWDZBQOSA-N 2 0 356.510 4.396 20 0 FIADRP C[N@H+](CC/C=C/c1ccc(Br)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513152691 1093911859 /nfs/dbraw/zinc/91/18/59/1093911859.db2.gz FWZRJXUJHCFINO-LWFHPDCVSA-N 2 0 363.343 4.409 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(F)cc23)CC1 ZINC000513231523 1094014062 /nfs/dbraw/zinc/01/40/62/1094014062.db2.gz DUWYDKRHUQFABQ-ZHRRBRCNSA-N 2 0 357.517 4.482 20 0 FIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(Sc3ccccn3)o2)C1 ZINC000509928036 1094190170 /nfs/dbraw/zinc/19/01/70/1094190170.db2.gz QGFCJRGFOKBPFB-QGZVFWFLSA-N 2 0 359.539 4.428 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000513523829 1094196763 /nfs/dbraw/zinc/19/67/63/1094196763.db2.gz CLJKSDUQFJVJGA-UGKGYDQZSA-N 2 0 352.526 4.005 20 0 FIADRP COC1CCN(C(C)(C)C[NH2+]C/C(C)=C\c2ccc(Cl)cc2)CC1 ZINC000513545372 1094205828 /nfs/dbraw/zinc/20/58/28/1094205828.db2.gz QCZZHTZFTVYWMW-SSZFMOIBSA-N 2 0 350.934 4.222 20 0 FIADRP C[C@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2C(C)(C)C)C[N@@H+]1Cc1ccccc1 ZINC000513544600 1094205859 /nfs/dbraw/zinc/20/58/59/1094205859.db2.gz KGZMOPXIEYPHOE-HKUYNNGSSA-N 2 0 354.542 4.098 20 0 FIADRP COc1ccc(OC)c(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513544616 1094206016 /nfs/dbraw/zinc/20/60/16/1094206016.db2.gz KKUNSNOPXMVSRL-AZUAARDMSA-N 2 0 368.521 4.094 20 0 FIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2cc(C)cc(C[NH+](C)C)c2)cc1 ZINC000513605215 1094234171 /nfs/dbraw/zinc/23/41/71/1094234171.db2.gz OVWUWDHLAJQJSV-UHFFFAOYSA-N 2 0 353.510 4.151 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2cccc(F)c2)C2CCCC2)CC1 ZINC000500989285 1094405516 /nfs/dbraw/zinc/40/55/16/1094405516.db2.gz GAFYBEQELXMISF-QFIPXVFZSA-N 2 0 361.549 4.063 20 0 FIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000474607382 1094410760 /nfs/dbraw/zinc/41/07/60/1094410760.db2.gz YDZGHTWFPBOVDX-MSOLQXFVSA-N 2 0 374.569 4.440 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000501063678 1094474610 /nfs/dbraw/zinc/47/46/10/1094474610.db2.gz KLXLFZAEKUTMLE-FXAWDEMLSA-N 2 0 372.553 4.385 20 0 FIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](F)C(F)(F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041853 1094635097 /nfs/dbraw/zinc/63/50/97/1094635097.db2.gz WMYXXUDTHZCIJV-NBMJBFSESA-N 2 0 354.460 4.497 20 0 FIADRP Fc1ccc(C(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccc(F)cc2)cc1 ZINC000501404009 1094697178 /nfs/dbraw/zinc/69/71/78/1094697178.db2.gz FDRAPBHRRPYMRL-SFTDATJTSA-N 2 0 356.460 4.313 20 0 FIADRP Cc1ccc(CCC[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000474881340 1094843539 /nfs/dbraw/zinc/84/35/39/1094843539.db2.gz VWQQKVARSJIZRM-NFBKMPQASA-N 2 0 351.538 4.213 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C[NH3+])c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000420364463 1094901097 /nfs/dbraw/zinc/90/10/97/1094901097.db2.gz CWRWOYWOUXKRRG-MAUKXSAKSA-N 2 0 364.436 4.080 20 0 FIADRP C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420379814 1094906014 /nfs/dbraw/zinc/90/60/14/1094906014.db2.gz NPRJBIZRWRHIIU-PJSAGSTRSA-N 2 0 357.325 4.273 20 0 FIADRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000420382945 1094907016 /nfs/dbraw/zinc/90/70/16/1094907016.db2.gz PZSGATSBQDECBN-HNAYVOBHSA-N 2 0 364.942 4.273 20 0 FIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3sc4ccccc4c3Cl)CC2)C1 ZINC000420398942 1094913219 /nfs/dbraw/zinc/91/32/19/1094913219.db2.gz ZMAFOMFOVCKPLC-ZBFHGGJFSA-N 2 0 364.942 4.273 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC000501902123 1094995433 /nfs/dbraw/zinc/99/54/33/1094995433.db2.gz WPTPNJSLDPDFJU-OAQYLSRUSA-N 2 0 363.977 4.283 20 0 FIADRP CC[NH2+]Cc1ccccc1NC(=O)c1ccc(C[N@H+](CC)C2CC2)cc1 ZINC000428305912 1095009136 /nfs/dbraw/zinc/00/91/36/1095009136.db2.gz MZRQYDGJEZXDOQ-UHFFFAOYSA-N 2 0 351.494 4.033 20 0 FIADRP CCCc1cc(N2CCC(OCCC[NH+](C)C)CC2)c2ccccc2[nH+]1 ZINC000443886581 1095163752 /nfs/dbraw/zinc/16/37/52/1095163752.db2.gz DBLLPEJYTHIEFS-UHFFFAOYSA-N 2 0 355.526 4.124 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCC23CCOCC3)C1 ZINC000502279873 1095299032 /nfs/dbraw/zinc/29/90/32/1095299032.db2.gz FRMJMRAICJBJIV-KNQAVFIVSA-N 2 0 356.554 4.357 20 0 FIADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000502282586 1095305193 /nfs/dbraw/zinc/30/51/93/1095305193.db2.gz CNZMJUAVTKXRBA-MZYLBHOOSA-N 2 0 356.554 4.226 20 0 FIADRP CC(C)Oc1ccccc1C[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000502328212 1095384219 /nfs/dbraw/zinc/38/42/19/1095384219.db2.gz UTBQPRQLGCMTTN-LJQANCHMSA-N 2 0 353.510 4.386 20 0 FIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCCC23CCOCC3)C[N@@H+]1Cc1ccccc1 ZINC000502411456 1095436238 /nfs/dbraw/zinc/43/62/38/1095436238.db2.gz ARZRCCFKBGUYFD-CEMLEFRQSA-N 2 0 356.554 4.226 20 0 FIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cnn(C2CCCC2)c1 ZINC000502458548 1095487649 /nfs/dbraw/zinc/48/76/49/1095487649.db2.gz CXQQBSQIXWNWTF-ICSRJNTNSA-N 2 0 352.526 4.171 20 0 FIADRP CC[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC(F)(F)F ZINC000414512884 1095547595 /nfs/dbraw/zinc/54/75/95/1095547595.db2.gz DVZDMWKJRXQDMY-INIZCTEOSA-N 2 0 371.491 4.285 20 0 FIADRP Cn1cc(-c2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)s2)cn1 ZINC000509540456 1095597220 /nfs/dbraw/zinc/59/72/20/1095597220.db2.gz MZZYJQJNKFXREU-UHFFFAOYSA-N 2 0 366.534 4.034 20 0 FIADRP C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)CC[C@@H]1CCCC[NH+]1C ZINC000444166189 1095794106 /nfs/dbraw/zinc/79/41/06/1095794106.db2.gz ISZRUJCOCPXNRI-HNNXBMFYSA-N 2 0 372.340 4.128 20 0 FIADRP CC[C@@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000324585883 1095915733 /nfs/dbraw/zinc/91/57/33/1095915733.db2.gz YRZKDYPDKMPRKT-MOPGFXCFSA-N 2 0 372.384 4.306 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000324585884 1095915942 /nfs/dbraw/zinc/91/59/42/1095915942.db2.gz YRZKDYPDKMPRKT-OALUTQOASA-N 2 0 372.384 4.306 20 0 FIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000421832210 1095943617 /nfs/dbraw/zinc/94/36/17/1095943617.db2.gz FNFIOFFKYCHEHE-OAHLLOKOSA-N 2 0 359.901 4.311 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H](c2ccc(F)cc2)C2CC2)CC1 ZINC000271751032 1096123880 /nfs/dbraw/zinc/12/38/80/1096123880.db2.gz RNFDPQIXRCJRIB-QHCPKHFHSA-N 2 0 368.496 4.023 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccsc2S1 ZINC000272774858 1096211245 /nfs/dbraw/zinc/21/12/45/1096211245.db2.gz UETWOXFXJOGREN-POZUXBRTSA-N 2 0 374.575 4.030 20 0 FIADRP [NH3+]CCCOC1CC[NH+](Cc2ccc(Sc3ccccc3)cc2)CC1 ZINC000414667771 1096393111 /nfs/dbraw/zinc/39/31/11/1096393111.db2.gz YRZNUAULJWSWHV-UHFFFAOYSA-N 2 0 356.535 4.168 20 0 FIADRP Clc1ccccc1OCC[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503434925 1096398721 /nfs/dbraw/zinc/39/87/21/1096398721.db2.gz LJCZSRRGYUUNSW-INIZCTEOSA-N 2 0 359.901 4.131 20 0 FIADRP CC(C)CC(=O)Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422720766 1096470136 /nfs/dbraw/zinc/47/01/36/1096470136.db2.gz MVBZRXKFRSTJTH-NJDAHSKKSA-N 2 0 357.542 4.072 20 0 FIADRP CCOc1c(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1OC ZINC000422724094 1096471898 /nfs/dbraw/zinc/47/18/98/1096471898.db2.gz UJVBIKBGJILSPH-KBAYOESNSA-N 2 0 366.933 4.148 20 0 FIADRP CCN(CC)[C@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1Cl ZINC000422742653 1096478025 /nfs/dbraw/zinc/47/80/25/1096478025.db2.gz GSFIVHSZTLUIOF-QVKFZJNVSA-N 2 0 374.960 4.236 20 0 FIADRP CC(C)COc1ccccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422745016 1096479682 /nfs/dbraw/zinc/47/96/82/1096479682.db2.gz XAMQHATXHGSVHP-REWPJTCUSA-N 2 0 366.505 4.067 20 0 FIADRP c1sc2ccccc2c1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422751882 1096483101 /nfs/dbraw/zinc/48/31/01/1096483101.db2.gz DDNCJEOPQLJYFI-WIYYLYMNSA-N 2 0 350.487 4.247 20 0 FIADRP C[C@@H]([NH2+]C[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl)C1C[NH2+]C1 ZINC000422765558 1096485266 /nfs/dbraw/zinc/48/52/66/1096485266.db2.gz QKOBTRQJQFELAT-RDTXWAMCSA-N 2 0 353.897 4.151 20 0 FIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000422780068 1096488604 /nfs/dbraw/zinc/48/86/04/1096488604.db2.gz JSVUYTWCVOWAIT-OXJNMPFZSA-N 2 0 364.892 4.220 20 0 FIADRP CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)oc21 ZINC000422780944 1096488957 /nfs/dbraw/zinc/48/89/57/1096488957.db2.gz HZOXIBAMRDQXPA-DZGCQCFKSA-N 2 0 353.466 4.405 20 0 FIADRP c1sc(-c2ccccc2)nc1CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422781369 1096489950 /nfs/dbraw/zinc/48/99/50/1096489950.db2.gz IQTQXJMKTIUZNT-SLFFLAALSA-N 2 0 355.551 4.253 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000422783436 1096490100 /nfs/dbraw/zinc/49/01/00/1096490100.db2.gz HKBDOLRQBPOIPH-ZDUSSCGKSA-N 2 0 353.388 4.110 20 0 FIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422785833 1096490161 /nfs/dbraw/zinc/49/01/61/1096490161.db2.gz RUWHERPACBBDEO-AMHTUMDSSA-N 2 0 366.505 4.382 20 0 FIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H](Cc3ccccc3)[C@H](C)[NH3+])s2)cs1 ZINC000422796992 1096493734 /nfs/dbraw/zinc/49/37/34/1096493734.db2.gz KUQUIIJKMMNFRF-KSSFIOAISA-N 2 0 371.575 4.271 20 0 FIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@H](Cc2ccccc2)[C@@H](C)[NH3+])cc1 ZINC000422811062 1096496878 /nfs/dbraw/zinc/49/68/78/1096496878.db2.gz TVCCZBYVVBXRFI-HWHRFOGPSA-N 2 0 352.522 4.011 20 0 FIADRP FC(F)Oc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000422832370 1096501969 /nfs/dbraw/zinc/50/19/69/1096501969.db2.gz UTWMUJIRBQSDGN-YDZRNGNQSA-N 2 0 350.453 4.176 20 0 FIADRP CCCOc1cc(C)ccc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422863300 1096507140 /nfs/dbraw/zinc/50/71/40/1096507140.db2.gz RRTGNARVBGWFDB-NFBKMPQASA-N 2 0 366.505 4.129 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422862515 1096507165 /nfs/dbraw/zinc/50/71/65/1096507165.db2.gz PXDSEGPLFJWIJF-NWDGAFQWSA-N 2 0 352.309 4.437 20 0 FIADRP CCCOc1cc(C)ccc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422863303 1096507365 /nfs/dbraw/zinc/50/73/65/1096507365.db2.gz RRTGNARVBGWFDB-REWPJTCUSA-N 2 0 366.505 4.129 20 0 FIADRP Cc1cccc(Oc2ccccc2C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422858897 1096507377 /nfs/dbraw/zinc/50/73/77/1096507377.db2.gz JFFXPWUVQSOMEJ-YPAWHYETSA-N 2 0 366.505 4.034 20 0 FIADRP Cc1ccc(Cl)cc1N1CC[C@H](C[NH2+][C@@H](Cc2ccccc2)[C@@H](C)[NH3+])C1 ZINC000422878251 1096510279 /nfs/dbraw/zinc/51/02/79/1096510279.db2.gz JVBNQGNJZOOVCT-QFUCXCTJSA-N 2 0 371.956 4.023 20 0 FIADRP Fc1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)ccc1Oc1cccnc1 ZINC000422901953 1096518995 /nfs/dbraw/zinc/51/89/95/1096518995.db2.gz LXPJFAKVELWGAV-SESVDKBCSA-N 2 0 369.484 4.413 20 0 FIADRP CC(C)COc1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422894688 1096525167 /nfs/dbraw/zinc/52/51/67/1096525167.db2.gz CVUDGQQNIBORIU-GGAORHGYSA-N 2 0 366.505 4.067 20 0 FIADRP Cc1sc(CC[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)nc1-c1ccccc1 ZINC000422924709 1096525618 /nfs/dbraw/zinc/52/56/18/1096525618.db2.gz BAIPCIPUKVKYFT-AWEZNQCLSA-N 2 0 366.534 4.174 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000422943728 1096525710 /nfs/dbraw/zinc/52/57/10/1096525710.db2.gz REULARUWSPUZBL-KRWDZBQOSA-N 2 0 361.489 4.279 20 0 FIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000422943729 1096526877 /nfs/dbraw/zinc/52/68/77/1096526877.db2.gz REULARUWSPUZBL-QGZVFWFLSA-N 2 0 361.489 4.279 20 0 FIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000422930943 1096528219 /nfs/dbraw/zinc/52/82/19/1096528219.db2.gz AEVYNPUCWOKBJL-SCLBCKFNSA-N 2 0 365.290 4.395 20 0 FIADRP c1ccc2c(c1)cccc2OCC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422933986 1096529670 /nfs/dbraw/zinc/52/96/70/1096529670.db2.gz BWKKJCWPGBZTIE-QPPBQGQZSA-N 2 0 374.484 4.064 20 0 FIADRP Clc1cccc2c1CC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422943032 1096531494 /nfs/dbraw/zinc/53/14/94/1096531494.db2.gz XOAWDASOTQOTHD-QKNQBKEWSA-N 2 0 354.881 4.173 20 0 FIADRP Clc1cccc2c1CC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422943034 1096531910 /nfs/dbraw/zinc/53/19/10/1096531910.db2.gz XOAWDASOTQOTHD-ZVDOUQERSA-N 2 0 354.881 4.173 20 0 FIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)ccc1OCC(C)C ZINC000422944531 1096535934 /nfs/dbraw/zinc/53/59/34/1096535934.db2.gz SHEJUIZVAYDVHR-CVEARBPZSA-N 2 0 371.525 4.304 20 0 FIADRP CC(C)[C@@H]([NH3+])CCN(C)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000414708124 1096536417 /nfs/dbraw/zinc/53/64/17/1096536417.db2.gz ILYKBNOUTQSALM-FQEVSTJZSA-N 2 0 374.573 4.288 20 0 FIADRP Clc1cccc(C2([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)CC2)c1 ZINC000422948579 1096536948 /nfs/dbraw/zinc/53/69/48/1096536948.db2.gz SNORQNICOFHRJP-AZUAARDMSA-N 2 0 354.881 4.175 20 0 FIADRP C[N@H+](Cc1ccco1)Cc1ccccc1CN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422990330 1096540570 /nfs/dbraw/zinc/54/05/70/1096540570.db2.gz BQXSUENXLMXBDJ-GOTSBHOMSA-N 2 0 361.489 4.146 20 0 FIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)c2)nc1 ZINC000422993806 1096542257 /nfs/dbraw/zinc/54/22/57/1096542257.db2.gz GHQICHTXIPEQNP-ISKFKSNPSA-N 2 0 371.484 4.094 20 0 FIADRP c1cc(-c2ccccc2)oc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422976110 1096543530 /nfs/dbraw/zinc/54/35/30/1096543530.db2.gz UQUDTAKQQKOGKP-OFNKIYASSA-N 2 0 360.457 4.292 20 0 FIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000423034222 1096555964 /nfs/dbraw/zinc/55/59/64/1096555964.db2.gz PPDUXJNMSKIYBD-APWZRJJASA-N 2 0 367.320 4.426 20 0 FIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000423037182 1096556397 /nfs/dbraw/zinc/55/63/97/1096556397.db2.gz VQAQDCQFIBICNQ-LUVWLHFXSA-N 2 0 355.929 4.108 20 0 FIADRP C[NH+](C)[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000423057465 1096559286 /nfs/dbraw/zinc/55/92/86/1096559286.db2.gz ZVGBGKKAMFBRFC-GBESFXJTSA-N 2 0 363.427 4.043 20 0 FIADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCN(c3ccccc3C(F)(F)F)C2)c2ccccc21 ZINC000423067613 1096563106 /nfs/dbraw/zinc/56/31/06/1096563106.db2.gz ZZLQIFPGBPQJBM-MORSLUCNSA-N 2 0 361.411 4.019 20 0 FIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000423052646 1096565412 /nfs/dbraw/zinc/56/54/12/1096565412.db2.gz RAQXKMJRFXFQRT-UPVQGACJSA-N 2 0 371.484 4.094 20 0 FIADRP Fc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423089874 1096571145 /nfs/dbraw/zinc/57/11/45/1096571145.db2.gz WETDCLKTZGYCIL-ONTIZHBOSA-N 2 0 352.453 4.049 20 0 FIADRP CCOc1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1Cl ZINC000423107725 1096583821 /nfs/dbraw/zinc/58/38/21/1096583821.db2.gz QCGWJNXLMGLUKU-NQIIRXRSSA-N 2 0 372.896 4.084 20 0 FIADRP COCCC[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccc(Cl)cc1 ZINC000423113102 1096586075 /nfs/dbraw/zinc/58/60/75/1096586075.db2.gz YKDBMISFICVWQC-AYWYSENESA-N 2 0 364.961 4.361 20 0 FIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)[C@H]1CCC[NH2+]C1 ZINC000423221825 1096621740 /nfs/dbraw/zinc/62/17/40/1096621740.db2.gz YIDQPQNIDFQYGO-GRDNDAEWSA-N 2 0 359.514 4.304 20 0 FIADRP CC1(C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)CC[NH2+]CC1 ZINC000423315789 1096641328 /nfs/dbraw/zinc/64/13/28/1096641328.db2.gz AJTDFYGAAJZRLS-KRWDZBQOSA-N 2 0 363.299 4.111 20 0 FIADRP [NH3+]CCCC[NH2+][C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000423316000 1096642114 /nfs/dbraw/zinc/64/21/14/1096642114.db2.gz BKAFFKFLZUBEAA-QGZVFWFLSA-N 2 0 354.828 4.359 20 0 FIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423300349 1096645533 /nfs/dbraw/zinc/64/55/33/1096645533.db2.gz RJARRCIXGBXMJK-QWRGUYRKSA-N 2 0 368.344 4.126 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)sc1Br ZINC000423401213 1096660973 /nfs/dbraw/zinc/66/09/73/1096660973.db2.gz VWUYGPSNLPTDJB-LLVKDONJSA-N 2 0 351.313 4.273 20 0 FIADRP CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)nc1 ZINC000423390039 1096663405 /nfs/dbraw/zinc/66/34/05/1096663405.db2.gz VOVXMVFZKGMVGQ-SSKFGXFMSA-N 2 0 371.956 4.181 20 0 FIADRP COCC1(C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC[NH2+]CC1 ZINC000423404032 1096672496 /nfs/dbraw/zinc/67/24/96/1096672496.db2.gz IEQLJTRTOUYILR-KRWDZBQOSA-N 2 0 357.325 4.050 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(OCc2cn3ccccc3n2)c1 ZINC000423427731 1096675118 /nfs/dbraw/zinc/67/51/18/1096675118.db2.gz ISIRVUAJAIINPN-ZWKOTPCHSA-N 2 0 366.509 4.081 20 0 FIADRP FC(F)Oc1ccc([C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423436361 1096685820 /nfs/dbraw/zinc/68/58/20/1096685820.db2.gz LTOSRAYGVWGWMU-PWRODBHTSA-N 2 0 372.459 4.355 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000423475048 1096695369 /nfs/dbraw/zinc/69/53/69/1096695369.db2.gz PSCKDMLQYJBKRQ-XCRHUMRWSA-N 2 0 363.299 4.239 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000423472983 1096695465 /nfs/dbraw/zinc/69/54/65/1096695465.db2.gz NNVUHAGFKBBUPS-LZNRXBQRSA-N 2 0 353.485 4.055 20 0 FIADRP Fc1ccc([C@@H]2CC[NH2+]C[C@@H]2C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000423473021 1096695483 /nfs/dbraw/zinc/69/54/83/1096695483.db2.gz NNVUHAGFKBBUPS-ZWCUEREDSA-N 2 0 353.485 4.055 20 0 FIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423480476 1096697847 /nfs/dbraw/zinc/69/78/47/1096697847.db2.gz NIXIPJJVEGICRN-AEFFLSMTSA-N 2 0 371.550 4.318 20 0 FIADRP Cc1c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000423503579 1096700936 /nfs/dbraw/zinc/70/09/36/1096700936.db2.gz MWEAJRYMNDAWLE-AOMKIAJQSA-N 2 0 366.484 4.451 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000423506989 1096702141 /nfs/dbraw/zinc/70/21/41/1096702141.db2.gz JFWPHBDSZAOXDD-HYBUGGRVSA-N 3 0 365.565 4.152 20 0 FIADRP CCc1ccccc1[C@@H]([NH3+])CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423495039 1096706380 /nfs/dbraw/zinc/70/63/80/1096706380.db2.gz BLIWTZSOCJKAGQ-KHUIQGCPSA-N 2 0 363.549 4.034 20 0 FIADRP COc1cc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)ccc1OC(F)F ZINC000423494505 1096706961 /nfs/dbraw/zinc/70/69/61/1096706961.db2.gz AQPSULWBBGORBA-YOEHRIQHSA-N 2 0 364.436 4.427 20 0 FIADRP COc1ccc(C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423521802 1096711857 /nfs/dbraw/zinc/71/18/57/1096711857.db2.gz TZGRNPBMPDPBKY-UZLBHIALSA-N 2 0 356.510 4.013 20 0 FIADRP CCC[C@@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000423559061 1096714058 /nfs/dbraw/zinc/71/40/58/1096714058.db2.gz JDBPILYOVJTJSM-HXUWFJFHSA-N 2 0 357.567 4.172 20 0 FIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423538385 1096715554 /nfs/dbraw/zinc/71/55/54/1096715554.db2.gz MSVUSADEZVDFLL-KRWDZBQOSA-N 2 0 357.498 4.226 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423540996 1096716743 /nfs/dbraw/zinc/71/67/43/1096716743.db2.gz KIVCLYVIZMHUSM-JFILPPLUSA-N 2 0 355.309 4.185 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423540998 1096716825 /nfs/dbraw/zinc/71/68/25/1096716825.db2.gz KIVCLYVIZMHUSM-VLXAULBPSA-N 2 0 355.309 4.185 20 0 FIADRP COc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2ccccc2Cl)c1 ZINC000423542235 1096717381 /nfs/dbraw/zinc/71/73/81/1096717381.db2.gz MEUXNVLJQQEPPS-FOUBCARRSA-N 2 0 370.924 4.416 20 0 FIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423545567 1096717627 /nfs/dbraw/zinc/71/76/27/1096717627.db2.gz XXUVCPRSRJSFSE-QFIPXVFZSA-N 2 0 354.469 4.018 20 0 FIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423554484 1096720371 /nfs/dbraw/zinc/72/03/71/1096720371.db2.gz WOUXFVAWUMFGAE-DRPJVOAASA-N 2 0 359.514 4.296 20 0 FIADRP CN1CC[C@@H]([NH2+]Cc2ccc(-n3ccnc3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000514694955 1098559815 /nfs/dbraw/zinc/55/98/15/1098559815.db2.gz UEMSTECGPXJRKX-RTWAWAEBSA-N 2 0 366.896 4.061 20 0 FIADRP CC(C)N(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(C)C ZINC000515518346 1098656644 /nfs/dbraw/zinc/65/66/44/1098656644.db2.gz GBVMETATKKGWLA-VQTJNVASSA-N 2 0 373.585 4.042 20 0 FIADRP CCc1ccc(NC(=O)[C@H](C)[NH2+]Cc2cccc(C[NH+](CC)CC)c2)cc1 ZINC000515527143 1098664528 /nfs/dbraw/zinc/66/45/28/1098664528.db2.gz XVVZIJDLNRNYSJ-SFHVURJKSA-N 2 0 367.537 4.208 20 0 FIADRP CN1CCC[C@H](C[NH2+]Cc2c[nH]nc2-c2ccsc2)[C@H]1c1cccs1 ZINC000436236207 1098859438 /nfs/dbraw/zinc/85/94/38/1098859438.db2.gz DSVLYZMKTLAZRX-KUHUBIRLSA-N 2 0 372.563 4.372 20 0 FIADRP C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436284548 1098887971 /nfs/dbraw/zinc/88/79/71/1098887971.db2.gz BUPYWZIPMXMPAF-LRQRDZAKSA-N 2 0 356.485 4.363 20 0 FIADRP CSc1ccc(CC[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000436301170 1098914697 /nfs/dbraw/zinc/91/46/97/1098914697.db2.gz YGCXZVVYZGHURE-QGZVFWFLSA-N 2 0 358.551 4.242 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc3ccccc32)CC1 ZINC000533271798 1098922825 /nfs/dbraw/zinc/92/28/25/1098922825.db2.gz ZPTNQFWUZVFGCH-SFHVURJKSA-N 2 0 367.537 4.219 20 0 FIADRP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000436403975 1098992778 /nfs/dbraw/zinc/99/27/78/1098992778.db2.gz AUWJAMPAECOLIU-FUHWJXTLSA-N 2 0 351.469 4.307 20 0 FIADRP CCCC[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000533715068 1099359603 /nfs/dbraw/zinc/35/96/03/1099359603.db2.gz XMLNRGKVASTMBF-QGZVFWFLSA-N 2 0 359.341 4.271 20 0 FIADRP CCC[NH+](CCC)CCCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000505925547 1099506981 /nfs/dbraw/zinc/50/69/81/1099506981.db2.gz USIZCAVTWHOTKN-RTWAWAEBSA-N 2 0 365.606 4.002 20 0 FIADRP CN(c1ccccc1)c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cn1 ZINC000437146534 1099655155 /nfs/dbraw/zinc/65/51/55/1099655155.db2.gz QLGXMFDOYSZMDL-UHFFFAOYSA-N 2 0 364.537 4.157 20 0 FIADRP Clc1ccc(OCCCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459389944 1099658268 /nfs/dbraw/zinc/65/82/68/1099658268.db2.gz RQOKFVVBJKJFIK-UHFFFAOYSA-N 2 0 359.901 4.153 20 0 FIADRP Cc1ccsc1C[N@@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506009502 1099757698 /nfs/dbraw/zinc/75/76/98/1099757698.db2.gz KBTPPSSSUMQUAQ-UHFFFAOYSA-N 2 0 357.567 4.219 20 0 FIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000162499851 1099810755 /nfs/dbraw/zinc/81/07/55/1099810755.db2.gz VPMBJVOFKIEXDM-HNNXBMFYSA-N 2 0 362.901 4.140 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000162502276 1099813604 /nfs/dbraw/zinc/81/36/04/1099813604.db2.gz MKROSKKKBHKNMR-OAHLLOKOSA-N 2 0 362.514 4.339 20 0 FIADRP CC[N@H+](CCc1cccs1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000508691224 1099825022 /nfs/dbraw/zinc/82/50/22/1099825022.db2.gz WRTLNXGINCMKNK-UHFFFAOYSA-N 2 0 371.594 4.343 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000508695411 1099827291 /nfs/dbraw/zinc/82/72/91/1099827291.db2.gz FKIRDUFWWYDLQR-GXKRZCMTSA-N 2 0 350.506 4.051 20 0 FIADRP C[C@@H](NCCC[N@H+](C)C1CCCCC1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508699235 1099834285 /nfs/dbraw/zinc/83/42/85/1099834285.db2.gz NRMSSHLNPVEMOW-IRLDBZIGSA-N 2 0 357.586 4.141 20 0 FIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000162545468 1099835443 /nfs/dbraw/zinc/83/54/43/1099835443.db2.gz CWJTUVUFILGNTG-OAHLLOKOSA-N 2 0 361.555 4.366 20 0 FIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000162545634 1099837012 /nfs/dbraw/zinc/83/70/12/1099837012.db2.gz CWJTUVUFILGNTG-HNNXBMFYSA-N 2 0 361.555 4.366 20 0 FIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2ccsc2S1 ZINC000162554729 1099841620 /nfs/dbraw/zinc/84/16/20/1099841620.db2.gz KSZBXVJAFUZOPE-KBXCAEBGSA-N 2 0 362.564 4.404 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@H]2CC[NH+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000516866862 1099895483 /nfs/dbraw/zinc/89/54/83/1099895483.db2.gz UZUMPINZNKEABM-GOTSBHOMSA-N 2 0 369.597 4.141 20 0 FIADRP COc1cccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508711061 1099902935 /nfs/dbraw/zinc/90/29/35/1099902935.db2.gz OBHACPIRMGCZSK-IPJJNNNSSA-N 2 0 352.522 4.126 20 0 FIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC3(SC)CC[NH+](C)CC3)oc21 ZINC000516940236 1099947151 /nfs/dbraw/zinc/94/71/51/1099947151.db2.gz SEERHLNQHOZRSW-HNNXBMFYSA-N 2 0 362.539 4.310 20 0 FIADRP C[C@H](Nc1ccc(N2CCCC2)cn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516998733 1099978094 /nfs/dbraw/zinc/97/80/94/1099978094.db2.gz XLSLOKSOUMTZRS-AZUAARDMSA-N 2 0 350.510 4.004 20 0 FIADRP C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000536665609 1100138755 /nfs/dbraw/zinc/13/87/55/1100138755.db2.gz UBTGQVCAOVYEQB-GCJKJVERSA-N 2 0 373.585 4.031 20 0 FIADRP CC(C)(C)[C@@H](COc1ccccc1F)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459437792 1100149613 /nfs/dbraw/zinc/14/96/13/1100149613.db2.gz ZALQBZONWZAYFZ-OAQYLSRUSA-N 2 0 371.500 4.273 20 0 