smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)N(CCN(C)C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494074 495745661 /nfs/dbraw/zinc/74/56/61/495745661.db2.gz JBNXGQSDILKWFH-AZUAARDMSA-N 1 3 360.546 3.021 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494074 495745668 /nfs/dbraw/zinc/74/56/68/495745668.db2.gz JBNXGQSDILKWFH-AZUAARDMSA-N 1 3 360.546 3.021 20 70 FGIDHO CC[NH+](CC)CCOc1ccc(CN[C@@H]2CCCc3c2cnn3C)cc1 ZINC000160282481 495925747 /nfs/dbraw/zinc/92/57/47/495925747.db2.gz ASQJHNXOUVLKIB-HXUWFJFHSA-N 1 3 356.514 3.308 20 70 FGIDHO C[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc(OCCN(C)C)c1 ZINC000161122724 496108855 /nfs/dbraw/zinc/10/88/55/496108855.db2.gz ZSGKIDLNSUOOGV-MRXNPFEDSA-N 1 3 356.466 3.249 20 70 FGIDHO COC[C@@H](NCCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000160234917 495915242 /nfs/dbraw/zinc/91/52/42/495915242.db2.gz CZNGSKQKOKARKN-GOSISDBHSA-N 1 3 373.463 3.009 20 70 FGIDHO COc1cc(OC)c([C@@H](C)NCCN2CCC([NH+](C)C)CC2)cc1Cl ZINC000160262770 495921621 /nfs/dbraw/zinc/92/16/21/495921621.db2.gz HPPJPPOVNVZDCI-CQSZACIVSA-N 1 3 369.937 3.034 20 70 FGIDHO CCOc1ccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161282390 496144423 /nfs/dbraw/zinc/14/44/23/496144423.db2.gz LYZMMVFNKJYHLL-KRWDZBQOSA-N 1 3 369.509 3.228 20 70 FGIDHO COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)c1 ZINC000161298365 496145946 /nfs/dbraw/zinc/14/59/46/496145946.db2.gz XTZIFHGNXPKGPR-KKSFZXQISA-N 1 3 358.482 3.020 20 70 FGIDHO CCOCCC[N@@H+]1CC[C@H](NC[C@@H](C)N2CCc3ccccc3C2)[C@H](C)C1 ZINC000159804846 495812820 /nfs/dbraw/zinc/81/28/20/495812820.db2.gz JRFQNUKSULSZOH-VIZSFHNOSA-N 1 3 373.585 3.160 20 70 FGIDHO CCOCCC[N@H+]1CC[C@H](NC[C@@H](C)N2CCc3ccccc3C2)[C@H](C)C1 ZINC000159804846 495812824 /nfs/dbraw/zinc/81/28/24/495812824.db2.gz JRFQNUKSULSZOH-VIZSFHNOSA-N 1 3 373.585 3.160 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1Br ZINC000160181496 495903056 /nfs/dbraw/zinc/90/30/56/495903056.db2.gz YMILNHJDSFRXDO-AWEZNQCLSA-N 1 3 354.336 3.126 20 70 FGIDHO C[C@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1cccc(OCCN(C)C)c1 ZINC000160587508 495997922 /nfs/dbraw/zinc/99/79/22/495997922.db2.gz PKKHJNXOESGFAM-FUHWJXTLSA-N 1 3 367.493 3.404 20 70 FGIDHO C[C@@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690688 496021251 /nfs/dbraw/zinc/02/12/51/496021251.db2.gz RFWSYWOITGHKEE-UKRRQHHQSA-N 1 3 373.310 3.476 20 70 FGIDHO C[C@@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690688 496021254 /nfs/dbraw/zinc/02/12/54/496021254.db2.gz RFWSYWOITGHKEE-UKRRQHHQSA-N 1 3 373.310 3.476 20 70 FGIDHO C[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)N(C)Cc1ccccc1 ZINC000159586009 495764726 /nfs/dbraw/zinc/76/47/26/495764726.db2.gz QPGXVFPRHMCZIL-PZJWPPBQSA-N 1 3 372.557 3.167 20 70 FGIDHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000160012612 495863600 /nfs/dbraw/zinc/86/36/00/495863600.db2.gz IOGTYAVMYRGKPC-GIVPXCGWSA-N 1 3 372.557 3.023 20 70 FGIDHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000160012612 495863606 /nfs/dbraw/zinc/86/36/06/495863606.db2.gz IOGTYAVMYRGKPC-GIVPXCGWSA-N 1 3 372.557 3.023 20 70 FGIDHO CC[NH+](CC)CCOc1ccc(CN[C@H]2CCCc3c2cnn3C)cc1 ZINC000160282613 495926134 /nfs/dbraw/zinc/92/61/34/495926134.db2.gz ASQJHNXOUVLKIB-FQEVSTJZSA-N 1 3 356.514 3.308 20 70 FGIDHO C[C@@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686189 496019700 /nfs/dbraw/zinc/01/97/00/496019700.db2.gz NSUDCBXWKSVZHC-HUUCEWRRSA-N 1 3 355.320 3.337 20 70 FGIDHO C[C@@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686189 496019707 /nfs/dbraw/zinc/01/97/07/496019707.db2.gz NSUDCBXWKSVZHC-HUUCEWRRSA-N 1 3 355.320 3.337 20 70 FGIDHO C[C@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685797 496019847 /nfs/dbraw/zinc/01/98/47/496019847.db2.gz BPTWMKNDWANJLQ-QWHCGFSZSA-N 1 3 361.349 3.398 20 70 FGIDHO C[C@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685797 496019851 /nfs/dbraw/zinc/01/98/51/496019851.db2.gz BPTWMKNDWANJLQ-QWHCGFSZSA-N 1 3 361.349 3.398 20 70 FGIDHO Cc1cc(C)cc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000161195564 496125082 /nfs/dbraw/zinc/12/50/82/496125082.db2.gz VGYIMPSKLOGQEQ-SFHVURJKSA-N 1 3 353.510 3.446 20 70 FGIDHO Cc1ccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)c1 ZINC000161260178 496139702 /nfs/dbraw/zinc/13/97/02/496139702.db2.gz AUDKRYWTDJCETD-SFHVURJKSA-N 1 3 353.510 3.446 20 70 FGIDHO C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)N(C)Cc1ccccc1 ZINC000159586148 495764640 /nfs/dbraw/zinc/76/46/40/495764640.db2.gz QPGXVFPRHMCZIL-TZIWHRDSSA-N 1 3 372.557 3.167 20 70 FGIDHO C[C@H]1C[C@H]([NH2+]CCCOC2CCN(Cc3ccccc3)CC2)CN1C1CC1 ZINC000159743915 495798894 /nfs/dbraw/zinc/79/88/94/495798894.db2.gz WZTQQVPKESWBNY-FPOVZHCZSA-N 1 3 371.569 3.273 20 70 FGIDHO C[C@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)C1CCOCC1 ZINC000159761080 495803567 /nfs/dbraw/zinc/80/35/67/495803567.db2.gz OLMLZJHCACTSKC-IBGZPJMESA-N 1 3 360.542 3.462 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159920062 495841669 /nfs/dbraw/zinc/84/16/69/495841669.db2.gz IMXKNWNOYMPLNX-GHTZIAJQSA-N 1 3 372.557 3.023 20 70 FGIDHO CCOc1ccc([C@@H](C)NCCN2CCC([NH+](C)C)CC2)cc1OCC ZINC000160285270 495927078 /nfs/dbraw/zinc/92/70/78/495927078.db2.gz JKLMZTOWJWHSBI-QGZVFWFLSA-N 1 3 363.546 3.161 20 70 FGIDHO C[C@H](Cn1cc(Br)cn1)NC1CC[NH+](C2CCCC2)CC1 ZINC000160482262 495973818 /nfs/dbraw/zinc/97/38/18/495973818.db2.gz ANNWYJVLXYUJDY-CYBMUJFWSA-N 1 3 355.324 3.031 20 70 FGIDHO C[C@@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685930 496020008 /nfs/dbraw/zinc/02/00/08/496020008.db2.gz