FIADRP FC(F)Oc1ccc(Cl)cc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459422198 1100152860 /nfs/dbraw/zinc/15/28/60/1100152860.db2.gz NHEZTHOKCSNBTO-UHFFFAOYSA-N 2 0 367.827 4.095 20 0 FIADRP Clc1ccc2c(c1Cl)OC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459431635 1100168127 /nfs/dbraw/zinc/16/81/27/1100168127.db2.gz SBBDRDYZZLIHJM-INIZCTEOSA-N 2 0 364.276 4.081 20 0 FIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(OCC2CC2)c(F)c1 ZINC000459446328 1100180983 /nfs/dbraw/zinc/18/09/83/1100180983.db2.gz PMHUDDVQUBMLLJ-INIZCTEOSA-N 2 0 369.484 4.329 20 0 FIADRP Cc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c(OC(C)(C)C)c1 ZINC000459439413 1100194820 /nfs/dbraw/zinc/19/48/20/1100194820.db2.gz IQKZKPWVABBKTL-UHFFFAOYSA-N 2 0 353.510 4.326 20 0 FIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000536695373 1100196539 /nfs/dbraw/zinc/19/65/39/1100196539.db2.gz CWZLINAFYBXOGQ-UHFFFAOYSA-N 2 0 354.542 4.043 20 0 FIADRP [NH3+]C1CCC([NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000437791625 1100200240 /nfs/dbraw/zinc/20/02/40/1100200240.db2.gz GBJMUHNOVUXVNS-UHFFFAOYSA-N 2 0 355.429 4.188 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1N(C)C ZINC000536705906 1100212911 /nfs/dbraw/zinc/21/29/11/1100212911.db2.gz QIGPVYVRIJERGP-LJQANCHMSA-N 2 0 367.537 4.078 20 0 FIADRP FC1(c2cccc(Cl)c2)CC([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459505425 1100243139 /nfs/dbraw/zinc/24/31/39/1100243139.db2.gz DWJCJPSCRBQCIK-UHFFFAOYSA-N 2 0 359.876 4.321 20 0 FIADRP Cc1nccn1CC[NH2+][C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000425921550 1100257651 /nfs/dbraw/zinc/25/76/51/1100257651.db2.gz QYNUPJSMLRWFOF-KRWDZBQOSA-N 2 0 366.278 4.224 20 0 FIADRP Brc1ccccc1-c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)s1 ZINC000666856632 1100268574 /nfs/dbraw/zinc/26/85/74/1100268574.db2.gz VKUZKNCEZSIBIC-ZDUSSCGKSA-N 2 0 365.340 4.409 20 0 FIADRP COCCCC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459528524 1100278404 /nfs/dbraw/zinc/27/84/04/1100278404.db2.gz NLYVKPRDLMTNEW-JOCHJYFZSA-N 2 0 353.510 4.198 20 0 FIADRP Clc1cc2[nH]cc(CC[NH2+]C3CCN(C4CC4)CC3)c2c(Cl)c1 ZINC000459532631 1100281431 /nfs/dbraw/zinc/28/14/31/1100281431.db2.gz VBQVJVQBDLYOQC-UHFFFAOYSA-N 2 0 352.309 4.234 20 0 FIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000425928066 1100297160 /nfs/dbraw/zinc/29/71/60/1100297160.db2.gz XHEPOESUNXCKRO-NRFANRHFSA-N 2 0 357.929 4.484 20 0 FIADRP CC(C)(C)C1CC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000459583168 1100308839 /nfs/dbraw/zinc/30/88/39/1100308839.db2.gz FMZAEYSWYMYXRU-ATKRNPRHSA-N 2 0 370.581 4.330 20 0 FIADRP CC[C@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000536830782 1100328474 /nfs/dbraw/zinc/32/84/74/1100328474.db2.gz CQKAXJJQHYVVTA-NRFANRHFSA-N 2 0 354.542 4.153 20 0 FIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc(C)ccc1OC ZINC000536825968 1100342192 /nfs/dbraw/zinc/34/21/92/1100342192.db2.gz JNQZXDYAMWOQDI-NRFANRHFSA-N 2 0 353.510 4.356 20 0 FIADRP Cc1ccn(-c2ccccc2C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000536847752 1100358963 /nfs/dbraw/zinc/35/89/63/1100358963.db2.gz WSZGXAUKEDUZDY-AUSIDOKSSA-N 2 0 374.532 4.181 20 0 FIADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000536853250 1100367039 /nfs/dbraw/zinc/36/70/39/1100367039.db2.gz QVFMRDNKOVNWMD-ORYQWCPZSA-N 2 0 362.583 4.216 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3Cl)CC2)[C@H](C)C1 ZINC000536853094 1100367726 /nfs/dbraw/zinc/36/77/26/1100367726.db2.gz PRBDNBAURUGOMJ-XLIONFOSSA-N 2 0 364.961 4.098 20 0 FIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536856342 1100371169 /nfs/dbraw/zinc/37/11/69/1100371169.db2.gz FBMUOYAUHUYHBN-YESZJQIVSA-N 2 0 372.475 4.115 20 0 FIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc(C)ccc2C)CC1 ZINC000517547516 1100489501 /nfs/dbraw/zinc/48/95/01/1100489501.db2.gz XXHRVOOOPDJVGS-IBGZPJMESA-N 2 0 369.528 4.435 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)[C@H](C)C1 ZINC000438189447 1100501330 /nfs/dbraw/zinc/50/13/30/1100501330.db2.gz KPGMLAPJYHKYJU-LGKPFJOYSA-N 2 0 358.570 4.223 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)Cc3ccccc3F)CC2)cc1 ZINC000438210721 1100513577 /nfs/dbraw/zinc/51/35/77/1100513577.db2.gz DYYQEYDMVWOGSS-GOSISDBHSA-N 2 0 370.512 4.267 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](CCO)c2ccccc2)CC1 ZINC000438836485 1100955925 /nfs/dbraw/zinc/95/59/25/1100955925.db2.gz ZPMUUMNWTFJUIB-ZKMFCFPVSA-N 2 0 366.549 4.185 20 0 FIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](CCO)c2ccccc2)CC1 ZINC000438836482 1100956046 /nfs/dbraw/zinc/95/60/46/1100956046.db2.gz ZPMUUMNWTFJUIB-BOMBAVFCSA-N 2 0 366.549 4.185 20 0 FIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC000518274765 1101057692 /nfs/dbraw/zinc/05/76/92/1101057692.db2.gz WKQRZWPCYCINKG-QFIPXVFZSA-N 2 0 352.522 4.476 20 0 FIADRP COc1cc(C[NH2+]CCC[C@H]2CCC[NH2+]2)ccc1OCc1ccc(F)cc1 ZINC000414975584 1101089613 /nfs/dbraw/zinc/08/96/13/1101089613.db2.gz OUYIKZRYSDXSEQ-FQEVSTJZSA-N 2 0 372.484 4.035 20 0 FIADRP C[C@@H]([NH3+])c1ccc(NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)cc1 ZINC000414981979 1101153664 /nfs/dbraw/zinc/15/36/64/1101153664.db2.gz YLIDTWCLYWUANU-QGZVFWFLSA-N 2 0 366.509 4.379 20 0 FIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1OCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000426308181 1101240522 /nfs/dbraw/zinc/24/05/22/1101240522.db2.gz VDNJEOLFCQDSDX-QYWGDWMGSA-N 2 0 374.550 4.042 20 0 FIADRP COc1cc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc(F)cc1 ZINC000414991367 1101291792 /nfs/dbraw/zinc/29/17/92/1101291792.db2.gz BBOYVOCWRISYLV-XLIONFOSSA-N 2 0 372.484 4.020 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1OCCc2sccc21 ZINC000426355034 1101351107 /nfs/dbraw/zinc/35/11/07/1101351107.db2.gz XKWGKCOEHUQONI-YZIUBNRHSA-N 2 0 370.562 4.251 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCc2cc(Cl)ccc2Br)CC1 ZINC000537093722 1101460030 /nfs/dbraw/zinc/46/00/30/1101460030.db2.gz ZSQBYVUYUCSFQD-UHFFFAOYSA-N 2 0 359.739 4.109 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]CCc2ccc(Br)cc2Cl)CC1 ZINC000559914884 1101467525 /nfs/dbraw/zinc/46/75/25/1101467525.db2.gz NEWKAWWDIDEWNA-UHFFFAOYSA-N 2 0 359.739 4.107 20 0 FIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000414999513 1101483224 /nfs/dbraw/zinc/48/32/24/1101483224.db2.gz JEIVHIOUXMTUSS-SWLSCSKDSA-N 2 0 369.456 4.436 20 0 FIADRP C[C@H](CC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000178742013 1101533775 /nfs/dbraw/zinc/53/37/75/1101533775.db2.gz UNQIYDDWPRMEFN-UYAOXDASSA-N 2 0 357.542 4.027 20 0 FIADRP C[NH+]1CCC(CC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000518775712 1101538388 /nfs/dbraw/zinc/53/83/88/1101538388.db2.gz DMTANONQDXNWDO-UHFFFAOYSA-N 2 0 374.532 4.361 20 0 FIADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537190012 1101541468 /nfs/dbraw/zinc/54/14/68/1101541468.db2.gz OBZABMVZXSLYRQ-UZKOGDIHSA-N 2 0 372.553 4.015 20 0 FIADRP COCc1cccc(OCC2(C[NH+]3CCC(CC[NH+](C)C)CC3)CCC2)c1 ZINC000537212320 1101548650 /nfs/dbraw/zinc/54/86/50/1101548650.db2.gz VXHPLDKWUXNZJY-UHFFFAOYSA-N 2 0 374.569 4.046 20 0 FIADRP CC(C)(C)C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1 ZINC000537292254 1101612156 /nfs/dbraw/zinc/61/21/56/1101612156.db2.gz HGFGVTLLGMFWAI-VQTJNVASSA-N 2 0 350.522 4.130 20 0 FIADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000643462260 1101927003 /nfs/dbraw/zinc/92/70/03/1101927003.db2.gz SEZGQPXOFQXOSE-AZUAARDMSA-N 2 0 353.510 4.061 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(CC)cc2)CC1 ZINC000519225004 1102021619 /nfs/dbraw/zinc/02/16/19/1102021619.db2.gz JHCVJGKXPXKJHM-SFHVURJKSA-N 2 0 359.558 4.020 20 0 FIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2C(C)C)CC1 ZINC000519223331 1102021823 /nfs/dbraw/zinc/02/18/23/1102021823.db2.gz ZWMZYBRGQXXGQS-SFHVURJKSA-N 2 0 359.558 4.191 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1OC ZINC000036804151 1102095490 /nfs/dbraw/zinc/09/54/90/1102095490.db2.gz VRBQOIFJBOVIQS-AWEZNQCLSA-N 2 0 357.336 4.058 20 0 FIADRP FC(F)(F)Oc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167967081 1102272176 /nfs/dbraw/zinc/27/21/76/1102272176.db2.gz AUTOZJPGAASXTD-AYHJJNSGSA-N 2 0 368.443 4.123 20 0 FIADRP OCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cccc2ccccc21 ZINC001167967153 1102275366 /nfs/dbraw/zinc/27/53/66/1102275366.db2.gz DPYHLBNTSAUFCE-LUQQLXLSSA-N 2 0 364.533 4.258 20 0 FIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120964258 1102290653 /nfs/dbraw/zinc/29/06/53/1102290653.db2.gz IHJQBJZROUVSGQ-ZDUSSCGKSA-N 2 0 350.865 4.400 20 0 FIADRP Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000187780800 1102316857 /nfs/dbraw/zinc/31/68/57/1102316857.db2.gz BYXUPDNCQYCIDD-SCTDSRPQSA-N 2 0 352.526 4.114 20 0 FIADRP c1c[nH]c([C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)n1 ZINC000187837133 1102322484 /nfs/dbraw/zinc/32/24/84/1102322484.db2.gz YFHBSYAMDRMZBI-JOCHJYFZSA-N 2 0 360.505 4.001 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(Br)cc1 ZINC000532446327 1102337229 /nfs/dbraw/zinc/33/72/29/1102337229.db2.gz FTYFJNNBCHUJQI-KEYYUXOJSA-N 2 0 353.348 4.045 20 0 FIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CC(c3cccc(Br)c3)C2)C1 ZINC000040622760 1102343385 /nfs/dbraw/zinc/34/33/85/1102343385.db2.gz MCSMFMHUERKZJO-NXVRBGIVSA-N 2 0 351.332 4.015 20 0 FIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000040622734 1102344816 /nfs/dbraw/zinc/34/48/16/1102344816.db2.gz HJIKOJYBOLZTOF-MXWWQKGMSA-N 2 0 351.332 4.015 20 0 FIADRP c1ccc(CO[C@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167969032 1102352522 /nfs/dbraw/zinc/35/25/22/1102352522.db2.gz YQTVVCLCTIGCLT-HVXWDBPDSA-N 2 0 354.538 4.119 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000121274449 1102362291 /nfs/dbraw/zinc/36/22/91/1102362291.db2.gz JCHPKVKXGRVKNY-OALUTQOASA-N 2 0 363.615 4.111 20 0 FIADRP COCc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000537636462 1102392693 /nfs/dbraw/zinc/39/26/93/1102392693.db2.gz MPLHIGOAWLMKCI-UHFFFAOYSA-N 2 0 352.522 4.177 20 0 FIADRP C[C@@H](NC[C@@H](O)C[NH+]1CCCC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000532479640 1102423434 /nfs/dbraw/zinc/42/34/34/1102423434.db2.gz LJHLELNHPRDGFZ-RHSMWYFYSA-N 2 0 364.942 4.176 20 0 FIADRP Cc1cc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c(C)s1 ZINC000532497830 1102440150 /nfs/dbraw/zinc/44/01/50/1102440150.db2.gz UTWODYXGGTULQY-UTKZUKDTSA-N 2 0 357.567 4.004 20 0 FIADRP Cc1ccc(C[N@@H+]2CCOC3(CC[NH+](C4CCC(C)CC4)CC3)C2)cc1 ZINC001168215784 1102496650 /nfs/dbraw/zinc/49/66/50/1102496650.db2.gz WVNCYKVKXIBHSX-UHFFFAOYSA-N 2 0 356.554 4.241 20 0 FIADRP COc1ccc2c(c1)C[C@H]([NH2+]CCC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168228879 1102548939 /nfs/dbraw/zinc/54/89/39/1102548939.db2.gz LRGFHHPDVKHKOL-HSZRJFAPSA-N 2 0 364.533 4.054 20 0 FIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1F ZINC000122318795 1102566386 /nfs/dbraw/zinc/56/63/86/1102566386.db2.gz BVXIPTJZTUVOES-OAHLLOKOSA-N 2 0 362.514 4.339 20 0 FIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)ccc1SC ZINC000122371092 1102568565 /nfs/dbraw/zinc/56/85/65/1102568565.db2.gz OGHSYUNSFJKGRA-INIZCTEOSA-N 2 0 374.550 4.208 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC[C@@H](c3ccco3)[NH+]3CCCC3)CC2)C1 ZINC000152275941 1102584029 /nfs/dbraw/zinc/58/40/29/1102584029.db2.gz VGXSBUZBNQUZEA-GIVPXCGWSA-N 2 0 359.558 4.049 20 0 FIADRP CC[NH+](CC)CC1CC[NH+](Cc2cn(C)nc2-c2ccccc2Cl)CC1 ZINC000506850023 1102594167 /nfs/dbraw/zinc/59/41/67/1102594167.db2.gz DUJWCUWVDNOEQH-UHFFFAOYSA-N 2 0 374.960 4.294 20 0 FIADRP CCCC(=O)Nc1ccc(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007035 1102759404 /nfs/dbraw/zinc/75/94/04/1102759404.db2.gz CJCMUSGMYRALRJ-FCHUYYIVSA-N 2 0 365.521 4.350 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@]1(C)CCCO1 ZINC000550999413 1102759527 /nfs/dbraw/zinc/75/95/27/1102759527.db2.gz QKGFAPCJOWRYRY-FDDCHVKYSA-N 2 0 352.522 4.462 20 0 FIADRP Brc1sccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167981727 1102771928 /nfs/dbraw/zinc/77/19/28/1102771928.db2.gz GXSXNCVSGNGNHC-MQVJKMGUSA-N 2 0 369.372 4.048 20 0 FIADRP C[C@H](CCN[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000551034751 