BPTWMKNDWANJLQ-CHWSQXEVSA-N 1 3 361.349 3.398 20 70 FGIDHO C[C@@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685930 496020012 /nfs/dbraw/zinc/02/00/12/496020012.db2.gz BPTWMKNDWANJLQ-CHWSQXEVSA-N 1 3 361.349 3.398 20 70 FGIDHO C[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000161250528 496137043 /nfs/dbraw/zinc/13/70/43/496137043.db2.gz POZUZRHELVUZHX-HNNXBMFYSA-N 1 3 371.550 3.379 20 70 FGIDHO C[C@H]1Cc2ccc(F)cc2[C@H]1NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292570 496146434 /nfs/dbraw/zinc/14/64/34/496146434.db2.gz AUCSNRZFOHLNPX-BTYIYWSLSA-N 1 3 369.484 3.140 20 70 FGIDHO COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)c1 ZINC000161298685 496146707 /nfs/dbraw/zinc/14/67/07/496146707.db2.gz XTZIFHGNXPKGPR-IIBYNOLFSA-N 1 3 358.482 3.020 20 70 FGIDHO CC[C@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000159742949 495798467 /nfs/dbraw/zinc/79/84/67/495798467.db2.gz IPSYLHZPLNQHHE-IRLDBZIGSA-N 1 3 360.542 3.462 20 70 FGIDHO CN(C)Cc1cccc(CNC(=O)N2CCC(CCC[NH+](C)C)CC2)c1 ZINC000160421284 495958791 /nfs/dbraw/zinc/95/87/91/495958791.db2.gz UHHJPSRYQAKXND-UHFFFAOYSA-N 1 3 360.546 3.012 20 70 FGIDHO COc1ccc2c(c1)[C@H](NCc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000161168357 496119019 /nfs/dbraw/zinc/11/90/19/496119019.db2.gz ZUCJORUEXTZOFM-HSZRJFAPSA-N 1 3 366.505 3.429 20 70 FGIDHO C[C@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C(C)(C)c1ccccc1 ZINC000161204702 496127117 /nfs/dbraw/zinc/12/71/17/496127117.db2.gz SBTKVNMWRLZLNW-SFHVURJKSA-N 1 3 367.537 3.434 20 70 FGIDHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446476 495734461 /nfs/dbraw/zinc/73/44/61/495734461.db2.gz GZLCORSKJJBNMD-QGZVFWFLSA-N 1 3 373.501 3.016 20 70 FGIDHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446476 495734466 /nfs/dbraw/zinc/73/44/66/495734466.db2.gz GZLCORSKJJBNMD-QGZVFWFLSA-N 1 3 373.501 3.016 20 70 FGIDHO C[C@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CN1Cc1ccccc1 ZINC000160358502 495944758 /nfs/dbraw/zinc/94/47/58/495944758.db2.gz CCIYCJHUVRNCDZ-RXVVDRJESA-N 1 3 372.557 3.023 20 70 FGIDHO CCC[NH+]1CCC(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)CC1 ZINC000160399050 495954645 /nfs/dbraw/zinc/95/46/45/495954645.db2.gz CCKJLBGWCONNBP-OAQYLSRUSA-N 1 3 372.557 3.167 20 70 FGIDHO C[C@@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1cccc(OCCN(C)C)c1 ZINC000160587392 495998248 /nfs/dbraw/zinc/99/82/48/495998248.db2.gz PKKHJNXOESGFAM-AEFFLSMTSA-N 1 3 367.493 3.404 20 70 FGIDHO COc1cc(OC)c([C@@H](C)NCCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160743048 496033426 /nfs/dbraw/zinc/03/34/26/496033426.db2.gz QYLBDYLPSZWTGK-HUUCEWRRSA-N 1 3 370.921 3.245 20 70 FGIDHO COc1cc(OC)c([C@@H](C)NCCCC[N@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160743048 496033430 /nfs/dbraw/zinc/03/34/30/496033430.db2.gz QYLBDYLPSZWTGK-HUUCEWRRSA-N 1 3 370.921 3.245 20 70 FGIDHO Cc1cccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1C ZINC000161218794 496129428 /nfs/dbraw/zinc/12/94/28/496129428.db2.gz KCZNRBAOKQDKEI-GOSISDBHSA-N 1 3 353.510 3.446 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494361 495745355 /nfs/dbraw/zinc/74/53/55/495745355.db2.gz JBNXGQSDILKWFH-ICSRJNTNSA-N 1 3 360.546 3.021 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494361 495745361 /nfs/dbraw/zinc/74/53/61/495745361.db2.gz JBNXGQSDILKWFH-ICSRJNTNSA-N 1 3 360.546 3.021 20 70 FGIDHO C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)N(C)Cc1ccccc1 ZINC000159585906 495764049 /nfs/dbraw/zinc/76/40/49/495764049.db2.gz QPGXVFPRHMCZIL-CTNGQTDRSA-N 1 3 372.557 3.167 20 70 FGIDHO CC[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(OC)c1 ZINC000161219334 496129620 /nfs/dbraw/zinc/12/96/20/496129620.db2.gz FBOIKMWDDGWZIO-OAQYLSRUSA-N 1 3 369.509 3.228 20 70 FGIDHO C[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000161228277 496132415 /nfs/dbraw/zinc/13/24/15/496132415.db2.gz TYIMCHMGVMUTIY-KRWDZBQOSA-N 1 3 365.521 3.318 20 70 FGIDHO C[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000161250606 496137118 /nfs/dbraw/zinc/13/71/18/496137118.db2.gz POZUZRHELVUZHX-OAHLLOKOSA-N 1 3 371.550 3.379 20 70 FGIDHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260672 496139560 /nfs/dbraw/zinc/13/95/60/496139560.db2.gz MOYVZFXJPRQKQS-HXUWFJFHSA-N 1 3 368.525 3.031 20 70 FGIDHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260672 496139563 /nfs/dbraw/zinc/13/95/63/496139563.db2.gz MOYVZFXJPRQKQS-HXUWFJFHSA-N 1 3 368.525 3.031 20 70 FGIDHO CCOCCCN1CC[C@H]([NH2+][C@@H](C)c2cc(OC)ccc2OC)[C@H](C)C1 ZINC000159981408 495855936 /nfs/dbraw/zinc/85/59/36/495855936.db2.gz KZTAYNLAKUVWIF-UWVAXJGDSA-N 1 3 364.530 3.491 20 70 FGIDHO CN(C)[C@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005814 496083760 /nfs/dbraw/zinc/08/37/60/496083760.db2.gz CBMREKQESRQVSI-SJORKVTESA-N 1 3 363.933 3.407 20 70 FGIDHO COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)c1 ZINC000161298483 496145987 /nfs/dbraw/zinc/14/59/87/496145987.db2.gz XTZIFHGNXPKGPR-IERDGZPVSA-N 1 3 358.482 3.020 20 70 FGIDHO CC(C)[NH+](CCN(C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000216910739 496993146 /nfs/dbraw/zinc/99/31/46/496993146.db2.gz SCODUEDVHVPFSO-FQEVSTJZSA-N 1 3 360.546 3.021 20 70 FGIDHO CN(C)[C@H](CNC(=O)N1CCC(CCC[NH+](C)C)CC1)c1ccccc1 ZINC000159718073 495793578 /nfs/dbraw/zinc/79/35/78/495793578.db2.gz YHUFBWICJZRCDT-HXUWFJFHSA-N 1 3 360.546 3.053 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000160179807 495901860 /nfs/dbraw/zinc/90/18/60/495901860.db2.gz PHYAGGVCYCYYGG-GOSISDBHSA-N 1 3 351.922 3.169 20 70 