1102824739 /nfs/dbraw/zinc/82/47/39/1102824739.db2.gz ONDWSQHSIROEJV-HUVFLSCGSA-N 2 0 365.565 4.322 20 0 FIADRP Cc1ccccc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550262493 1102883320 /nfs/dbraw/zinc/88/33/20/1102883320.db2.gz IKFLOBIRMOFCSG-HSZRJFAPSA-N 2 0 364.533 4.013 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1 ZINC000550263041 1102884017 /nfs/dbraw/zinc/88/40/17/1102884017.db2.gz TXJDBJUKPQNNND-CEMLEFRQSA-N 2 0 356.554 4.084 20 0 FIADRP CCO[C@@H]1C[C@@H](NC2CC[NH+](CC(C)C)CC2)[C@H]1Sc1ccccc1 ZINC000459362763 1102919247 /nfs/dbraw/zinc/91/92/47/1102919247.db2.gz HALFGYSBILHQOJ-NJDAHSKKSA-N 2 0 362.583 4.035 20 0 FIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000506947172 1102976526 /nfs/dbraw/zinc/97/65/26/1102976526.db2.gz UFVNRVXROJQMNJ-UHFFFAOYSA-N 2 0 372.944 4.142 20 0 FIADRP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000551199229 1102982796 /nfs/dbraw/zinc/98/27/96/1102982796.db2.gz XQDUMKAXWJALIV-INIZCTEOSA-N 2 0 367.468 4.165 20 0 FIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC000537698604 1102985673 /nfs/dbraw/zinc/98/56/73/1102985673.db2.gz UVUQYQDHWMJRFK-XPWALMASSA-N 2 0 350.506 4.037 20 0 FIADRP CN(C)[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000551267154 1103026853 /nfs/dbraw/zinc/02/68/53/1103026853.db2.gz MYBGZAHWBFOIIH-KXTRFFEISA-N 2 0 365.565 4.322 20 0 FIADRP Clc1ccc2sc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)nc2c1 ZINC000459379822 1103034541 /nfs/dbraw/zinc/03/45/41/1103034541.db2.gz AASAJVNVQGHISY-UHFFFAOYSA-N 2 0 358.898 4.103 20 0 FIADRP COc1cc([C@@H](C)[NH2+]C2CCN(C3CC3)CC2)ccc1OC1CCCC1 ZINC000459378980 1103036475 /nfs/dbraw/zinc/03/64/75/1103036475.db2.gz SBAAGSPQNMSDJU-MRXNPFEDSA-N 2 0 358.526 4.294 20 0 FIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnn(Cc2ccccc2Cl)c1)c1ccccc1 ZINC000666976003 1103044059 /nfs/dbraw/zinc/04/40/59/1103044059.db2.gz SWRSOQAMNHDWIK-NRFANRHFSA-N 2 0 368.912 4.155 20 0 FIADRP CC(C)[NH+]1CCC([N@H+](C)CCCOc2cccc(C(F)(F)F)c2)CC1 ZINC000507360885 1103337494 /nfs/dbraw/zinc/33/74/94/1103337494.db2.gz POXUAXBOXUCBCM-UHFFFAOYSA-N 2 0 358.448 4.279 20 0 FIADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)ccc1OCc1ccccc1 ZINC000666996723 1103356041 /nfs/dbraw/zinc/35/60/41/1103356041.db2.gz BLATZTCWTPUFAY-FQEVSTJZSA-N 2 0 366.505 4.039 20 0 FIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000551798476 1103676015 /nfs/dbraw/zinc/67/60/15/1103676015.db2.gz YQSKJDGGFQLJPH-ZOCIIQOWSA-N 2 0 352.444 4.415 20 0 FIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC3CC[NH+](C)CC3)cc1)[C@@H](C)C2 ZINC000551813413 1103695973 /nfs/dbraw/zinc/69/59/73/1103695973.db2.gz LQTACXRLENFTTQ-MHECFPHRSA-N 2 0 364.533 4.491 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccnc1 ZINC000551816763 1103699009 /nfs/dbraw/zinc/69/90/09/1103699009.db2.gz KJPDMWCPALYWOV-JOCHJYFZSA-N 2 0 353.510 4.042 20 0 FIADRP O=C(Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1)C1CCCCC1 ZINC000519698811 1103787246 /nfs/dbraw/zinc/78/72/46/1103787246.db2.gz VTQWGJHQORXBEJ-FDFHNCONSA-N 2 0 369.553 4.216 20 0 FIADRP CC(C)CSCCC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538307294 1104104401 /nfs/dbraw/zinc/10/44/01/1104104401.db2.gz MCLLVVBREGDSGB-IBGZPJMESA-N 2 0 362.583 4.344 20 0 FIADRP CCC(C)(C)[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000520343991 1104284749 /nfs/dbraw/zinc/28/47/49/1104284749.db2.gz SRLYFAANSNFWQJ-FPOVZHCZSA-N 2 0 358.570 4.330 20 0 FIADRP FC(F)(F)c1ccc(OCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441419875 1104381399 /nfs/dbraw/zinc/38/13/99/1104381399.db2.gz YFDRUTRGUOWKNY-HNAYVOBHSA-N 2 0 368.443 4.033 20 0 FIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441419129 1104400377 /nfs/dbraw/zinc/40/03/77/1104400377.db2.gz JJURSYUUAFFQPX-KNQAVFIVSA-N 2 0 350.506 4.167 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCOC4(CCSCC4)C3)CC2)C1 ZINC000537963316 1104448596 /nfs/dbraw/zinc/44/85/96/1104448596.db2.gz HTBSKINLGKUBDO-HOJAQTOUSA-N 2 0 366.615 4.064 20 0 FIADRP c1ccc2c(c1)nc([C@H]1CCCC[NH2+]1)n2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994456 1104491606 /nfs/dbraw/zinc/49/16/06/1104491606.db2.gz FJJOYKQJEPNNNC-KXZRCVDZSA-N 2 0 364.537 4.429 20 0 FIADRP c1ccc(COC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995366 1104498692 /nfs/dbraw/zinc/49/86/92/1104498692.db2.gz COPWLAKOVGDWHN-CBQGHPETSA-N 2 0 354.538 4.073 20 0 FIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2c(Cl)oc3ccccc32)C[C@H](C)O1 ZINC000536413736 1104916179 /nfs/dbraw/zinc/91/61/79/1104916179.db2.gz DJXIPGRQWQXMMC-GJZGRUSLSA-N 2 0 350.890 4.065 20 0 FIADRP c1ccc2c(c1)c(C1CC[NH2+]CC1)nn2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001168003219 1104996497 /nfs/dbraw/zinc/99/64/97/1104996497.db2.gz KTRQJEPHSSMGQO-YOFSQIOKSA-N 2 0 364.537 4.081 20 0 FIADRP Cc1cc(F)cc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)c1 ZINC001143586478 1105014497 /nfs/dbraw/zinc/01/44/97/1105014497.db2.gz OAGSQDMBHMOWAG-UHFFFAOYSA-N 2 0 353.485 4.017 20 0 FIADRP COc1ccccc1S[C@@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001168004755 1105046012 /nfs/dbraw/zinc/04/60/12/1105046012.db2.gz YMSZTCHNPRJXRR-JIRNRHONSA-N 2 0 372.578 4.267 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000152403513 1105087541 /nfs/dbraw/zinc/08/75/41/1105087541.db2.gz ASSJRXROJLXILO-CVDCTZTESA-N 2 0 350.506 4.053 20 0 FIADRP Clc1ccc2c(c1Cl)OCCC[C@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152415565 1105105014 /nfs/dbraw/zinc/10/50/14/1105105014.db2.gz UUNSJICMJIERPT-MLGOLLRUSA-N 2 0 355.309 4.281 20 0 FIADRP Clc1cc(Cl)cc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000665228788 1105224387 /nfs/dbraw/zinc/22/43/87/1105224387.db2.gz HFWYKTJTHMSLCB-PKOBYXMFSA-N 2 0 363.288 4.339 20 0 FIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(C)C ZINC000427699417 1105251096 /nfs/dbraw/zinc/25/10/96/1105251096.db2.gz XIUDQQZZXOJRMO-IRXDYDNUSA-N 2 0 357.464 4.434 20 0 FIADRP CCSc1cc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)ccn1 ZINC000427868049 1105303617 /nfs/dbraw/zinc/30/36/17/1105303617.db2.gz VUAFITZFRVBWOS-PWRODBHTSA-N 2 0 367.562 4.194 20 0 FIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000474021676 1105311649 /nfs/dbraw/zinc/31/16/49/1105311649.db2.gz HRGGUSSFQOXVSK-NRFANRHFSA-N 2 0 356.485 4.408 20 0 FIADRP CCO[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C12CCC2 ZINC000390719028 1106752978 /nfs/dbraw/zinc/75/29/78/1106752978.db2.gz YVPPHYQGSVHOBB-DSBNJHONSA-N 2 0 354.538 4.119 20 0 FIADRP CCO[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C12CCC2 ZINC000390719032 1106753135 /nfs/dbraw/zinc/75/31/35/1106753135.db2.gz YVPPHYQGSVHOBB-NAQMCUANSA-N 2 0 354.538 4.119 20 0 FIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](COCC3CC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168064252 1106855173 /nfs/dbraw/zinc/85/51/73/1106855173.db2.gz PLVFFGSHRNMPML-WOIUINJBSA-N 2 0 356.554 4.177 20 0 FIADRP FC1(F)CC(C[NH+]2CCCC3(CCC[N@@H+](CC4CC(F)(F)C4)C3)C2)C1 ZINC000451046721 1106907489 /nfs/dbraw/zinc/90/74/89/1106907489.db2.gz QEDKXSXVSMSWFT-UHFFFAOYSA-N 2 0 362.455 4.255 20 0 FIADRP CC(C)Cc1ccccc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000530210044 1106913613 /nfs/dbraw/zinc/91/36/13/1106913613.db2.gz KSNFGINOIGCUNC-GGAORHGYSA-N 2 0 350.506 4.231 20 0 FIADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1OCc1cccs1 ZINC000530674589 1107245496 /nfs/dbraw/zinc/24/54/96/1107245496.db2.gz CFISXURXCNQSPW-MSOLQXFVSA-N 2 0 374.550 4.298 20 0 FIADRP CC[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CCCc3ccc(F)cc32)CC1 ZINC000475507513 1107581994 /nfs/dbraw/zinc/58/19/94/1107581994.db2.gz FXBLGKXGZFPYPH-JOCHJYFZSA-N 2 0 367.512 4.135 20 0 FIADRP Brc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCS2 ZINC000152441400 1107648519 /nfs/dbraw/zinc/64/85/19/1107648519.db2.gz VWIAIXUZTJBYFR-MLGOLLRUSA-N 2 0 367.356 4.060 20 0 FIADRP COc1ccc(CNC2CC([NH+]3CCCCC3)C2)cc1OCCC(C)C ZINC000475568185 1107757606 /nfs/dbraw/zinc/75/76/06/1107757606.db2.gz DEWPBXAEFSYYRV-UHFFFAOYSA-N 2 0 360.542 4.227 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+]CC2CCCCCC2)c1)C1CCOCC1 ZINC000531489990 1107927212 /nfs/dbraw/zinc/92/72/12/1107927212.db2.gz IKOLHBUSVFOTCT-UHFFFAOYSA-N 2 0 374.569 4.236 20 0 FIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000531677181 1108063420 /nfs/dbraw/zinc/06/34/20/1108063420.db2.gz CIUJAMKDMXNHML-HLAWJBBLSA-N 2 0 359.558 4.049 20 0 FIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000531692675 1108096610 /nfs/dbraw/zinc/09/66/10/1108096610.db2.gz UYQISVUJHXRHEM-FCEUIQTBSA-N 2 0 373.585 4.439 20 0 FIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CCOCC1 ZINC000531724324 1108114910 /nfs/dbraw/zinc/11/49/10/1108114910.db2.gz XZZYDZIFRCMVKE-JOCHJYFZSA-N 2 0 356.510 4.206 20 0 FIADRP C[C@@H](CCCc1cccnc1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000453064685 1108116748 /nfs/dbraw/zinc/11/67/48/1108116748.db2.gz GGCSGJBVHOIGCJ-FQEVSTJZSA-N 2 0 351.538 4.295 20 0 FIADRP CCn1ccnc1[C@H](C)NCc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000453057483 1108132474 /nfs/dbraw/zinc/13/24/74/1108132474.db2.gz FJPYGPUODICHNJ-QRVBRYPASA-N 2 0 354.542 4.232 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](CC)CC1)c1ccncc1 ZINC000453102854 1108170587 /nfs/dbraw/zinc/17/05/87/1108170587.db2.gz QNQCGWBGSHIAGL-LAUBAEHRSA-N 2 0 370.516 4.165 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2sccc21 ZINC000453198629 1108267046 /nfs/dbraw/zinc/26/70/46/1108267046.db2.gz QHUUNOIGCCPYCJ-XFQXTVEOSA-N 2 0 356.535 4.043 20 0 FIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccncc2OCCC[NH+](C)C)c2sccc21 ZINC000453231169 1108306432 /nfs/dbraw/zinc/30/64/32/1108306432.db2.gz QDVHROIPFYFQFS-CRAIPNDOSA-N 2 0 359.539 4.202 20 0 FIADRP CC[C@H](COCC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453265152 1108337758 /nfs/dbraw/zinc/33/77/58/1108337758.db2.gz XHKSGOWZOVSTHT-AKHDSKFASA-N 2 0 370.459 4.129 20 0 FIADRP Cc1cnn(CCCCC[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000523612357 1108361589 /nfs/dbraw/zinc/36/15/89/1108361589.db2.gz BEVHKMQZMQETHZ-UHFFFAOYSA-N 2 0 368.569 4.206 20 0 FIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CCOC4(CCC4)C2)C3)cc1 ZINC000453326603 1108417915 /nfs/dbraw/zinc/41/79/15/1108417915.db2.gz VGOZFWJZPVQTLT-KJJMTIBFSA-N 2 0 354.538 4.121 20 0 FIADRP CC(=O)Nc1ccc(CN2CCC([NH2+]C3[C@@H](C)CCC[C@@H]3C)CC2)cc1 ZINC000453332056 1108422810 /nfs/dbraw/zinc/42/28/10/1108422810.db2.gz UUYXTEFGDLGXMF-IRXDYDNUSA-N 2 0 357.542 4.024 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@@H](c3ccco3)[NH+]3CCCCC3)CC2)C1 ZINC000531947993 1108430519 /nfs/dbraw/zinc/43/05/19/1108430519.db2.gz DCAJTNNZECYQNC-FCEUIQTBSA-N 2 0 373.585 4.439 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H](CC3CC3)c3ccccc3)cc2)CC1 ZINC000531959327 1108451507 /nfs/dbraw/zinc/45/15/07/1108451507.db2.gz RCXNHWRAPRXOHS-XMMPIXPASA-N 2 0 364.533 4.274 20 0 FIADRP C[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc2ccccc2c1 ZINC000531965309 1108461503 /nfs/dbraw/zinc/46/15/03/1108461503.db2.gz VJJRDJMNDNEXRZ-CJFMBICVSA-N 2 0 373.544 4.479 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1)C1CC1 ZINC000453386249 1108470802 /nfs/dbraw/zinc/47/08/02/1108470802.db2.gz ALBNZRZEFQTJRB-OAQYLSRUSA-N 2 0 357.929 4.483 20 0 FIADRP C[C@@H]([NH2+][C@H]1CCCN(C)c2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000453386517 1108471414 /nfs/dbraw/zinc/47/14/14/1108471414.db2.gz VETLZMGKGSNRRU-GCJKJVERSA-N 2 0 367.537 4.249 20 0 FIADRP C[N@H+](CCCC[NH2+][C@H]1CCc2c1c(Br)ccc2F)C1CC1 ZINC000453388619 1108473637 /nfs/dbraw/zinc/47/36/37/1108473637.db2.gz BTGCPFOIIDXYAI-INIZCTEOSA-N 2 0 355.295 4.040 20 0 FIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCc4c3cccc4Cl)c2)CCO1 ZINC000532207228 1108694453 /nfs/dbraw/zinc/69/44/53/1108694453.db2.gz UZUWLWGAYDECAZ-KSFYIVLOSA-N 2 0 370.924 4.338 20 0 FIADRP C[C@@H]1C[C@H]1c1ccc(CNC2CC[NH+](CCc3ccc(F)cc3)CC2)o1 ZINC000532210914 1108712335 /nfs/dbraw/zinc/71/23/35/1108712335.db2.gz DHMPQOFENDTCAJ-IIBYNOLFSA-N 2 0 356.485 4.339 20 0 FIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCCC2(C)C)c1)C1CCOCC1 ZINC000532214015 1108715147 /nfs/dbraw/zinc/71/51/47/1108715147.db2.gz