FGIDHO Cc1cc([C@H](C)NCC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307518 495931756 /nfs/dbraw/zinc/93/17/56/495931756.db2.gz ROGOVCDJZJIOGZ-KXBFYZLASA-N 1 3 359.539 3.435 20 70 FGIDHO C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000160405219 495955809 /nfs/dbraw/zinc/95/58/09/495955809.db2.gz VEOFXHHDEZTKKV-OALUTQOASA-N 1 3 366.594 3.260 20 70 FGIDHO Cc1ccc(C)c([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000160872313 496057466 /nfs/dbraw/zinc/05/74/66/496057466.db2.gz UHININYBMPGOBW-SFHVURJKSA-N 1 3 353.510 3.446 20 70 FGIDHO CN(C)[C@@H](CNC(=O)N1CCC(CCC[NH+](C)C)CC1)c1ccccc1 ZINC000159717943 495793692 /nfs/dbraw/zinc/79/36/92/495793692.db2.gz YHUFBWICJZRCDT-FQEVSTJZSA-N 1 3 360.546 3.053 20 70 FGIDHO CCN(C(=O)NCCC1CC[NH+](C)CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000160057094 495873495 /nfs/dbraw/zinc/87/34/95/495873495.db2.gz GJHWIFFIHBNNRG-NRFANRHFSA-N 1 3 372.557 3.024 20 70 FGIDHO COCCOc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1OC ZINC000161066822 496096578 /nfs/dbraw/zinc/09/65/78/496096578.db2.gz KVTBQDMIRSKESD-NJAFHUGGSA-N 1 3 350.503 3.244 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1 ZINC000159939753 495845506 /nfs/dbraw/zinc/84/55/06/495845506.db2.gz GNEQKBBBSDTUFN-AZUAARDMSA-N 1 3 372.557 3.165 20 70 FGIDHO CCN(CC)C(=O)C[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000161097361 496102184 /nfs/dbraw/zinc/10/21/84/496102184.db2.gz LHBRSECPQCIHOM-LBFURVHYSA-N 1 3 357.542 3.419 20 70 FGIDHO CCN(CC)C(=O)C[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000161097361 496102187 /nfs/dbraw/zinc/10/21/87/496102187.db2.gz LHBRSECPQCIHOM-LBFURVHYSA-N 1 3 357.542 3.419 20 70 FGIDHO Cc1ccc(CNC(=O)C2CC[NH+](CCCN3CCCCC3)CC2)cc1 ZINC000161374311 496162664 /nfs/dbraw/zinc/16/26/64/496162664.db2.gz KKANKYOUIXNGOK-UHFFFAOYSA-N 1 3 357.542 3.199 20 70 FGIDHO C[C@H]1C[C@@H]([NH2+]CCCOC2CCN(Cc3ccccc3)CC2)CN1C1CC1 ZINC000159744158 495799893 /nfs/dbraw/zinc/79/98/93/495799893.db2.gz WZTQQVPKESWBNY-PZJWPPBQSA-N 1 3 371.569 3.273 20 70 FGIDHO CCN1CCCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000159781402 495806994 /nfs/dbraw/zinc/80/69/94/495806994.db2.gz SJAFWIOIAKZKQV-UHFFFAOYSA-N 1 3 372.557 3.300 20 70 FGIDHO CCN1CCC(NC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000160753522 496036104 /nfs/dbraw/zinc/03/61/04/496036104.db2.gz PQKGRMGHGJOTEI-SFHVURJKSA-N 1 3 364.578 3.157 20 70 FGIDHO CCN1CCC(NC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000160753522 496036109 /nfs/dbraw/zinc/03/61/09/496036109.db2.gz PQKGRMGHGJOTEI-SFHVURJKSA-N 1 3 364.578 3.157 20 70 FGIDHO C[NH+](C)CCNC(=O)c1cccc(CN[C@@H]2CCCc3sccc32)c1 ZINC000161260570 496139834 /nfs/dbraw/zinc/13/98/34/496139834.db2.gz SLWKPQCYZIXXQE-GOSISDBHSA-N 1 3 357.523 3.207 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1Br ZINC000160181640 495903087 /nfs/dbraw/zinc/90/30/87/495903087.db2.gz YMILNHJDSFRXDO-CQSZACIVSA-N 1 3 354.336 3.126 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@@H]2CC3(CCCC3)Oc3ccccc32)CC1 ZINC000160275257 495924892 /nfs/dbraw/zinc/92/48/92/495924892.db2.gz RIIWBSFSPWJDJW-HXUWFJFHSA-N 1 3 357.542 3.439 20 70 FGIDHO C[C@@H](Cn1cc(Br)cn1)NC1CC[NH+](C2CCCC2)CC1 ZINC000160482128 495972154 /nfs/dbraw/zinc/97/21/54/495972154.db2.gz ANNWYJVLXYUJDY-ZDUSSCGKSA-N 1 3 355.324 3.031 20 70 FGIDHO Cc1cccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1C ZINC000161218918 496129381 /nfs/dbraw/zinc/12/93/81/496129381.db2.gz KCZNRBAOKQDKEI-SFHVURJKSA-N 1 3 353.510 3.446 20 70 FGIDHO CN(C)[C@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605799 496001499 /nfs/dbraw/zinc/00/14/99/496001499.db2.gz YWOFTLIGVBCHIO-FCHUYYIVSA-N 1 3 365.521 3.016 20 70 FGIDHO C[C@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186647 496122080 /nfs/dbraw/zinc/12/20/80/496122080.db2.gz IPNVCDRUFFPSNU-INIZCTEOSA-N 1 3 364.493 3.370 20 70 FGIDHO C[C@H](NCc1ccccc1C[NH+]1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186647 496122085 /nfs/dbraw/zinc/12/20/85/496122085.db2.gz IPNVCDRUFFPSNU-INIZCTEOSA-N 1 3 364.493 3.370 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000160169267 495901016 /nfs/dbraw/zinc/90/10/16/495901016.db2.gz KGGWRXLKOLSBRE-CYBMUJFWSA-N 1 3 372.326 3.265 20 70 FGIDHO CC[C@H](NCCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC ZINC000160174783 495902340 /nfs/dbraw/zinc/90/23/40/495902340.db2.gz CBDZRGKILYLWMO-SFHVURJKSA-N 1 3 353.938 3.415 20 70 FGIDHO Cc1nc(C(C)(C)C)sc1[C@@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160248640 495917776 /nfs/dbraw/zinc/91/77/76/495917776.db2.gz CXCJNIHPUKWFHG-CQSZACIVSA-N 1 3 352.592 3.426 20 70 FGIDHO CCN1CCC(NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000160753655 496036031 /nfs/dbraw/zinc/03/60/31/496036031.db2.gz PQKGRMGHGJOTEI-GOSISDBHSA-N 1 3 364.578 3.157 20 70 FGIDHO CCN1CCC(NC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000160753655 496036037 /nfs/dbraw/zinc/03/60/37/496036037.db2.gz PQKGRMGHGJOTEI-GOSISDBHSA-N 1 3 364.578 3.157 20 70 FGIDHO CN(C)[C@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103862 496104303 /nfs/dbraw/zinc/10/43/03/496104303.db2.gz ZIBLPEHYHKJDEK-MOPGFXCFSA-N 1 3 363.933 3.407 20 70 FGIDHO CN(C)[C@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103632 496104372 /nfs/dbraw/zinc/10/43/72/496104372.db2.gz ZIBLPEHYHKJDEK-OALUTQOASA-N 1 3 363.933 3.407 20 70 FGIDHO Cc1ccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1C ZINC000161236529 496134657 /nfs/dbraw/zinc/13/46/57/496134657.db2.gz UWWBNOXQIYAOTR-SFHVURJKSA-N 1 3 353.510 3.446 20 70 FGIDHO COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)c1 