NTCHXMWAWHFEAT-QFIPXVFZSA-N 2 0 374.569 4.235 20 0 FIADRP COc1ccsc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000532213369 1108715698 /nfs/dbraw/zinc/71/56/98/1108715698.db2.gz QQZLDUWLOTURIT-UHFFFAOYSA-N 2 0 356.491 4.272 20 0 FIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532225246 1108723110 /nfs/dbraw/zinc/72/31/10/1108723110.db2.gz FNIJCKKMCYYFQK-MJGOQNOKSA-N 2 0 356.485 4.397 20 0 FIADRP Cc1ccc(NC(=O)C2(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)CCCC2)cc1C ZINC000532249235 1108728097 /nfs/dbraw/zinc/72/80/97/1108728097.db2.gz ROTPBWMSZQUJSY-IRFCIJBXSA-N 2 0 371.569 4.121 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000525869925 1109547181 /nfs/dbraw/zinc/54/71/81/1109547181.db2.gz XCVPVLJGVWQTQO-QKLQHJQFSA-N 2 0 352.950 4.170 20 0 FIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447551340 1109567654 /nfs/dbraw/zinc/56/76/54/1109567654.db2.gz KGPBZHLVXOVDIQ-QGZVFWFLSA-N 2 0 372.557 4.085 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(C)o1 ZINC000447543373 1109574153 /nfs/dbraw/zinc/57/41/53/1109574153.db2.gz RXSGRZYEZGNEMS-FGTMMUONSA-N 2 0 356.510 4.356 20 0 FIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000525980849 1109580354 /nfs/dbraw/zinc/58/03/54/1109580354.db2.gz GVBYVSAIDJVJKZ-UHFFFAOYSA-N 2 0 373.491 4.052 20 0 FIADRP Brc1ccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000447567977 1109584775 /nfs/dbraw/zinc/58/47/75/1109584775.db2.gz GKHKDOBWLFTTBY-LJQANCHMSA-N 2 0 363.343 4.364 20 0 FIADRP COC1CCC(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447600252 1109599311 /nfs/dbraw/zinc/59/93/11/1109599311.db2.gz LLKQOLQPKWGKIX-YYDSYHLRSA-N 2 0 356.554 4.367 20 0 FIADRP C[C@@H](C[NH+]1CCCCCC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447608317 1109601332 /nfs/dbraw/zinc/60/13/32/1109601332.db2.gz VCHTZRKNOSJPNO-SNJCGAMXSA-N 2 0 355.570 4.036 20 0 FIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1 ZINC000508603031 1109606194 /nfs/dbraw/zinc/60/61/94/1109606194.db2.gz GUFHJMBZWZPYIB-LJQANCHMSA-N 2 0 373.566 4.013 20 0 FIADRP C[C@H](CC[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000447725030 1109634641 /nfs/dbraw/zinc/63/46/41/1109634641.db2.gz ABGBOJQVNGVVEB-OAQYLSRUSA-N 2 0 371.613 4.308 20 0 FIADRP CCN(Cc1ccnn1-c1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000448330829 1109773880 /nfs/dbraw/zinc/77/38/80/1109773880.db2.gz FUHSYQZULUUVCE-JOCHJYFZSA-N 2 0 374.532 4.216 20 0 FIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527672569 1109800655 /nfs/dbraw/zinc/80/06/55/1109800655.db2.gz AWJJYVFHJDWKCA-PABCKOPISA-N 2 0 356.554 4.070 20 0 FIADRP CC[N@H+](C)Cc1cccc(CN[C@@H](C)c2cc(-c3ccccc3)n(C)n2)c1 ZINC000527857405 1109840022 /nfs/dbraw/zinc/84/00/22/1109840022.db2.gz AUVZNBVTRAZGSC-SFHVURJKSA-N 2 0 362.521 4.390 20 0 FIADRP COc1cccc([C@H](C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)OC)c1 ZINC000527921010 1109856046 /nfs/dbraw/zinc/85/60/46/1109856046.db2.gz PPARYOWNHPMQPH-WEYGHZABSA-N 2 0 360.542 4.015 20 0 FIADRP COc1ccc([C@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cn1 ZINC000528044863 1109897388 /nfs/dbraw/zinc/89/73/88/1109897388.db2.gz VZSDJAAORDKGNB-AMHTUMDSSA-N 2 0 365.521 4.042 20 0 FIADRP Brc1cccc2c(C[NH2+]C3CC[NH+](C4CCC4)CC3)ccnc12 ZINC000449100824 1109976493 /nfs/dbraw/zinc/97/64/93/1109976493.db2.gz XQKGJIUBBREWEV-UHFFFAOYSA-N 2 0 374.326 4.104 20 0 FIADRP CSCC1CCC([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000449105445 1109976764 /nfs/dbraw/zinc/97/67/64/1109976764.db2.gz HYSNVAXHSYAKEV-UHFFFAOYSA-N 2 0 352.613 4.472 20 0 FIADRP C[C@H](c1ccccc1)[NH+]1CCC(NCc2ccnn2C2CCCC2)CC1 ZINC000449149311 1109985843 /nfs/dbraw/zinc/98/58/43/1109985843.db2.gz NGYJDAVVVCTHDL-GOSISDBHSA-N 2 0 352.526 4.313 20 0 FIADRP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000449156184 1109986992 /nfs/dbraw/zinc/98/69/92/1109986992.db2.gz CWDJVSXOEGBEPS-HXUWFJFHSA-N 2 0 364.533 4.253 20 0 FIADRP Cc1nn(C)c(C)c1C[C@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449170214 1109987871 /nfs/dbraw/zinc/98/78/71/1109987871.db2.gz FQSZCXMAIKTIPZ-INIZCTEOSA-N 2 0 362.606 4.237 20 0 FIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCOCC2CCOCC2)CC1 ZINC000449162829 1109989988 /nfs/dbraw/zinc/98/99/88/1109989988.db2.gz KEFTYBMHCJZLJX-UHFFFAOYSA-N 2 0 368.606 4.089 20 0 FIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C[C@H]4CCOC4)CC3)C2)cc1 ZINC000449164147 1109990407 /nfs/dbraw/zinc/99/04/07/1109990407.db2.gz YEADQSMEPRICCS-BLIXFSHQSA-N 2 0 362.945 4.067 20 0 FIADRP CC[S@](=O)[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449180218 1109993062 /nfs/dbraw/zinc/99/30/62/1109993062.db2.gz YWYCNBRAVGCLHS-WYEJZRMESA-N 2 0 370.647 4.335 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@H](CNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449214466 1109996908 /nfs/dbraw/zinc/99/69/08/1109996908.db2.gz WTOVJMALVMAZEM-FYYLOGMGSA-N 2 0 371.613 4.040 20 0 FIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cc(F)cc(Br)c2)cc1F ZINC000449200721 1109997947 /nfs/dbraw/zinc/99/79/47/1109997947.db2.gz FFZFRRGOOMWNHL-UHFFFAOYSA-N 2 0 369.253 4.079 20 0 FIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)CC1 ZINC000449216078 1109999505 /nfs/dbraw/zinc/99/95/05/1109999505.db2.gz ZZGSZAHLQKZQFQ-MSYGRNIXSA-N 2 0 368.565 4.019 20 0 FIADRP C[NH+]1CCC2(CCCN2Cc2ccnc3c(Br)cccc23)CC1 ZINC000449263132 1110018227 /nfs/dbraw/zinc/01/82/27/1110018227.db2.gz GVPZKWNANDFOIT-UHFFFAOYSA-N 2 0 374.326 4.058 20 0 FIADRP CC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)C1CCC1 ZINC000449342832 1110035019 /nfs/dbraw/zinc/03/50/19/1110035019.db2.gz FPURWCPKRWRPQF-VXKWHMMOSA-N 2 0 356.554 4.084 20 0 FIADRP C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000449440411 1110080543 /nfs/dbraw/zinc/08/05/43/1110080543.db2.gz ZHJBMHVCMPIKGA-QAPCUYQASA-N 2 0 363.427 4.101 20 0 FIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@H]4CCOC5(CCC5)C4)[C@H]3C2)cc1 ZINC000449478406 1110085093 /nfs/dbraw/zinc/08/50/93/1110085093.db2.gz KCKOWOICXAGURL-MLCQCVOFSA-N 2 0 368.565 4.226 20 0 FIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C2CC2)cn1 ZINC000528851344 1110132037 /nfs/dbraw/zinc/13/20/37/1110132037.db2.gz LZLYDXKIRNIXCI-QHCPKHFHSA-N 2 0 365.521 4.317 20 0 FIADRP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@H]4CCO[C@H](C)C4)CC3)C2)cc1 ZINC001168114896 1110239052 /nfs/dbraw/zinc/23/90/52/1110239052.db2.gz FLAZJRONNWRNIU-IRLDBZIGSA-N 2 0 356.554 4.241 20 0 FIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(CC[NH+](C)C)CC3)o2)cc1C ZINC000121238158 1110319302 /nfs/dbraw/zinc/31/93/02/1110319302.db2.gz BLBCUSHJAIPOCA-QGZVFWFLSA-N 2 0 356.514 4.078 20 0 FIADRP CC(=O)c1cccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000450642311 1110321941 /nfs/dbraw/zinc/32/19/41/1110321941.db2.gz IOEKSCXVPFCULC-UHFFFAOYSA-N 2 0 362.517 4.377 20 0 FIADRP CC[C@@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000538723584 1111262763 /nfs/dbraw/zinc/26/27/63/1111262763.db2.gz NOMYXARHLGRDIG-QFIPXVFZSA-N 2 0 371.613 4.308 20 0 FIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(Cl)s3)CC2)CC1 ZINC000538723969 1111274784 /nfs/dbraw/zinc/27/47/84/1111274784.db2.gz JMRKPMFCNAPIAR-UHFFFAOYSA-N 2 0 370.006 4.030 20 0 FIADRP CCCc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)C(C)C)cc1 ZINC000539215302 1111478861 /nfs/dbraw/zinc/47/88/61/1111478861.db2.gz LOQCTLNOIKTWRY-XPWALMASSA-N 2 0 358.570 4.304 20 0 FIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](CCCC4CCOCC4)C3)CC2)cc1 ZINC000552059976 1111561061 /nfs/dbraw/zinc/56/10/61/1111561061.db2.gz BGNVPZSANYVHHI-UHFFFAOYSA-N 2 0 356.554 4.181 20 0 FIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@H]4CCOC5(CCC5)C4)[C@H]3C2)cc1 ZINC000552062593 1111562973 /nfs/dbraw/zinc/56/29/73/1111562973.db2.gz AGTKBNUBJBPMJL-MLCQCVOFSA-N 2 0 368.565 4.369 20 0 FIADRP CCC[NH+]1CCC([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC1 ZINC000477859030 1111580095 /nfs/dbraw/zinc/58/00/95/1111580095.db2.gz LGROMLANCKRJCP-UHFFFAOYSA-N 2 0 354.325 4.481 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CCO[C@@H]3c3ccccc3)CC2)C1 ZINC000477927758 1111604632 /nfs/dbraw/zinc/60/46/32/1111604632.db2.gz BIMMNVMREMGHJA-KPUOSGPGSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000477930993 1111605710 /nfs/dbraw/zinc/60/57/10/1111605710.db2.gz BWUPZKQLKROGHO-OUJCMCIWSA-N 2 0 364.533 4.264 20 0 FIADRP FC(F)(F)Oc1cccc([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000552224317 1111624308 /nfs/dbraw/zinc/62/43/08/1111624308.db2.gz SPQWFENRFPKGPB-UGSOOPFHSA-N 2 0 354.416 4.110 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc(Br)cc2)CC1 ZINC000479295510 1111987577 /nfs/dbraw/zinc/98/75/77/1111987577.db2.gz LGJLDXZCBAADEO-HNNXBMFYSA-N 2 0 353.348 4.092 20 0 FIADRP COc1cccc(C[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)c1 ZINC000479441351 1112023684 /nfs/dbraw/zinc/02/36/84/1112023684.db2.gz BFFLLMVLAPRKMJ-QPPBQGQZSA-N 2 0 364.533 4.128 20 0 FIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1N(C)C ZINC000479463554 1112033322 /nfs/dbraw/zinc/03/33/22/1112033322.db2.gz IPRVUYDLNSKAJR-IEBWSBKVSA-N 2 0 355.501 4.064 20 0 FIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000479526661 1112052964 /nfs/dbraw/zinc/05/29/64/1112052964.db2.gz JYIVSAQYOGPONY-QFIPXVFZSA-N 2 0 370.924 4.074 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000479551982 1112068397 /nfs/dbraw/zinc/06/83/97/1112068397.db2.gz ARZQDXWJLMHJHT-OAQYLSRUSA-N 2 0 358.913 4.448 20 0 FIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4ccc(Cl)cc43)cc2)CC1 ZINC000479581803 1112079526 /nfs/dbraw/zinc/07/95/26/1112079526.db2.gz VAWJTWJMZLDLPU-JOCHJYFZSA-N 2 0 370.924 4.074 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000479875397 1112173559 /nfs/dbraw/zinc/17/35/59/1112173559.db2.gz QHTBCKWFIUQCRM-FCEWJHQRSA-N 2 0 372.475 4.493 20 0 FIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCO[C@@H](C(F)(F)F)C3)c2)CC1 ZINC000554072896 1112183020 /nfs/dbraw/zinc/18/30/20/1112183020.db2.gz UWSWXKUVPZIUBN-RTBURBONSA-N 2 0 370.459 4.118 20 0 FIADRP CC(C)(C)OC(=O)c1cccc(C[NH2+]Cc2ccccc2-n2ccnc2)c1 ZINC000480050124 1112253362 /nfs/dbraw/zinc/25/33/62/1112253362.db2.gz XDSVIQIRWBUQIP-UHFFFAOYSA-N 2 0 363.461 4.117 20 0 FIADRP C[N@@H+](Cc1cc2ccncc2s1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000667621093 1112285481 /nfs/dbraw/zinc/28/54/81/1112285481.db2.gz ZYCRECMJEDEBFY-SFHVURJKSA-N 2 0 351.519 4.250 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)cn1 ZINC000480162461 1112309118 /nfs/dbraw/zinc/30/91/18/1112309118.db2.gz BRJDGEWZYXAQGN-IXDOHACOSA-N 2 0 373.928 4.195 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCO[C@@H](C(F)(F)F)C2)C1 ZINC000554349379 1112311024 /nfs/dbraw/zinc/31/10/24/1112311024.db2.gz KTWBMRTYDJJZOM-ATZDWAIDSA-N 2 0 370.459 4.118 20 0 FIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000480252514 1112350472 /nfs/dbraw/zinc/35/04/72/1112350472.db2.gz USQBPFAIKWSZNE-FVJVTNMWSA-N 2 0 364.533 4.319 20 0 FIADRP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480252294 1112351558 /nfs/dbraw/zinc/35/15/58/1112351558.db2.gz JZRZNVYOBBYSEX-MRXNPFEDSA-N 2 0 357.542 4.222 20 0 FIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000480608971 1112498896 /nfs/dbraw/zinc/49/88/96/1112498896.db2.gz IJQLPHNNTZOJAP-MQSCRBSSSA-N 2 0 357.586 4.141 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)nnn1-c1ccc(C)cc1 ZINC000480615892 1112502894 /nfs/dbraw/zinc/50/28/94/1112502894.db2.gz VTHIATNWBXTJCR-MOPGFXCFSA-N 2 0 369.557 4.047 20 0 FIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000554811627 1112507188 /nfs/dbraw/zinc/50/71/88/1112507188.db2.gz MHKKEPPCVNEBHA-SBHAEUEKSA-N 2 0 356.554 4.224 20 0 FIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480630548 1112510465 /nfs/dbraw/zinc/51/04/65/1112510465.db2.gz JZGFTFADSQPVNL-CVEARBPZSA-N 2 0 352.494 4.006 20 0 FIADRP Cc1ccncc1CCC[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000554861687 1112526533 /nfs/dbraw/zinc/52/65/33/1112526533.db2.gz PFPVMNALJDWZCQ-PMACEKPBSA-N 2 0 351.538 4.069 20 0 FIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2OC ZINC000480725731 1112572575 /nfs/dbraw/zinc/57/25/75/1112572575.db2.gz GBJSCNUGGWMZLD-OAQYLSRUSA-N 2 0 368.521 4.193 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)COC3)cc1 ZINC000480727966 1112573143 /nfs/dbraw/zinc/57/31/43/1112573143.db2.gz KRGGOCKJZXIALT-GOSISDBHSA-N 2 0 368.521 4.288 20 0 FIADRP Cc1ccsc1[C@@H](C)[NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000480782768 1112595538 /nfs/dbraw/zinc/59/55/38/1112595538.db2.gz XTIPIWJXZSJJMV-QUCCMNQESA-N 2 0 357.567 4.086 20 0 FIADRP CC(C)[N@@H+](C)C[C@@H](C)NC(=O)Nc1ccccc1C[NH+](C)C1CCCCC1 ZINC000554967109 1112597967 /nfs/dbraw/zinc/59/79/67/1112597967.db2.gz MRCVSZOAAFABSK-GOSISDBHSA-N 2 0 374.573 4.301 20 0 FIADRP Cc1nc(COc2ccc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)cc2)cs1 ZINC000480931028 1112678869 /nfs/dbraw/zinc/67/88/69/1112678869.db2.gz FMPDGKXEJRPHEZ-UHFFFAOYSA-N 2 0 373.566 4.242 20 0 FIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CCCO2 ZINC000481343371 1112907253 /nfs/dbraw/zinc/90/72/53/1112907253.db2.gz WCWVDTQJJIMZAF-QFIPXVFZSA-N 2 0 368.521 4.247 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC(CC)([NH+]3CCC3)CC2)cc1)C(C)C ZINC000899562467 1112908804 /nfs/dbraw/zinc/90/88/04/1112908804.db2.gz UJSMSFKDLDOMMQ-UHFFFAOYSA-N 2 0 371.569 4.007 20 0 FIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)[C@@H](C)C1 ZINC000481421637 1112938062 /nfs/dbraw/zinc/93/80/62/1112938062.db2.gz IYXVJBXQOZCBCD-HRAATJIYSA-N 2 0 357.542 4.011 20 0 FIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCOc4ccccc43)CC2)c1 ZINC000481731677 1113058887 /nfs/dbraw/zinc/05/88/87/1113058887.db2.gz WASKFBJFWHRHLM-HXUWFJFHSA-N 2 0 356.535 4.464 20 0 FIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000481720335 1113060885 /nfs/dbraw/zinc/06/08/85/1113060885.db2.gz FJJYABIYXBYBFN-DRSNIGMVSA-N 2 0 350.506 4.107 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481917908 1113131810 /nfs/dbraw/zinc/13/18/10/1113131810.db2.gz PJLLACWABMNGHZ-XMMPIXPASA-N 2 0 366.549 4.451 20 0 FIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+](C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481957480 1113140859 /nfs/dbraw/zinc/14/08/59/1113140859.db2.gz LWNJHZSETFUZGW-ZDUSSCGKSA-N 2 0 369.340 4.480 20 0 FIADRP COc1ccccc1C1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000482117623 1113174324 /nfs/dbraw/zinc/17/43/24/1113174324.db2.gz AIJLJPXTNFNWGG-KNQAVFIVSA-N 2 0 364.533 4.227 20 0 FIADRP c1ccc(C[NH+]2CCC(C[NH2+]CCCc3ccc4c(c3)CCO4)CC2)cc1 ZINC000482230528 1113204627 /nfs/dbraw/zinc/20/46/27/1113204627.db2.gz SFVCLFGRUNXRJQ-UHFFFAOYSA-N 2 0 364.533 4.056 20 0 FIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H]1CCCc2cccnc21 ZINC000482280009 1113215922 /nfs/dbraw/zinc/21/59/22/1113215922.db2.gz FZIWRHZTFIHHAL-OAQYLSRUSA-N 2 0 361.493 4.260 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c32)[C@H](C)C1 ZINC000482334316 1113227969 /nfs/dbraw/zinc/22/79/69/1113227969.db2.gz NSAZRZFUJIJXDC-VGSWGCGISA-N 2 0 371.569 4.320 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000162926955 1113250223 /nfs/dbraw/zinc/25/02/23/1113250223.db2.gz BVQSALOFNOVEES-IBGZPJMESA-N 3 0 360.505 4.319 20 0 FIADRP CCC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482458900 1113267177 /nfs/dbraw/zinc/26/71/77/1113267177.db2.gz AZMGNYNJFGKUGV-KXBFYZLASA-N 2 0 372.384 4.308 20 0 FIADRP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)cc1Cl ZINC000482519352 1113282613 /nfs/dbraw/zinc/28/26/13/1113282613.db2.gz NHNAGLWEJVAHSI-HNAYVOBHSA-N 2 0 372.384 4.308 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OC)c(Br)c2)CC1 ZINC000482519298 1113282793 /nfs/dbraw/zinc/28/27/93/1113282793.db2.gz MMCCLMCENNYADW-CQSZACIVSA-N 2 0 369.347 4.230 20 0 FIADRP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482514664 1113284916 /nfs/dbraw/zinc/28/49/16/1113284916.db2.gz ZVLIWTUODPERRR-BEFAXECRSA-N 2 0 372.384 4.308 20 0 FIADRP CCC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCC1 ZINC000482553716 1113292628 /nfs/dbraw/zinc/29/26/28/1113292628.db2.gz KBOBUVGSRBMPOU-HSZRJFAPSA-N 2 0 358.570 4.482 20 0 FIADRP CC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc2cc(OC)ccc2c1 ZINC000482867868 1113381251 /nfs/dbraw/zinc/38/12/51/1113381251.db2.gz PBFAQYQXUBVXSR-GGAORHGYSA-N 2 0 370.537 4.126 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000482870160 1113384184 /nfs/dbraw/zinc/38/41/84/1113384184.db2.gz DPGZVXAJSHFIKH-SFHVURJKSA-N 2 0 366.505 4.042 20 0 FIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C3CCC4(CC4)CC3)CC2)cc1 ZINC000486713535 1113627939 /nfs/dbraw/zinc/62/79/39/1113627939.db2.gz ZVSZKEVYHVMNKE-UHFFFAOYSA-N 2 0 356.554 4.370 20 0 FIADRP Clc1ccc(C2=CC[C@H]([NH2+]C3CCN([C@@H]4CCOC4)CC3)CC2)cc1 ZINC000668693818 1113658571 /nfs/dbraw/zinc/65/85/71/1113658571.db2.gz WEOAMXRWAKXCAT-PZJWPPBQSA-N 2 0 360.929 4.119 20 0 FIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c1 ZINC000488045256 1113846164 /nfs/dbraw/zinc/84/61/64/1113846164.db2.gz ILBQSSFGQOFPKJ-BHDDXSALSA-N 2 0 354.538 4.110 20 0 FIADRP Cn1ccnc1C[C@H]1CCC[N@H+](CCc2cc(Cl)ccc2Cl)C1 ZINC000488135390 1113860772 /nfs/dbraw/zinc/86/07/72/1113860772.db2.gz DLCKVKNPBNOMCC-CQSZACIVSA-N 2 0 352.309 4.224 20 0 FIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)cc1 ZINC000488422969 1113925533 /nfs/dbraw/zinc/92/55/33/1113925533.db2.gz AMALYJZDOHFKID-HKUYNNGSSA-N 2 0 350.572 4.027 20 0 FIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)CC1 ZINC000490167618 1114228284 /nfs/dbraw/zinc/22/82/84/1114228284.db2.gz LKKJWONOYZQLAN-URXFXBBRSA-N 2 0 365.565 4.008 20 0 FIADRP c1ccc(CCOCCC[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491059835 1114368704 /nfs/dbraw/zinc/36/87/04/1114368704.db2.gz JLTQSXRSUBAZCM-QHCPKHFHSA-N 2 0 358.570 4.224 20 0 FIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000570964756 1114418888 /nfs/dbraw/zinc/41/88/88/1114418888.db2.gz ARYQTRIFOHPKHX-SBUREZEXSA-N 2 0 350.506 4.498 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2Oc2cccnc2)CC1 ZINC000590786882 1114973906 /nfs/dbraw/zinc/97/39/06/1114973906.db2.gz IGPFYYFVMNYTLP-UHFFFAOYSA-N 2 0 353.510 4.426 20 0 FIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2cc(Cl)ccc2Cl)CC1 ZINC000590786601 1114974544 /nfs/dbraw/zinc/97/45/44/1114974544.db2.gz HKPBIOFSKFQIHJ-UHFFFAOYSA-N 2 0 359.341 4.424 20 0 FIADRP Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000573345145 1115092609 /nfs/dbraw/zinc/09/26/09/1115092609.db2.gz VGYPNHNBKAVLQU-QGZVFWFLSA-N 2 0 365.949 4.221 20 0 FIADRP C[C@H]([NH3+])C1CC[NH+](Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000573444649 1115103097 /nfs/dbraw/zinc/10/30/97/1115103097.db2.gz HKUFGHOLGBBLKM-ZDUSSCGKSA-N 2 0 374.941 4.275 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCC(O)(c4ccccc4)CC3)CC2)C1 ZINC000760908724 1115170403 /nfs/dbraw/zinc/17/04/03/1115170403.db2.gz QJCPUEOEEOVRHB-VCERZCPPSA-N 2 0 370.581 4.450 20 0 FIADRP CC[NH+]1CCC(C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000574136242 1115292240 /nfs/dbraw/zinc/29/22/40/1115292240.db2.gz ZCJNSRGAUNPGOQ-NRFANRHFSA-N 2 0 357.929 4.340 20 0 FIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cn1 ZINC000498423817 1115335568 /nfs/dbraw/zinc/33/55/68/1115335568.db2.gz PVRAOYIWYSZKAD-OAQYLSRUSA-N 2 0 359.489 4.038 20 0 FIADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)[C@@H]1C[C@H](C(=O)OC(C)(C)C)C1(C)C ZINC000594519092 1115458696 /nfs/dbraw/zinc/45/86/96/1115458696.db2.gz CWLNHVIVNMEVMO-BPQIPLTHSA-N 2 0 366.590 4.231 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(Br)cn1 ZINC000574811640 1115497152 /nfs/dbraw/zinc/49/71/52/1115497152.db2.gz LSQUIZZYCPZDLZ-CABCVRRESA-N 2 0 354.336 4.007 20 0 FIADRP COC(=O)c1oc(CNCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1C ZINC000597050434 1115638138 /nfs/dbraw/zinc/63/81/38/1115638138.db2.gz NHUNJWQUDMLXPR-QGZVFWFLSA-N 2 0 370.493 4.039 20 0 FIADRP COc1c(C)cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1C ZINC000060952450 1115736960 /nfs/dbraw/zinc/73/69/60/1115736960.db2.gz GFIQKCAJVYPNFS-UHFFFAOYSA-N 2 0 358.551 4.375 20 0 FIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)[C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416103 1115841876 /nfs/dbraw/zinc/84/18/76/1115841876.db2.gz GEZQFFOPNKVQOT-VABKMULXSA-N 2 0 352.497 4.455 20 0 FIADRP C[C@H]1C[NH+](CC2CC[NH+](CCCc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000607151515 1116003533 /nfs/dbraw/zinc/00/35/33/1116003533.db2.gz RFXLSMKKRVYXPV-ROUUACIJSA-N 2 0 364.961 4.094 20 0 FIADRP Cc1ccccc1O[C@H](C)C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000608065441 1116080726 /nfs/dbraw/zinc/08/07/26/1116080726.db2.gz QICOWEYXDIVRJG-HXUWFJFHSA-N 2 0 368.521 4.027 20 0 FIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000534332158 1116185500 /nfs/dbraw/zinc/18/55/00/1116185500.db2.gz PZJUGXQSZQCIEH-QHCPKHFHSA-N 2 0 374.569 4.188 20 0 FIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)c(F)c1 ZINC000534331539 1116185502 /nfs/dbraw/zinc/18/55/02/1116185502.db2.gz NSJXESXZGIXDHJ-AWEZNQCLSA-N 2 0 350.865 4.270 20 0 FIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1Br ZINC000535082660 1116265803 /nfs/dbraw/zinc/26/58/03/1116265803.db2.gz ACMFAKLJKBJPHB-UHFFFAOYSA-N 2 0 369.347 4.010 20 0 FIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Oc3cccnc3)c(C)c2)[C@@H](C)C1 ZINC000539819625 1116385013 /nfs/dbraw/zinc/38/50/13/1116385013.db2.gz NXXBEJFDHWZQLB-GHTZIAJQSA-N 2 0 353.510 4.344 20 0 FIADRP Fc1ccc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000539821217 1116385768 /nfs/dbraw/zinc/38/57/68/1116385768.db2.gz YYJPTFLSAYZNSO-UHFFFAOYSA-N 2 0 372.484 4.163 20 0 FIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(C(C)(C)C)cc2)(N2CCCCC2)CC1 ZINC000462733461 1117740893 /nfs/dbraw/zinc/74/08/93/1117740893.db2.gz DHVCYPYSNSGJPA-UHFFFAOYSA-N 2 0 357.586 4.024 20 0 FIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(Br)cc2Cl)CC1 ZINC000462744182 1117747836 /nfs/dbraw/zinc/74/78/36/1117747836.db2.gz KCVGSBQHMKBFKM-UHFFFAOYSA-N 2 0 359.739 4.314 20 0 FIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(OC)c2OC)CC1)CC1CC1 ZINC000539957593 1117775592 /nfs/dbraw/zinc/77/55/92/1117775592.db2.gz XZSPHPAJKGHBAL-UHFFFAOYSA-N 2 0 360.542 4.038 20 0 FIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC000462799311 1117783973 /nfs/dbraw/zinc/78/39/73/1117783973.db2.gz SNIXWHXBTLJJSQ-BHDDXSALSA-N 2 0 374.569 4.092 20 0 FIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@@]2(C)CCOC2)c2ccc(F)cc2)CC1 ZINC000462802369 1117785896 /nfs/dbraw/zinc/78/58/96/1117785896.db2.gz LCPUUVLMNPXQLF-FGZHOGPDSA-N 2 0 362.533 4.395 20 0 FIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000462803692 1117787272 /nfs/dbraw/zinc/78/72/72/1117787272.db2.gz CDYRIXNRZRDHLD-UGKGYDQZSA-N 2 0 362.533 4.395 20 0 FIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)CC1 ZINC000462815745 1117793168 /nfs/dbraw/zinc/79/31/68/1117793168.db2.gz JHSLLNQXSAHNAH-SFHVURJKSA-N 2 0 371.569 4.315 20 0 FIADRP CC[N@H+](CCC1CC[NH+](CC(=O)Nc2cc(C)ccc2C)CC1)CC1CC1 ZINC000540049154 1117830674 /nfs/dbraw/zinc/83/06/74/1117830674.db2.gz GJRUTSJSWYTRFC-UHFFFAOYSA-N 2 0 371.569 4.076 20 0 FIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](c3ccccc3)[C@@H]3CCOC3)CC2)C1 ZINC000540137165 1117900919 /nfs/dbraw/zinc/90/09/19/1117900919.db2.gz MJODXAQUWYHMDD-SQMBMXPBSA-N 2 0 356.554 4.397 20 0 FIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(OCC(F)F)c1 ZINC000540176637 1117916409 /nfs/dbraw/zinc/91/64/09/1117916409.db2.gz UJBNWNPVRJSSTO-UWJYYQICSA-N 2 0 374.475 4.331 20 0 FIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000540262178 1117962437 /nfs/dbraw/zinc/96/24/37/1117962437.db2.gz GMXYUXYROXNBLD-RDTXWAMCSA-N 2 0 351.332 4.222 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000463112717 1117970159 /nfs/dbraw/zinc/97/01/59/1117970159.db2.gz VVCJLCHTYWBIPV-YKSBVNFPSA-N 2 0 365.565 4.281 20 0 FIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463112716 1117970447 /nfs/dbraw/zinc/97/04/47/1117970447.db2.gz VVCJLCHTYWBIPV-RDPSFJRHSA-N 2 0 365.565 4.281 20 0 FIADRP CC(C)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(C(F)(F)F)cc1 ZINC000540301464 1117976499 /nfs/dbraw/zinc/97/64/99/1117976499.db2.gz ZRUQXZBZZNPQEN-OALUTQOASA-N 2 0 372.475 4.229 20 0 FIADRP COc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)C2CC2)cc1 ZINC000540302003 1117976798 /nfs/dbraw/zinc/97/67/98/1117976798.db2.gz MHHQNCUBVRHZEM-RDPSFJRHSA-N 2 0 364.533 