ZINC000161314834 496150302 /nfs/dbraw/zinc/15/03/02/496150302.db2.gz WHRYLKXLRPLEKH-KKSFZXQISA-N 1 3 358.482 3.020 20 70 FGIDHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)c1 ZINC000161204448 496127352 /nfs/dbraw/zinc/12/73/52/496127352.db2.gz MAXGXTRPRAXIJA-QFIPXVFZSA-N 1 3 365.521 3.089 20 70 FGIDHO COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)c1 ZINC000161298578 496146263 /nfs/dbraw/zinc/14/62/63/496146263.db2.gz XTZIFHGNXPKGPR-HRAATJIYSA-N 1 3 358.482 3.020 20 70 FGIDHO COc1cccc([C@@H](O)CNC2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000161323014 496152418 /nfs/dbraw/zinc/15/24/18/496152418.db2.gz WTOBMSQPTVAEEP-QFIPXVFZSA-N 1 3 372.484 3.164 20 70 FGIDHO C[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)N(C)Cc1ccccc1 ZINC000159585780 495764570 /nfs/dbraw/zinc/76/45/70/495764570.db2.gz QPGXVFPRHMCZIL-FPOVZHCZSA-N 1 3 372.557 3.167 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1 ZINC000159940035 495846580 /nfs/dbraw/zinc/84/65/80/495846580.db2.gz GNEQKBBBSDTUFN-UYAOXDASSA-N 1 3 372.557 3.165 20 70 FGIDHO Cc1cccc2c1CC[C@@H]2NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161215101 496128532 /nfs/dbraw/zinc/12/85/32/496128532.db2.gz XTFPISZBRDOJMO-NRFANRHFSA-N 1 3 351.494 3.064 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000159691512 495788343 /nfs/dbraw/zinc/78/83/43/495788343.db2.gz XWUZYHWABVZZSP-OALUTQOASA-N 1 3 374.573 3.125 20 70 FGIDHO C[C@@H]1C[C@@H]([NH2+]CCCOC2CCN(Cc3ccccc3)CC2)CN1C1CC1 ZINC000159744042 495800099 /nfs/dbraw/zinc/80/00/99/495800099.db2.gz WZTQQVPKESWBNY-TZIWHRDSSA-N 1 3 371.569 3.273 20 70 FGIDHO CCCC[N@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159813675 495815917 /nfs/dbraw/zinc/81/59/17/495815917.db2.gz WAZWFBARHUOJNH-CTNGQTDRSA-N 1 3 374.573 3.413 20 70 FGIDHO CCCC[N@@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159813675 495815921 /nfs/dbraw/zinc/81/59/21/495815921.db2.gz WAZWFBARHUOJNH-CTNGQTDRSA-N 1 3 374.573 3.413 20 70 FGIDHO Cc1ccc(OC(F)F)c([C@H](C)NCCN2CCC([NH+](C)C)CC2)c1 ZINC000160183715 495903101 /nfs/dbraw/zinc/90/31/01/495903101.db2.gz BICFZAVLYXUUNH-HNNXBMFYSA-N 1 3 355.473 3.273 20 70 FGIDHO C[C@@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186788 496122360 /nfs/dbraw/zinc/12/23/60/496122360.db2.gz IPNVCDRUFFPSNU-MRXNPFEDSA-N 1 3 364.493 3.370 20 70 FGIDHO C[C@@H](NCc1ccccc1C[NH+]1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186788 496122366 /nfs/dbraw/zinc/12/23/66/496122366.db2.gz IPNVCDRUFFPSNU-MRXNPFEDSA-N 1 3 364.493 3.370 20 70 FGIDHO Cc1ccc([C@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)N(C)C)cc1 ZINC000161210206 496128502 /nfs/dbraw/zinc/12/85/02/496128502.db2.gz KPKGIPNXVQVUBA-NRFANRHFSA-N 1 3 374.573 3.361 20 70 FGIDHO CC[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(OC)c1 ZINC000161219199 496129562 /nfs/dbraw/zinc/12/95/62/496129562.db2.gz FBOIKMWDDGWZIO-NRFANRHFSA-N 1 3 369.509 3.228 20 70 FGIDHO Cc1ccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)c1 ZINC000161260059 496139574 /nfs/dbraw/zinc/13/95/74/496139574.db2.gz AUDKRYWTDJCETD-GOSISDBHSA-N 1 3 353.510 3.446 20 70 FGIDHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260810 496139905 /nfs/dbraw/zinc/13/99/05/496139905.db2.gz MOYVZFXJPRQKQS-FQEVSTJZSA-N 1 3 368.525 3.031 20 70 FGIDHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260810 496139913 /nfs/dbraw/zinc/13/99/13/496139913.db2.gz MOYVZFXJPRQKQS-FQEVSTJZSA-N 1 3 368.525 3.031 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159920201 495841441 /nfs/dbraw/zinc/84/14/41/495841441.db2.gz IMXKNWNOYMPLNX-RXVVDRJESA-N 1 3 372.557 3.023 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000160181363 495902763 /nfs/dbraw/zinc/90/27/63/495902763.db2.gz UZMUGKOEWXHIBH-GFCCVEGCSA-N 1 3 360.365 3.187 20 70 FGIDHO CN(Cc1ccccc1)CC(C)(C)NC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000160193553 495905315 /nfs/dbraw/zinc/90/53/15/495905315.db2.gz VTAYOVPVEIXZSY-UHFFFAOYSA-N 1 3 374.573 3.317 20 70 FGIDHO Cc1cc(C)cc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000161195465 496125133 /nfs/dbraw/zinc/12/51/33/496125133.db2.gz VGYIMPSKLOGQEQ-GOSISDBHSA-N 1 3 353.510 3.446 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000159691665 495788262 /nfs/dbraw/zinc/78/82/62/495788262.db2.gz XWUZYHWABVZZSP-RTBURBONSA-N 1 3 374.573 3.125 20 70 FGIDHO C[C@H](NCCCOC1CC[NH+](Cc2ccccc2)CC1)c1cnccn1 ZINC000159724509 495795170 /nfs/dbraw/zinc/79/51/70/495795170.db2.gz UAANUQMJGKZYAV-SFHVURJKSA-N 1 3 354.498 3.199 20 70 FGIDHO Cc1ccc(C)c([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000160872168 496057712 /nfs/dbraw/zinc/05/77/12/496057712.db2.gz UHININYBMPGOBW-GOSISDBHSA-N 1 3 353.510 3.446 20 70 FGIDHO C[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000161228403 496131839 /nfs/dbraw/zinc/13/18/39/496131839.db2.gz TYIMCHMGVMUTIY-QGZVFWFLSA-N 1 3 365.521 3.318 20 70 FGIDHO CC[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000161238522 496134354 /nfs/dbraw/zinc/13/43/54/496134354.db2.gz WUNGMIFXMWIJLK-OAQYLSRUSA-N 1 3 369.509 3.228 20 70 FGIDHO Cc1cc([C@H](C)NCC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307764 495931942 /nfs/dbraw/zinc/93/19/42/495931942.db2.gz ROGOVCDJZJIOGZ-HNAYVOBHSA-N 1 3 359.539 3.435 20 70 FGIDHO C[C@@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C(C)(C)c1ccccc1 ZINC000161204798 496126989 /nfs/dbraw/zinc/12/69/89/496126989.db2.gz SBTKVNMWRLZLNW-GOSISDBHSA-N 1 3 367.537 3.434 20 70 FGIDHO CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@@H]2C)cc1 ZINC000160271464 495923663 /nfs/dbraw/zinc/92/36/63/495923663.db2.gz