4.301 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000463145410 1117982324 /nfs/dbraw/zinc/98/23/24/1117982324.db2.gz YGOMXRJBCSZDDK-SFHVURJKSA-N 2 0 363.977 4.159 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]C2CCN(CCc3ccccc3)CC2)C1 ZINC000463138803 1117986655 /nfs/dbraw/zinc/98/66/55/1117986655.db2.gz QNHXXXICBDOJMF-SZPZYZBQSA-N 2 0 371.613 4.041 20 0 FIADRP COc1cccc([C@H](C)[NH2+]CC[C@@H](C)[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000540327444 1117994233 /nfs/dbraw/zinc/99/42/33/1117994233.db2.gz CXUYHYLSAQDUQQ-SQNIBIBYSA-N 2 0 356.510 4.484 20 0 FIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000540419298 1118045516 /nfs/dbraw/zinc/04/55/16/1118045516.db2.gz WFINIWQLHAMGEQ-IGCXYCKISA-N 2 0 369.372 4.163 20 0 FIADRP CCc1nc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1C ZINC000463297183 1118079555 /nfs/dbraw/zinc/07/95/55/1118079555.db2.gz JIWGDMBZOBABLS-IHWFROFDSA-N 2 0 369.578 4.342 20 0 FIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000540596741 1118140363 /nfs/dbraw/zinc/14/03/63/1118140363.db2.gz GYIQURGYHTUKIW-SFHVURJKSA-N 2 0 365.521 4.264 20 0 FIADRP CCN1CCC([NH2+][C@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540778304 1118240958 /nfs/dbraw/zinc/24/09/58/1118240958.db2.gz HWGASQFLBXCVKT-VQTJNVASSA-N 2 0 367.940 4.077 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1C(C)(C)C ZINC000540989828 1118339860 /nfs/dbraw/zinc/33/98/60/1118339860.db2.gz XEKBIARIFZMRBR-WIYYLYMNSA-N 2 0 366.549 4.402 20 0 FIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2cnccn2)CC1 ZINC000541543213 1118548229 /nfs/dbraw/zinc/54/82/29/1118548229.db2.gz XNEGZGJOUKOQQY-QFIPXVFZSA-N 2 0 370.516 4.053 20 0 FIADRP CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000541533902 1118553228 /nfs/dbraw/zinc/55/32/28/1118553228.db2.gz HKNBYTWHGNCZFY-JOCHJYFZSA-N 2 0 362.477 4.312 20 0 FIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC(=O)Nc2ccccc21 ZINC000541550170 1118559465 /nfs/dbraw/zinc/55/94/65/1118559465.db2.gz XRIADRUQMXIYHW-HXUWFJFHSA-N 2 0 351.494 4.092 20 0 FIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000541663170 1118596437 /nfs/dbraw/zinc/59/64/37/1118596437.db2.gz YJTOGSRGKKASSZ-FQEVSTJZSA-N 2 0 357.586 4.221 20 0 FIADRP C[N@H+](CCCOc1ccc(F)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464839305 1118708736 /nfs/dbraw/zinc/70/87/36/1118708736.db2.gz QLQDZHUMIVTMIC-HXUWFJFHSA-N 2 0 356.485 4.049 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1OC ZINC000173365655 1119035649 /nfs/dbraw/zinc/03/56/49/1119035649.db2.gz AUQWDVUSQNBXQX-MRXNPFEDSA-N 2 0 374.550 4.328 20 0 FIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492598589 1119141348 /nfs/dbraw/zinc/14/13/48/1119141348.db2.gz AYVPPUHJHVWOHV-GMAHTHKFSA-N 3 0 357.586 4.143 20 0 FIADRP Cc1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(-c2cnn(C)c2)c1 ZINC000669988636 1119328426 /nfs/dbraw/zinc/32/84/26/1119328426.db2.gz LLZHGZQGWGNCHD-WOJBJXKFSA-N 2 0 368.569 4.243 20 0 FIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000542464850 1119338858 /nfs/dbraw/zinc/33/88/58/1119338858.db2.gz LYGFYHVOCKXAJJ-VFNWGFHPSA-N 2 0 350.441 4.298 20 0 FIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc([S@](C)=O)cc1 ZINC000178012377 1119364886 /nfs/dbraw/zinc/36/48/86/1119364886.db2.gz OZBWDWNTKLUOQQ-NSYGIPOTSA-N 2 0 358.551 4.115 20 0 FIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311890645 1119393780 /nfs/dbraw/zinc/39/37/80/1119393780.db2.gz DEAUDQNNPMULBG-AUSIDOKSSA-N 2 0 350.506 4.184 20 0 FIADRP Cc1nc2c(s1)[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000178635511 1119399383 /nfs/dbraw/zinc/39/93/83/1119399383.db2.gz HCXZYGMKFSLYAX-LJQANCHMSA-N 2 0 355.551 4.331 20 0 FIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccnn1-c1ccccc1 ZINC000467314597 1119424699 /nfs/dbraw/zinc/42/46/99/1119424699.db2.gz WVAQOHOIGFBHBR-IBGZPJMESA-N 2 0 360.505 4.319 20 0 FIADRP Brc1ccc(C2CC([NH2+]C3CC[NH+](C4CCC4)CC3)C2)cc1 ZINC000493893545 1119506745 /nfs/dbraw/zinc/50/67/45/1119506745.db2.gz HERNUGCIDCVAEO-UHFFFAOYSA-N 2 0 363.343 4.302 20 0 FIADRP c1cc(C[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000493900903 1119508339 /nfs/dbraw/zinc/50/83/39/1119508339.db2.gz POVPIMNVMKTXSM-BHIFYINESA-N 2 0 354.538 4.110 20 0 FIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000493945783 1119513794 /nfs/dbraw/zinc/51/37/94/1119513794.db2.gz ULCNBIHWQLDSFI-NXVRBGIVSA-N 2 0 351.332 4.017 20 0 FIADRP CC[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000186574451 1119736849 /nfs/dbraw/zinc/73/68/49/1119736849.db2.gz DCWIVDKBNKKGRN-KBXCAEBGSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000186574115 1119737000 /nfs/dbraw/zinc/73/70/00/1119737000.db2.gz STIFEHJBHNKHCK-UXHICEINSA-N 2 0 367.537 4.156 20 0 FIADRP CC[C@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)cc1Cl ZINC000186574473 1119737098 /nfs/dbraw/zinc/73/70/98/1119737098.db2.gz DCWIVDKBNKKGRN-KDOFPFPSSA-N 2 0 358.357 4.060 20 0 FIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000186594455 1119738866 /nfs/dbraw/zinc/73/88/66/1119738866.db2.gz MBBCBSJLJGKBQF-UXHICEINSA-N 2 0 351.538 4.030 20 0 FIADRP COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cn(-c3cc[nH+]cc3)nc1C)[C@H]2C ZINC000542485524 1119932893 /nfs/dbraw/zinc/93/28/93/1119932893.db2.gz POURVGZGJQXGKM-RDJZCZTQSA-N 2 0 362.477 4.092 20 0 FIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000191556898 1119984097 /nfs/dbraw/zinc/98/40/97/1119984097.db2.gz BIIMEPXRATYGIN-OAHLLOKOSA-N 2 0 358.357 4.060 20 0 FIADRP CC(C)[NH+]1CCN(CCC[N@H+](C)C2c3ccccc3-c3ccccc32)CC1 ZINC000191580774 1119985512 /nfs/dbraw/zinc/98/55/12/1119985512.db2.gz KJZCJBVHRCJPTH-UHFFFAOYSA-N 2 0 363.549 4.104 20 0 FIADRP CC[C@@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000192727639 1120078563 /nfs/dbraw/zinc/07/85/63/1120078563.db2.gz JZJUYAZFAHHKKK-XZOQPEGZSA-N 2 0 357.586 4.061 20 0 FIADRP Fc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OC(F)F ZINC000192934821 1120091541 /nfs/dbraw/zinc/09/15/41/1120091541.db2.gz KOZVYPPTYQGFLC-KRWDZBQOSA-N 2 0 364.411 4.039 20 0 FIADRP c1coc(-c2ncc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)s2)c1 ZINC000193045104 1120096324 /nfs/dbraw/zinc/09/63/24/1120096324.db2.gz BOBUWSHHXXLDAS-UHFFFAOYSA-N 2 0 367.518 4.405 20 0 FIADRP C[C@H]([NH2+]CCOc1ccc(C(F)(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542532752 1120428278 /nfs/dbraw/zinc/42/82/78/1120428278.db2.gz PTCHHTCADZOSSH-HOTGVXAUSA-N 2 0 370.459 4.327 20 0 FIADRP C[C@@H]([NH2+]CCCOc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534267 1120436029 /nfs/dbraw/zinc/43/60/29/1120436029.db2.gz RNHNTTUBGLLMTL-SJORKVTESA-N 2 0 350.934 4.352 20 0 FIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495078426 1120462684 /nfs/dbraw/zinc/46/26/84/1120462684.db2.gz JMZBTEOXUNTOKI-WMZHIEFXSA-N 2 0 357.586 4.090 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495431940 1120816738 /nfs/dbraw/zinc/81/67/38/1120816738.db2.gz GALCVQMOGDVRFX-MZKRTTBSSA-N 2 0 374.532 4.434 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495443817 1120818097 /nfs/dbraw/zinc/81/80/97/1120818097.db2.gz FHZXCRXAFPTHML-URVUXULASA-N 2 0 374.532 4.434 20 0 FIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)Cc1ccc(Br)cc1 ZINC000233449362 1120864965 /nfs/dbraw/zinc/86/49/65/1120864965.db2.gz NMCUOZCKLJDDPB-JKSUJKDBSA-N 2 0 355.364 4.480 20 0 FIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc(Br)ncc1F ZINC000762738588 1120956993 /nfs/dbraw/zinc/95/69/93/1120956993.db2.gz UWSCJGLFGBPKQJ-KBPBESRZSA-N 2 0 372.326 4.146 20 0 FIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000236870691 1120970709 /nfs/dbraw/zinc/97/07/09/1120970709.db2.gz MOJJSHHXNIZAPX-NRFANRHFSA-N 2 0 374.532 4.030 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000155083750 1121179088 /nfs/dbraw/zinc/17/90/88/1121179088.db2.gz NSLMHZIZAIDTDU-MSOLQXFVSA-N 2 0 365.521 4.320 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000397543411 1121214894 /nfs/dbraw/zinc/21/48/94/1121214894.db2.gz CLYQXUONXGWQKT-KRWDZBQOSA-N 2 0 358.913 4.018 20 0 FIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000397553638 1121217729 /nfs/dbraw/zinc/21/77/29/1121217729.db2.gz HOAKBPWRJZEREL-QGZVFWFLSA-N 2 0 356.485 4.397 20 0 FIADRP CCC[NH+]1CCC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000155197820 1121220807 /nfs/dbraw/zinc/22/08/07/1121220807.db2.gz ICGLOPPAHYQVAQ-UHFFFAOYSA-N 3 0 363.977 4.016 20 0 FIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1Cl ZINC000397562847 1121222427 /nfs/dbraw/zinc/22/24/27/1121222427.db2.gz YTIMCHXBQSIIER-KRWDZBQOSA-N 2 0 358.913 4.018 20 0 FIADRP Brc1cccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000166263138 1121468037 /nfs/dbraw/zinc/46/80/37/1121468037.db2.gz CQFCYXARNQDGNX-QZTJIDSGSA-N 2 0 363.343 4.087 20 0 FIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cccc4ccccc43)cc2)CC1 ZINC000061070099 1121506875 /nfs/dbraw/zinc/50/68/75/1121506875.db2.gz NDRIDUKKEAZAAT-UHFFFAOYSA-N 2 0 373.544 4.267 20 0 FIADRP CC(C)[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000037506728 1121580211 /nfs/dbraw/zinc/58/02/11/1121580211.db2.gz KGMJDVMNQJANAS-UHFFFAOYSA-N 2 0 351.332 4.158 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[C@H]2CCC[C@H]21 ZINC000671740216 1121643075 /nfs/dbraw/zinc/64/30/75/1121643075.db2.gz TXSPYKUIHGZFPZ-ULXLPNHUSA-N 2 0 372.397 4.358 20 0 FIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc2[nH]c(=O)oc2c1 ZINC000671744585 1121649530 /nfs/dbraw/zinc/64/95/30/1121649530.db2.gz NMBVCNQCXCYIOX-FUHWJXTLSA-N 2 0 365.477 4.096 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1(C)C ZINC001649090727 1121717389 /nfs/dbraw/zinc/71/73/89/1121717389.db2.gz KKKUSNTUEOQRGJ-QHCPKHFHSA-N 3 0 371.613 4.184 20 0 FIADRP C[N@H+](Cc1cc(Br)cc(C(F)(F)F)c1)C1CCC([NH3+])CC1 ZINC000843055951 1121723687 /nfs/dbraw/zinc/72/36/87/1121723687.db2.gz SPNMCTGDCUHYAN-UHFFFAOYSA-N 2 0 365.237 4.170 20 0 FIADRP CN1Cc2ccccc2[C@H]([NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)C1 ZINC000671754173 1121749834 /nfs/dbraw/zinc/74/98/34/1121749834.db2.gz CCCBZDNZYSSASE-UBVWURDFSA-N 2 0 363.549 4.206 20 0 FIADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCN2Cc2cccc(Cl)c2)CC1(C)C ZINC001649095861 1121755012 /nfs/dbraw/zinc/75/50/12/1121755012.db2.gz IBWWOABDZNRWBG-PMACEKPBSA-N 2 0 363.977 4.157 20 0 FIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](CCCOC)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000671764652 1121798553 /nfs/dbraw/zinc/79/85/53/1121798553.db2.gz POEHMTIZTAIABC-HQRMLTQVSA-N 2 0 352.950 4.170 20 0 FIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000126375118 1121950268 /nfs/dbraw/zinc/95/02/68/1121950268.db2.gz IVANUDCCIXMUNA-QGZVFWFLSA-N 2 0 359.514 4.258 20 0 FIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCO[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001168608274 1121970619 /nfs/dbraw/zinc/97/06/19/1121970619.db2.gz CRNDTMNGIZNDQI-KNQAVFIVSA-N 2 0 360.542 4.158 20 0 FIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)s1 ZINC000126662289 1121973660 /nfs/dbraw/zinc/97/36/60/1121973660.db2.gz NJQASEZGNJWDAH-JKSUJKDBSA-N 2 0 361.530 4.359 20 0 FIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(F)c1 ZINC000126744144 1121982743 /nfs/dbraw/zinc/98/27/43/1121982743.db2.gz MLOQGIRBDDHFIV-CVEARBPZSA-N 2 0 359.464 4.128 20 0 FIADRP C[NH+]1CCC2(CC[N@H+](Cc3c(Cl)cccc3Br)C2)CC1 ZINC001137815220 1121988579 /nfs/dbraw/zinc/98/85/79/1121988579.db2.gz CCRGOJGFNGANNE-UHFFFAOYSA-N 2 0 357.723 4.020 20 0 FIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3)cc2)C1 ZINC000917006689 1121999236 /nfs/dbraw/zinc/99/92/36/1121999236.db2.gz UMMWCNVMQCAUPH-PMAPCBKXSA-N 2 0 370.512 4.127 20 0 FIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cc(F)ccc3F)cc2)C1 ZINC000917007718 1121999673 /nfs/dbraw/zinc/99/96/73/1121999673.db2.gz AUISTQCXZGVBRZ-ZHRRBRCNSA-N 2 0 374.475 4.020 20 0 FIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)cc2F)cc1 ZINC000917008227 1122000254 /nfs/dbraw/zinc/00/02/54/1122000254.db2.gz HKXZEZNXUSBREA-KSFYIVLOSA-N 2 0 374.475 4.162 20 0 FIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3F)cc2)C1 ZINC000917009117 1122001425 /nfs/dbraw/zinc/00/14/25/1122001425.db2.gz XXUBUMVOUICRDY-AOMKIAJQSA-N 2 0 