ZTRFOSMFCXLYAN-IRXDYDNUSA-N 1 3 367.559 3.363 20 70 FGIDHO CN(C)[C@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005571 496083411 /nfs/dbraw/zinc/08/34/11/496083411.db2.gz CBMREKQESRQVSI-IRXDYDNUSA-N 1 3 363.933 3.407 20 70 FGIDHO CC[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000161238393 496134704 /nfs/dbraw/zinc/13/47/04/496134704.db2.gz WUNGMIFXMWIJLK-NRFANRHFSA-N 1 3 369.509 3.228 20 70 FGIDHO CN(C)CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)C1CCCC1 ZINC000159381876 495721046 /nfs/dbraw/zinc/72/10/46/495721046.db2.gz MMFIRDQGRJZEOT-UHFFFAOYSA-N 1 3 372.557 3.298 20 70 FGIDHO CC[C@@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000159743094 495798759 /nfs/dbraw/zinc/79/87/59/495798759.db2.gz IPSYLHZPLNQHHE-IFMALSPDSA-N 1 3 360.542 3.462 20 70 FGIDHO Cc1nc(C(C)(C)C)sc1[C@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160248741 495917371 /nfs/dbraw/zinc/91/73/71/495917371.db2.gz CXCJNIHPUKWFHG-AWEZNQCLSA-N 1 3 352.592 3.426 20 70 FGIDHO CCOc1ccc([C@H](C)NCCN2CCC([NH+](C)C)CC2)cc1OCC ZINC000160285399 495927074 /nfs/dbraw/zinc/92/70/74/495927074.db2.gz JKLMZTOWJWHSBI-KRWDZBQOSA-N 1 3 363.546 3.161 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000159598474 495766222 /nfs/dbraw/zinc/76/62/22/495766222.db2.gz WABBWJKVUPBIDM-UHFFFAOYSA-N 1 3 372.557 3.156 20 70 FGIDHO C[C@H](CN1CCCCC1)NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159614713 495769867 /nfs/dbraw/zinc/76/98/67/495769867.db2.gz VKUACWOVJKNBHG-LJQANCHMSA-N 1 3 364.578 3.158 20 70 FGIDHO Cc1ccc(OC(F)F)c([C@@H](C)NCCN2CCC([NH+](C)C)CC2)c1 ZINC000160183604 495903547 /nfs/dbraw/zinc/90/35/47/495903547.db2.gz BICFZAVLYXUUNH-OAHLLOKOSA-N 1 3 355.473 3.273 20 70 FGIDHO C[C@@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CN1Cc1ccccc1 ZINC000160358370 495944348 /nfs/dbraw/zinc/94/43/48/495944348.db2.gz CCIYCJHUVRNCDZ-NQIIRXRSSA-N 1 3 372.557 3.023 20 70 FGIDHO CN(C)[C@@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605661 496001747 /nfs/dbraw/zinc/00/17/47/496001747.db2.gz YWOFTLIGVBCHIO-VXKWHMMOSA-N 1 3 365.521 3.016 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000160179943 495901745 /nfs/dbraw/zinc/90/17/45/495901745.db2.gz PHYAGGVCYCYYGG-SFHVURJKSA-N 1 3 351.922 3.169 20 70 FGIDHO C[C@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CN1Cc1ccccc1 ZINC000160358744 495944597 /nfs/dbraw/zinc/94/45/97/495944597.db2.gz CCIYCJHUVRNCDZ-GHTZIAJQSA-N 1 3 372.557 3.023 20 70 FGIDHO C[C@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1ccc(OCCN(C)C)cc1 ZINC000160532814 495985608 /nfs/dbraw/zinc/98/56/08/495985608.db2.gz GSDJLCGPZNEQTL-WMZOPIPTSA-N 1 3 367.493 3.404 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000160191503 495905876 /nfs/dbraw/zinc/90/58/76/495905876.db2.gz BXJIWSIERQFKTL-ZDUSSCGKSA-N 1 3 372.326 3.265 20 70 FGIDHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N(CCN(C)C)C1CCCC1 ZINC000160393980 495953180 /nfs/dbraw/zinc/95/31/80/495953180.db2.gz YDNYKYVUSNFZKP-GOSISDBHSA-N 1 3 352.567 3.157 20 70 FGIDHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N(CCN(C)C)C1CCCC1 ZINC000160393980 495953187 /nfs/dbraw/zinc/95/31/87/495953187.db2.gz YDNYKYVUSNFZKP-GOSISDBHSA-N 1 3 352.567 3.157 20 70 FGIDHO Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)c1 ZINC000160841932 496052024 /nfs/dbraw/zinc/05/20/24/496052024.db2.gz YEFJHZDKYIPDFK-HXUWFJFHSA-N 1 3 372.557 3.085 20 70 FGIDHO Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000160841932 496052027 /nfs/dbraw/zinc/05/20/27/496052027.db2.gz YEFJHZDKYIPDFK-HXUWFJFHSA-N 1 3 372.557 3.085 20 70 FGIDHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@H](Cc2ccccc2)C2CC2)c1 ZINC000161204540 496126907 /nfs/dbraw/zinc/12/69/07/496126907.db2.gz MAXGXTRPRAXIJA-JOCHJYFZSA-N 1 3 365.521 3.089 20 70 FGIDHO CN(C)CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)C1CCCC1 ZINC000160130956 495891654 /nfs/dbraw/zinc/89/16/54/495891654.db2.gz JGHYAVVQPNRUCY-UHFFFAOYSA-N 1 3 372.557 3.298 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000160255853 495920430 /nfs/dbraw/zinc/92/04/30/495920430.db2.gz PVNVAOVFWRVKHB-GJZGRUSLSA-N 1 3 352.910 3.306 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)NCCC[N@H+]1CCCC[C@@H]1C ZINC000160255853 495920433 /nfs/dbraw/zinc/92/04/33/495920433.db2.gz PVNVAOVFWRVKHB-GJZGRUSLSA-N 1 3 352.910 3.306 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCCN1CCCC[C@@H]1C ZINC000160255853 495920443 /nfs/dbraw/zinc/92/04/43/495920443.db2.gz PVNVAOVFWRVKHB-GJZGRUSLSA-N 1 3 352.910 3.306 20 70 FGIDHO COc1cc(OC)c([C@H](C)NCCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160742900 496033164 /nfs/dbraw/zinc/03/31/64/496033164.db2.gz QYLBDYLPSZWTGK-LSDHHAIUSA-N 1 3 370.921 3.245 20 70 FGIDHO COc1cc(OC)c([C@H](C)NCCCC[N@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160742900 496033171 /nfs/dbraw/zinc/03/31/71/496033171.db2.gz QYLBDYLPSZWTGK-LSDHHAIUSA-N 1 3 370.921 3.245 20 70 FGIDHO COCCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1OC ZINC000161066547 496096679 /nfs/dbraw/zinc/09/66/79/496096679.db2.gz KVTBQDMIRSKESD-JQHSSLGASA-N 1 3 350.503 3.244 20 70 FGIDHO COc1cccc([C@@H](O)C[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)c1 ZINC000161314966 496150363 /nfs/dbraw/zinc/15/03/63/496150363.db2.gz WHRYLKXLRPLEKH-IERDGZPVSA-N 1 3 358.482 3.020 20 70 FGIDHO CN(C)[C@@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605933 496001963 /nfs/dbraw/zinc/00/19/63/496001963.db2.gz YWOFTLIGVBCHIO-YADHBBJMSA-N 1 3 365.521 3.016 20 70 FGIDHO CCOc1ccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161282293 496143907 /nfs/dbraw/zinc/14/39/07/496143907.db2.gz LYZMMVFNKJYHLL-QGZVFWFLSA-N 1 3 369.509 3.228 20 70 FGIDHO C[C@@H](NCCCOC1CC[NH+](Cc2ccccc2)CC1)c1cnccn1 ZINC000159724661 495795411 /nfs/dbraw/zinc/79/54/11/495795411.db2.gz UAANUQMJGKZYAV-GOSISDBHSA-N 1 3 354.498 3.199 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1OC(F)F ZINC000160274535 495924660 /nfs/dbraw/zinc/92/46/60/495924660.db2.gz KDZWZUIQXRKULL-CYBMUJFWSA-N 1 3 359.436 3.104 20 70 FGIDHO C[C@H]1Cc2ccc(F)cc2[C@@H]1NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292337 496145007 /nfs/dbraw/zinc/14/50/07/496145007.db2.gz AUCSNRZFOHLNPX-YCRPNKLZSA-N 1 3 369.484 3.140 20 70 FGIDHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446610 495734698 /nfs/dbraw/zinc/73/46/98/495734698.db2.gz GZLCORSKJJBNMD-KRWDZBQOSA-N 1 3 373.501 3.016 20 70 FGIDHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446610 495734703 /nfs/dbraw/zinc/73/47/03/495734703.db2.gz GZLCORSKJJBNMD-KRWDZBQOSA-N 1 3 373.501 3.016 20 70 FGIDHO C[C@@H](CN1CCCCC1)NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159614573 495769922 /nfs/dbraw/zinc/76/99/22/495769922.db2.gz VKUACWOVJKNBHG-IBGZPJMESA-N 1 3 364.578 3.158 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000160162168 495898531 /nfs/dbraw/zinc/89/85/31/495898531.db2.gz ZZQZVWBXXRCPNA-SFHVURJKSA-N 1 3 351.922 3.169 20 70 FGIDHO CCNC(=O)c1cccc(CN[C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000160158165 495898648 /nfs/dbraw/zinc/89/86/48/495898648.db2.gz BHMBMXYOTWTCIN-QGZVFWFLSA-N 1 3 369.509 3.228 20 70 FGIDHO C[C@@H]1C[C@H](NC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)CN1Cc1ccccc1 ZINC000160333831 495939104 /nfs/dbraw/zinc/93/91/04/495939104.db2.gz KBBLEVXWIPYYMP-GIVPXCGWSA-N 1 3 372.557 3.165 20 70 FGIDHO C[C@@H]1C[C@H](NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)CN1Cc1ccccc1 ZINC000160333831 495939108 /nfs/dbraw/zinc/93/91/08/495939108.db2.gz KBBLEVXWIPYYMP-GIVPXCGWSA-N 1 3 372.557 3.165 20 70 FGIDHO CCOCCCN1CC[C@H]([NH2+]C[C@@H](C2CCCCC2)N(C)C)[C@H](C)C1 ZINC000160400473 495954231 /nfs/dbraw/zinc/95/42/31/495954231.db2.gz QNTGHSFYMGXOOO-GIVPXCGWSA-N 1 3 353.595 3.224 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000159599259 495767541 /nfs/dbraw/zinc/76/75/41/495767541.db2.gz KLQKWPYBBARMIX-IBGZPJMESA-N 1 3 372.557 3.298 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)CC1 ZINC000159599259 495767544 /nfs/dbraw/zinc/76/75/44/495767544.db2.gz KLQKWPYBBARMIX-IBGZPJMESA-N 1 3 372.557 3.298 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000159599836 495767821 /nfs/dbraw/zinc/76/78/21/495767821.db2.gz VNQMWCGTGGWMIY-IBGZPJMESA-N 1 3 372.557 3.156 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000159599836 495767827 /nfs/dbraw/zinc/76/78/27/495767827.db2.gz VNQMWCGTGGWMIY-IBGZPJMESA-N 1 3 372.557 3.156 20 70 FGIDHO C[C@@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)C1CCOCC1 ZINC000159761212 495803827 /nfs/dbraw/zinc/80/38/27/495803827.db2.gz OLMLZJHCACTSKC-LJQANCHMSA-N 1 3 360.542 3.462 20 70 FGIDHO CCN(C(=O)NCCC1CC[NH+](C)CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000160056991 495873391 /nfs/dbraw/zinc/87/33/91/495873391.db2.gz GJHWIFFIHBNNRG-OAQYLSRUSA-N 1 3 372.557 3.024 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000160209598 495908690 /nfs/dbraw/zinc/90/86/90/495908690.db2.gz PDTQTIPVWKTLIO-KRWDZBQOSA-N 1 3 353.963 3.493 20 70 FGIDHO COC[C@H](NCCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000160234775 495915791 /nfs/dbraw/zinc/91/57/91/495915791.db2.gz CZNGSKQKOKARKN-SFHVURJKSA-N 1 3 373.463 3.009 20 70 FGIDHO COc1cc([C@@H](C)NCCN2CCC([NH+](C)C)CC2)ccc1SC ZINC000160249559 495918988 /nfs/dbraw/zinc/91/89/88/495918988.db2.gz PRAWIJFVKXUVHU-OAHLLOKOSA-N 1 3 351.560 3.094 20 70 FGIDHO C[C@@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1ccc(OCCN(C)C)cc1 ZINC000160533194 495985438 /nfs/dbraw/zinc/98/54/38/495985438.db2.gz GSDJLCGPZNEQTL-SJLPKXTDSA-N 1 3 367.493 3.404 20 70 FGIDHO Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CC[N@@H+](C3CCCC3)C2)c1 ZINC000160842045 496052172 /nfs/dbraw/zinc/05/21/72/496052172.db2.gz YEFJHZDKYIPDFK-FQEVSTJZSA-N 1 3 372.557 3.085 20 70 FGIDHO Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000160842045 496052175 /nfs/dbraw/zinc/05/21/75/496052175.db2.gz YEFJHZDKYIPDFK-FQEVSTJZSA-N 1 3 372.557 3.085 20 70 FGIDHO COc1cccc([C@H](O)C[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)c1 ZINC000161315080 496150625 /nfs/dbraw/zinc/15/06/25/496150625.db2.gz WHRYLKXLRPLEKH-HRAATJIYSA-N 1 3 358.482 3.020 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)CC1 ZINC000159598627 495766920 /nfs/dbraw/zinc/76/69/20/495766920.db2.gz TUNGTMXDWSJQND-UHFFFAOYSA-N 1 3 372.557 3.156 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000160169127 495900704 /nfs/dbraw/zinc/90/07/04/495900704.db2.gz KGGWRXLKOLSBRE-ZDUSSCGKSA-N 1 3 372.326 3.265 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000160209463 495909533 /nfs/dbraw/zinc/90/95/33/495909533.db2.gz PDTQTIPVWKTLIO-QGZVFWFLSA-N 1 3 353.963 3.493 20 70 FGIDHO C[C@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1ccc(OCCN(C)C)cc1 ZINC000160533061 495985396 /nfs/dbraw/zinc/98/53/96/495985396.db2.gz GSDJLCGPZNEQTL-FUHWJXTLSA-N 1 3 367.493 3.404 20 70 FGIDHO C[C@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751096 496034398 /nfs/dbraw/zinc/03/43/98/496034398.db2.gz FQKISABHCIMPIK-DZGCQCFKSA-N 1 3 360.420 3.315 20 70 FGIDHO C[C@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751096 496034405 /nfs/dbraw/zinc/03/44/05/496034405.db2.gz FQKISABHCIMPIK-DZGCQCFKSA-N 1 3 360.420 3.315 20 70 FGIDHO C[NH+]1CCC(N2CCC(NC(=O)NCC3CCC(C)(C)CC3)CC2)CC1 