374.475 4.020 20 0 FIADRP COc1ccc(OC(F)F)c(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000497291875 1122004423 /nfs/dbraw/zinc/00/44/23/1122004423.db2.gz FLWWNOPHNREKOP-HZPDHXFCSA-N 2 0 370.484 4.144 20 0 FIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000066594205 1122077747 /nfs/dbraw/zinc/07/77/47/1122077747.db2.gz CTJWJCCUUIJQNS-MRXNPFEDSA-N 2 0 374.960 4.390 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)CCO2)cc1 ZINC001168617147 1122126149 /nfs/dbraw/zinc/12/61/49/1122126149.db2.gz SZMKVYOQLUCYSZ-FYYLOGMGSA-N 2 0 372.553 4.017 20 0 FIADRP CC1CC[NH+](C2CCC([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)CC1 ZINC000090775379 1122131637 /nfs/dbraw/zinc/13/16/37/1122131637.db2.gz LTVRRAAGGCTIDJ-UHFFFAOYSA-N 3 0 361.618 4.416 20 0 FIADRP C[C@H](C[NH2+][C@H](C)c1ccc(SC2CCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127833711 1122152251 /nfs/dbraw/zinc/15/22/51/1122152251.db2.gz NOJQRGFLZIUHSU-QZTJIDSGSA-N 2 0 361.599 4.008 20 0 FIADRP COc1ccc([C@@H]2C[C@H]([NH2+]CC3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168618148 1122155072 /nfs/dbraw/zinc/15/50/72/1122155072.db2.gz WPRWWVFAFPZVFT-IRLDBZIGSA-N 2 0 374.569 4.263 20 0 FIADRP COc1ccc([C@H]2C[C@H]([NH2+]CC3CC[NH+](CC(C)(C)C)CC3)CCO2)cc1 ZINC001168618147 1122155732 /nfs/dbraw/zinc/15/57/32/1122155732.db2.gz WPRWWVFAFPZVFT-IFMALSPDSA-N 2 0 374.569 4.263 20 0 FIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCO[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001168630605 1122217399 /nfs/dbraw/zinc/21/73/99/1122217399.db2.gz QODCVAMIOVCXGE-NXLVEIQXSA-N 2 0 360.542 4.158 20 0 FIADRP CC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000128292890 1122226640 /nfs/dbraw/zinc/22/66/40/1122226640.db2.gz NXRXRSZAGUXMQR-GOSISDBHSA-N 2 0 358.357 4.062 20 0 FIADRP C[C@@H](C[NH2+]Cc1c(-c2ccccc2)nc2sccn12)C[NH+]1CCCCC1 ZINC000917436177 1122303194 /nfs/dbraw/zinc/30/31/94/1122303194.db2.gz BHMBMNFYQDDBQK-KRWDZBQOSA-N 2 0 368.550 4.274 20 0 FIADRP COc1cccc(N2CCC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000128745316 1122396263 /nfs/dbraw/zinc/39/62/63/1122396263.db2.gz TYEYEKJAKTVWIT-HXUWFJFHSA-N 2 0 371.569 4.051 20 0 FIADRP Cc1ccc([C@@H]([NH3+])C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000262667436 1122417934 /nfs/dbraw/zinc/41/79/34/1122417934.db2.gz QBYYGOJFTAELNE-OAQYLSRUSA-N 2 0 351.494 4.010 20 0 FIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)C1 ZINC000556059636 1122628906 /nfs/dbraw/zinc/62/89/06/1122628906.db2.gz UMBYBLSCYIMBPV-SKWRMQMOSA-N 2 0 357.586 4.170 20 0 FIADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556232850 1122749550 /nfs/dbraw/zinc/74/95/50/1122749550.db2.gz LGNIDBIDOUUSCD-VSKRKVRLSA-N 2 0 356.554 4.084 20 0 FIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@@H]3C3CC3)C3(C2)CCOCC3)cc1 ZINC000556233543 1122751535 /nfs/dbraw/zinc/75/15/35/1122751535.db2.gz QJHWRGCRBSRDQZ-YTFSRNRJSA-N 2 0 368.565 4.084 20 0 FIADRP Cc1nccn1CC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000556237257 1122754430 /nfs/dbraw/zinc/75/44/30/1122754430.db2.gz BSQIKTJAEZGEFC-QFIPXVFZSA-N 2 0 372.532 4.174 20 0 FIADRP CSc1ccc([C@H](CNC2CC[NH+](C3CCCC3)CC2)[NH+](C)C)cc1 ZINC000556259525 1122769839 /nfs/dbraw/zinc/76/98/39/1122769839.db2.gz CPRQQOHFECHGMB-NRFANRHFSA-N 2 0 361.599 4.008 20 0 FIADRP C[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCC[C@H]1C ZINC000499148767 1123293574 /nfs/dbraw/zinc/29/35/74/1123293574.db2.gz DOJJNUPSXXVEJD-UAAMJZOTSA-N 2 0 355.570 4.035 20 0 FIADRP C[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+]1CCCC[C@H]1C ZINC000499148763 1123293600 /nfs/dbraw/zinc/29/36/00/1123293600.db2.gz DOJJNUPSXXVEJD-GTWWNFFPSA-N 2 0 355.570 4.035 20 0 FIADRP COc1ccc(C)cc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499150702 1123293872 /nfs/dbraw/zinc/29/38/72/1123293872.db2.gz JTQLNVCMLPNTGT-WBDAEOGXSA-N 2 0 364.533 4.331 20 0 FIADRP CCC[NH+]1CCC(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000132872904 1123374333 /nfs/dbraw/zinc/37/43/33/1123374333.db2.gz CEILDLNGWMETFM-KRWDZBQOSA-N 2 0 355.448 4.189 20 0 FIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000133155584 1123436605 /nfs/dbraw/zinc/43/66/05/1123436605.db2.gz OXSAUGUVPZFKHB-VQTJNVASSA-N 2 0 374.569 4.263 20 0 FIADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000134023560 1123585126 /nfs/dbraw/zinc/58/51/26/1123585126.db2.gz UFHRQXAQZUVVSZ-SFHVURJKSA-N 2 0 356.510 4.265 20 0 FIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)Nc1ccccc1 ZINC000615314853 1123988815 /nfs/dbraw/zinc/98/88/15/1123988815.db2.gz JAUCWYQIEPJIPO-RTBURBONSA-N 2 0 365.521 4.178 20 0 FIADRP Cc1cc(C[NH2+]CCC[NH+]2CCCCC2)cc(C)c1OCc1ccccn1 ZINC000237620673 1124001151 /nfs/dbraw/zinc/00/11/51/1124001151.db2.gz CBWBIKDHLWCRFK-UHFFFAOYSA-N 2 0 367.537 4.243 20 0 FIADRP CO[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000245701840 1124210259 /nfs/dbraw/zinc/21/02/59/1124210259.db2.gz LTTQEEFKZGSJQS-BXXSPATCSA-N 2 0 368.496 4.298 20 0 FIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000474598283 1124216892 /nfs/dbraw/zinc/21/68/92/1124216892.db2.gz KQQQNQVHQDQRTG-GSXDDRDBSA-N 2 0 364.496 4.223 20 0 FIADRP O[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Cl)cc1 ZINC000180106145 1124228129 /nfs/dbraw/zinc/22/81/29/1124228129.db2.gz JSNSZOWWXUAFAC-LQCXBHPOSA-N 2 0 370.924 4.159 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245756732 1124241499 /nfs/dbraw/zinc/24/14/99/1124241499.db2.gz UXRRVHFVQYUEJX-XQUALCHDSA-N 2 0 369.597 4.140 20 0 FIADRP CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000245756726 1124241577 /nfs/dbraw/zinc/24/15/77/1124241577.db2.gz UXRRVHFVQYUEJX-NEWJYFPISA-N 2 0 369.597 4.140 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000246122266 1124362544 /nfs/dbraw/zinc/36/25/44/1124362544.db2.gz QTCCDLVACTZMRF-NJYVYQBISA-N 2 0 362.945 4.149 20 0 FIADRP COc1ccc([C@@H](OC)[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000542840769 1124437564 /nfs/dbraw/zinc/43/75/64/1124437564.db2.gz PIWJPHKMLLIZHU-JTSKRJEESA-N 2 0 360.542 4.158 20 0 FIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc(C)c1F ZINC000542846540 1124442114 /nfs/dbraw/zinc/44/21/14/1124442114.db2.gz MMANULMQIAYGLM-AVRDEDQJSA-N 2 0 370.512 4.250 20 0 FIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc(C)c1F ZINC000542846552 1124442320 /nfs/dbraw/zinc/44/23/20/1124442320.db2.gz MMANULMQIAYGLM-GCJKJVERSA-N 2 0 370.512 4.250 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc2c(s1)CCCC2 ZINC000542845583 1124446653 /nfs/dbraw/zinc/44/66/53/1124446653.db2.gz DAVXVJDWKWCNOP-OXJNMPFZSA-N 2 0 370.562 4.044 20 0 FIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2cccs2)C2CCCC2)CC1 ZINC000246528793 1124524116 /nfs/dbraw/zinc/52/41/16/1124524116.db2.gz VEZFJTCGEYXOEL-SFHLNBCPSA-N 2 0 362.583 4.337 20 0 FIADRP c1nc(-c2ccccc2)sc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246566817 1124534551 /nfs/dbraw/zinc/53/45/51/1124534551.db2.gz LFBFORKDVYWEBR-PXNSSMCTSA-N 2 0 353.535 4.259 20 0 FIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cc1 ZINC000246640325 1124545297 /nfs/dbraw/zinc/54/52/97/1124545297.db2.gz XAEMHGDTPWASBH-KZNAEPCWSA-N 2 0 356.485 4.286 20 0 FIADRP COc1ccc([C@@H]2C[C@@H]([N@@H+]3CCCC[C@@H]3C[C@@H]3CCC[NH+]3C)CCO2)cc1 ZINC001168662270 1124562358 /nfs/dbraw/zinc/56/23/58/1124562358.db2.gz DODNCVJDCFUZEH-KGSLCBSSSA-N 2 0 372.553 4.254 20 0 FIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(C)cc2C[NH+](C)C)cc1)C1CC1 ZINC000072839911 1124576493 /nfs/dbraw/zinc/57/64/93/1124576493.db2.gz JBUFJSYWNXFCCR-UHFFFAOYSA-N 2 0 365.521 4.293 20 0 FIADRP CCCC[NH+]1CCC([N@H+](C)Cc2cccc(Br)c2C)CC1 ZINC001236609954 1124584972 /nfs/dbraw/zinc/58/49/72/1124584972.db2.gz YJQKOWKUQAIYIG-UHFFFAOYSA-N 2 0 353.348 4.454 20 0 FIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCc1cccc2ccccc21 ZINC000247110455 1124591588 /nfs/dbraw/zinc/59/15/88/1124591588.db2.gz QLXRRCHLYQRHOL-YADARESESA-N 2 0 359.517 4.278 20 0 FIADRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c1 ZINC000247375957 1124705627 /nfs/dbraw/zinc/70/56/27/1124705627.db2.gz SRBNBPRDFAMYGZ-CEXWTWQISA-N 2 0 368.521 4.155 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(SC)c(F)c2)[C@@H](C)C1 ZINC000247969027 1124735004 /nfs/dbraw/zinc/73/50/04/1124735004.db2.gz HBUJSOUOFGADAX-BXWFABGCSA-N 2 0 368.562 4.335 20 0 FIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC[C@H](c3ccco3)[NH+]3CCCC3)CC2)C1 ZINC000248046731 1124739633 /nfs/dbraw/zinc/73/96/33/1124739633.db2.gz VGXSBUZBNQUZEA-HMXCVIKNSA-N 2 0 359.558 4.049 20 0 FIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cnc3ccsc3c2)[C@H](C)C1 ZINC000248066029 1124740200 /nfs/dbraw/zinc/74/02/00/1124740200.db2.gz MGCRAZDFUQKPPQ-NUJGCVRESA-N 2 0 361.555 4.084 20 0 FIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)OCCO2 ZINC000248393209 1124760710 /nfs/dbraw/zinc/76/07/10/1124760710.db2.gz DOUOGQBRRUXTQT-KPFFTGBYSA-N 2 0 358.526 4.152 20 0 FIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1c(C)noc1C ZINC000248412784 1124765103 /nfs/dbraw/zinc/76/51/03/1124765103.db2.gz KBAJRHXHKSEEHJ-JSXRDJHFSA-N 2 0 353.510 4.243 20 0 FIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Cl)s1 ZINC000248432659 1124767209 /nfs/dbraw/zinc/76/72/09/1124767209.db2.gz COTXKUFKHXLLSY-YOEHRIQHSA-N 2 0 364.942 4.209 20 0 FIADRP C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000248814203 1124815864 /nfs/dbraw/zinc/81/58/64/1124815864.db2.gz KVFZEADHQIFNBR-AVCGJXAMSA-N 2 0 368.521 4.198 20 0 FIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000248913056 1124827507 /nfs/dbraw/zinc/82/75/07/1124827507.db2.gz VRQYRZLSQRZEDT-BULFRSBZSA-N 2 0 374.569 4.282 20 0 FIADRP C[NH+]1CCC(Oc2ccc(CNc3cc[nH+]c4c(O)cccc34)cc2)CC1 ZINC000672296646 1124969198 /nfs/dbraw/zinc/96/91/98/1124969198.db2.gz HYUBHKLFNBMGEJ-UHFFFAOYSA-N 2 0 363.461 4.026 20 0 FIADRP Cc1nc2ccccc2nc1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000476976118 1125004460 /nfs/dbraw/zinc/00/44/60/1125004460.db2.gz VNIPEFBUZKDWAY-GOSISDBHSA-N 2 0 366.553 4.415 20 0 FIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1SC ZINC000090586543 1125006090 /nfs/dbraw/zinc/00/60/90/1125006090.db2.gz TXCKMGQWZMOVDN-IRXDYDNUSA-N 2 0 350.572 4.436 20 0 FIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091367506 1125068256 /nfs/dbraw/zinc/06/82/56/1125068256.db2.gz UQGFXLUPCBEGBE-LJQANCHMSA-N 2 0 370.368 4.060 20 0 FIADRP Cc1[nH]c2ccc(C[NH2+]Cc3ccc(OCC[NH+](C)C)cc3)cc2c1C ZINC000065013510 1125127777 /nfs/dbraw/zinc/12/77/77/1125127777.db2.gz LCLMFNVNVXYITK-UHFFFAOYSA-N 2 0 351.494 4.015 20 0 FIADRP Cc1cc([C@H]2CCC[N@@H+]2CCCCC[NH+]2CCC[C@H]2c2cc(C)no2)on1 ZINC000077265781 1125161982 /nfs/dbraw/zinc/16/19/82/1125161982.db2.gz ZYUXUMCISUTDQP-KDURUIRLSA-N 2 0 372.513 4.424 20 0 FIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccnc2)cc1C[NH+]1CCCCC1 ZINC000182226682 1125300941 /nfs/dbraw/zinc/30/09/41/1125300941.db2.gz OCXQHBNVVZDCEW-QZTJIDSGSA-N 2 0 353.510 4.488 20 0 FIADRP C[C@H](C[NH2+][C@@H](c1cccc(Cl)c1)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000543012753 1125324954 /nfs/dbraw/zinc/32/49/54/1125324954.db2.gz VSYVRFANODRYEX-DYESRHJHSA-N 2 0 363.977 4.187 20 0 FIADRP Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)CCC2 ZINC000359892378 223135194 /nfs/dbraw/zinc/13/51/94/223135194.db2.gz BGIUMOSVYZZDAZ-KDOFPFPSSA-N 2 0 359.539 4.120 20 0 FIADRP Clc1ccccc1Cn1cc(C[NH2+]CCCCC[NH+]2CCCCC2)cn1 ZINC000603516134 568111625 /nfs/dbraw/zinc/11/16/25/568111625.db2.gz LPWNWWNGRCIAID-UHFFFAOYSA-N 2 0 374.960 4.331 20 0 FIADRP COCc1cccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)c1 ZINC000563120758 568222008 /nfs/dbraw/zinc/22/20/08/568222008.db2.gz HVGVJRHIMCTLJZ-JOCHJYFZSA-N 2 0 350.506 4.120 20 0 FIADRP C[C@H]1CCCC[N@@H+]1CCCN[C@H]1CC[NH+](Cc2ccccc2)C2(CC2)C1 ZINC000563120078 568224803 /nfs/dbraw/zinc/22/48/03/568224803.db2.gz QNZOPSGHSADHDO-UNMCSNQZSA-N 2 0 355.570 4.038 20 0 FIADRP C[NH2+]CCC1CC[NH+](Cc2cc(OC)c(OC)cc2-c2ccccc2)CC1 ZINC000563137713 568271539 /nfs/dbraw/zinc/27/15/39/568271539.db2.gz JRXHNKFRMKVNRB-UHFFFAOYSA-N 2 0 368.521 4.192 20 0 FIADRP Cc1ccc(C[NH+]2CCC3(CCN(c4[nH+]cc(C)cc4N)CC3)CC2)cc1 ZINC001164760570 721045501 /nfs/dbraw/zinc/04/55/01/721045501.db2.gz WLRYZUBDRMJBNX-UHFFFAOYSA-N 2 0 364.537 4.163 20 0 FIADRP