ZINC000161045982 496092321 /nfs/dbraw/zinc/09/23/21/496092321.db2.gz GCQPUHJNNRNTBU-UHFFFAOYSA-N 1 3 364.578 3.061 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000159598915 495766257 /nfs/dbraw/zinc/76/62/57/495766257.db2.gz USTDOMKAOGNADP-IBGZPJMESA-N 1 3 372.557 3.298 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000159598915 495766260 /nfs/dbraw/zinc/76/62/60/495766260.db2.gz USTDOMKAOGNADP-IBGZPJMESA-N 1 3 372.557 3.298 20 70 FGIDHO CCCC[N@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159813501 495815525 /nfs/dbraw/zinc/81/55/25/495815525.db2.gz WAZWFBARHUOJNH-TZIWHRDSSA-N 1 3 374.573 3.413 20 70 FGIDHO CCCC[N@@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159813501 495815531 /nfs/dbraw/zinc/81/55/31/495815531.db2.gz WAZWFBARHUOJNH-TZIWHRDSSA-N 1 3 374.573 3.413 20 70 FGIDHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1 ZINC000160274387 495924597 /nfs/dbraw/zinc/92/45/97/495924597.db2.gz NNRBNAKINACESG-SESVDKBCSA-N 1 3 372.557 3.023 20 70 FGIDHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1 ZINC000160274387 495924599 /nfs/dbraw/zinc/92/45/99/495924599.db2.gz NNRBNAKINACESG-SESVDKBCSA-N 1 3 372.557 3.023 20 70 FGIDHO C[C@@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1cccc(OCCN(C)C)c1 ZINC000160587626 495997947 /nfs/dbraw/zinc/99/79/47/495997947.db2.gz PKKHJNXOESGFAM-SJLPKXTDSA-N 1 3 367.493 3.404 20 70 FGIDHO C[C@@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751189 496034719 /nfs/dbraw/zinc/03/47/19/496034719.db2.gz FQKISABHCIMPIK-UKRRQHHQSA-N 1 3 360.420 3.315 20 70 FGIDHO C[C@@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751189 496034722 /nfs/dbraw/zinc/03/47/22/496034722.db2.gz FQKISABHCIMPIK-UKRRQHHQSA-N 1 3 360.420 3.315 20 70 FGIDHO CCc1ccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161211669 496128178 /nfs/dbraw/zinc/12/81/78/496128178.db2.gz WHDNNGZHKSYLPF-QGZVFWFLSA-N 1 3 353.510 3.391 20 70 FGIDHO COc1cccc([C@H](O)C[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)c1 ZINC000161315211 496149886 /nfs/dbraw/zinc/14/98/86/496149886.db2.gz WHRYLKXLRPLEKH-IIBYNOLFSA-N 1 3 358.482 3.020 20 70 FGIDHO C[C@](O)(CNC1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccsc1 ZINC000159983194 495856162 /nfs/dbraw/zinc/85/61/62/495856162.db2.gz WFCZCZJKLYTXSP-FQEVSTJZSA-N 1 3 362.514 3.391 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000160191639 495905213 /nfs/dbraw/zinc/90/52/13/495905213.db2.gz BXJIWSIERQFKTL-CYBMUJFWSA-N 1 3 372.326 3.265 20 70 FGIDHO Cc1nc(-c2cccnc2)sc1[C@@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160232838 495914492 /nfs/dbraw/zinc/91/44/92/495914492.db2.gz YCDWTFKMOBOPHT-OAHLLOKOSA-N 1 3 373.570 3.190 20 70 FGIDHO Cc1cc([C@@H](C)NCC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307637 495931930 /nfs/dbraw/zinc/93/19/30/495931930.db2.gz ROGOVCDJZJIOGZ-DNVCBOLYSA-N 1 3 359.539 3.435 20 70 FGIDHO CCNC(=O)c1cccc(CN[C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000160158017 495898404 /nfs/dbraw/zinc/89/84/04/495898404.db2.gz BHMBMXYOTWTCIN-KRWDZBQOSA-N 1 3 369.509 3.228 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1cccc(OC(F)(F)F)c1 ZINC000160287022 495927138 /nfs/dbraw/zinc/92/71/38/495927138.db2.gz GWKDVQZTTSJBLZ-AWEZNQCLSA-N 1 3 359.436 3.262 20 70 FGIDHO C[C@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1cccc(OCCN(C)C)c1 ZINC000160587247 495998029 /nfs/dbraw/zinc/99/80/29/495998029.db2.gz PKKHJNXOESGFAM-WMZOPIPTSA-N 1 3 367.493 3.404 20 70 FGIDHO CC[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000160872844 496058663 /nfs/dbraw/zinc/05/86/63/496058663.db2.gz MJSOQZRMQSYVBG-HXUWFJFHSA-N 1 3 357.473 3.358 20 70 FGIDHO CC[C@@H](NCCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC ZINC000160174878 495901988 /nfs/dbraw/zinc/90/19/88/495901988.db2.gz CBDZRGKILYLWMO-GOSISDBHSA-N 1 3 353.938 3.415 20 70 FGIDHO Cc1nc(-c2cccnc2)sc1[C@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160232973 495915119 /nfs/dbraw/zinc/91/51/19/495915119.db2.gz YCDWTFKMOBOPHT-HNNXBMFYSA-N 1 3 373.570 3.190 20 70 FGIDHO C[C@H](CC(=O)Nc1cccnc1Cl)NC1CC[NH+](C2CCCC2)CC1 ZINC000160458266 495967779 /nfs/dbraw/zinc/96/77/79/495967779.db2.gz PNFYDAMBQVKTLT-CQSZACIVSA-N 1 3 364.921 3.449 20 70 FGIDHO C[C@H](CC(=O)Nc1cccnc1Cl)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000160458266 495967784 /nfs/dbraw/zinc/96/77/84/495967784.db2.gz PNFYDAMBQVKTLT-CQSZACIVSA-N 1 3 364.921 3.449 20 70 FGIDHO CN(C)[C@@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103741 496103429 /nfs/dbraw/zinc/10/34/29/496103429.db2.gz ZIBLPEHYHKJDEK-RTBURBONSA-N 1 3 363.933 3.407 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000160162057 495898670 /nfs/dbraw/zinc/89/86/70/495898670.db2.gz ZZQZVWBXXRCPNA-GOSISDBHSA-N 1 3 351.922 3.169 20 70 FGIDHO COc1cc(OC)c([C@H](C)NCCN2CCC([NH+](C)C)CC2)cc1Cl ZINC000160262684 495921083 /nfs/dbraw/zinc/92/10/83/495921083.db2.gz HPPJPPOVNVZDCI-AWEZNQCLSA-N 1 3 369.937 3.034 20 70 FGIDHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103499 496104083 /nfs/dbraw/zinc/10/40/83/496104083.db2.gz ZIBLPEHYHKJDEK-RBUKOAKNSA-N 1 3 363.933 3.407 20 70 FGIDHO C[NH+](C)CCNC(=O)c1cccc(CN[C@H]2CCc3cc(Cl)ccc32)c1 ZINC000161269363 496140673 /nfs/dbraw/zinc/14/06/73/496140673.db2.gz NUTBSKCTRXIBQD-FQEVSTJZSA-N 1 3 371.912 3.409 20 70 FGIDHO C[C@@H]1C[C@@H](NC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)CN1Cc1ccccc1 ZINC000160334128 495938473 /nfs/dbraw/zinc/93/84/73/495938473.db2.gz KBBLEVXWIPYYMP-NRSPTQNISA-N 1 3 372.557 3.165 20 70 FGIDHO C[C@@H]1C[C@@H](NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)CN1Cc1ccccc1 ZINC000160334128 495938479 /nfs/dbraw/zinc/93/84/79/495938479.db2.gz KBBLEVXWIPYYMP-NRSPTQNISA-N 1 3 372.557 3.165 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000159600002 495768182 /nfs/dbraw/zinc/76/81/82/495768182.db2.gz DHAFCXONQIBIFN-IBGZPJMESA-N 1 3 372.557 3.156 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000159600002 495768188 /nfs/dbraw/zinc/76/81/88/495768188.db2.gz DHAFCXONQIBIFN-IBGZPJMESA-N 1 3 372.557 3.156 20 70 FGIDHO Cc1cc([C@@H](C)NCC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307397 495931908 /nfs/dbraw/zinc/93/19/08/495931908.db2.gz ROGOVCDJZJIOGZ-BEFAXECRSA-N 1 3 359.539 3.435 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)NC1CC[NH+](C2CCCC2)CC1 ZINC000160458143 495967374 /nfs/dbraw/zinc/96/73/74/495967374.db2.gz PNFYDAMBQVKTLT-AWEZNQCLSA-N 1 3 364.921 3.449 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000160458143 495967378 /nfs/dbraw/zinc/96/73/78/495967378.db2.gz PNFYDAMBQVKTLT-AWEZNQCLSA-N 1 3 364.921 3.449 20 70 FGIDHO CN(C)[C@@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005672 496083167 /nfs/dbraw/zinc/08/31/67/496083167.db2.gz CBMREKQESRQVSI-IAGOWNOFSA-N 1 3 363.933 3.407 20 70 FGIDHO C[C@@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1ccc(OCCN(C)C)cc1 ZINC000160532903 495985514 /nfs/dbraw/zinc/98/55/14/495985514.db2.gz GSDJLCGPZNEQTL-AEFFLSMTSA-N 1 3 367.493 3.404 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159494209 495745206 /nfs/dbraw/zinc/74/52/06/495745206.db2.gz JBNXGQSDILKWFH-QUCCMNQESA-N 1 3 360.546 3.021 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159494209 495745215 /nfs/dbraw/zinc/74/52/15/495745215.db2.gz JBNXGQSDILKWFH-QUCCMNQESA-N 1 3 360.546 3.021 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1cccc(OC(F)(F)F)c1 ZINC000160287138 495926543 /nfs/dbraw/zinc/92/65/43/495926543.db2.gz GWKDVQZTTSJBLZ-CQSZACIVSA-N 1 3 359.436 3.262 20 70 FGIDHO C[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc(OCCN(C)C)c1 ZINC000161122586 496108970 /nfs/dbraw/zinc/10/89/70/496108970.db2.gz ZSGKIDLNSUOOGV-INIZCTEOSA-N 1 3 356.466 3.249 20 70 FGIDHO C[NH+](C)CCNC(=O)c1cccc(CN[C@H]2CCCc3sccc32)c1 ZINC000161260671 496139125 /nfs/dbraw/zinc/13/91/25/496139125.db2.gz SLWKPQCYZIXXQE-SFHVURJKSA-N 1 3 357.523 3.207 20 70 FGIDHO CN(C)[C@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160606054 496001824 /nfs/dbraw/zinc/00/18/24/496001824.db2.gz YWOFTLIGVBCHIO-FGZHOGPDSA-N 1 3 365.521 3.016 20 70 FGIDHO CCc1ccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161284066 496144323 /nfs/dbraw/zinc/14/43/23/496144323.db2.gz NUMVTAGHFRHXBN-HNNXBMFYSA-N 1 3 359.539 3.453 20 70 FGIDHO CC[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000160248383 495917226 /nfs/dbraw/zinc/91/72/26/495917226.db2.gz MTQCTHDVZQJFLY-KRWDZBQOSA-N 1 3 355.473 3.355 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1OC(F)F ZINC000160274404 495925139 /nfs/dbraw/zinc/92/51/39/495925139.db2.gz KDZWZUIQXRKULL-ZDUSSCGKSA-N 1 3 359.436 3.104 20 70 FGIDHO CC[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000160872726 496058916 /nfs/dbraw/zinc/05/89/16/496058916.db2.gz MJSOQZRMQSYVBG-FQEVSTJZSA-N 1 3 357.473 3.358 20 70 FGIDHO Cc1ccc([C@@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)N(C)C)cc1 ZINC000161210074 496128480 /nfs/dbraw/zinc/12/84/80/496128480.db2.gz KPKGIPNXVQVUBA-OAQYLSRUSA-N 1 3 374.573 3.361 20 70 FGIDHO COc1cccc([C@H](O)CNC2CC[NH+](CCc3ccc(F)cc3)CC2)c1 ZINC000161322882 496152615 /nfs/dbraw/zinc/15/26/15/496152615.db2.gz WTOBMSQPTVAEEP-JOCHJYFZSA-N 1 3 372.484 3.164 20 70 FGIDHO CN(C)Cc1ccc(CNC(=O)N2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000159932080 495843800 /nfs/dbraw/zinc/84/38/00/495843800.db2.gz XOEIVDSZRNUOSA-UHFFFAOYSA-N 1 3 360.546 3.012 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000160171090 495900927 /nfs/dbraw/zinc/90/09/27/495900927.db2.gz NNBCUDMDSPUOOB-AWEZNQCLSA-N 1 3 359.436 3.262 20 70 FGIDHO C[C@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686077 496020076 /nfs/dbraw/zinc/02/00/76/496020076.db2.gz NSUDCBXWKSVZHC-LSDHHAIUSA-N 1 3 355.320 3.337 20 70 FGIDHO C[C@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686077 496020079 /nfs/dbraw/zinc/02/00/79/496020079.db2.gz NSUDCBXWKSVZHC-LSDHHAIUSA-N 1 3 355.320 3.337 20 70 FGIDHO COCCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1OC ZINC000161066722 496096525 /nfs/dbraw/zinc/09/65/25/496096525.db2.gz KVTBQDMIRSKESD-SZMVWBNQSA-N 1 3 350.503 3.244 20 70 FGIDHO Cc1ccc2c(c1)[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)CC2 ZINC000161261287 496139401 /nfs/dbraw/zinc/13/94/01/496139401.db2.gz CBTMFXUUKWKPJL-OAQYLSRUSA-N 1 3 351.494 3.064 20 70 FGIDHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000160171229 495900653 /nfs/dbraw/zinc/90/06/53/495900653.db2.gz NNBCUDMDSPUOOB-CQSZACIVSA-N 1 3 359.436 3.262 20 70 FGIDHO C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)CN1Cc1ccccc1 ZINC000160358637 495945042 /nfs/dbraw/zinc/94/50/42/495945042.db2.gz CCIYCJHUVRNCDZ-WIYYLYMNSA-N 1 3 372.557 3.023 20 70 FGIDHO CC1CC[NH+](CCCCNC(=O)N(CCN(C)C)C2CCCC2)CC1 ZINC000160381788 495949882 /nfs/dbraw/zinc/94/98/82/495949882.db2.gz AOTPRVSDLNEEAM-UHFFFAOYSA-N 1 3 352.567 3.014 20 70 FGIDHO CC[N@@H+]1CC[C@H](N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)[C@H](C)C1 ZINC000161117688 496107626 /nfs/dbraw/zinc/10/76/26/496107626.db2.gz AIZQWVWNSDFOFB-QINHECLXSA-N 1 3 351.485 3.249 20 70 FGIDHO CC[N@H+]1CC[C@H](N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)[C@H](C)C1 ZINC000161117688 496107630 /nfs/dbraw/zinc/10/76/30/496107630.db2.gz AIZQWVWNSDFOFB-QINHECLXSA-N 1 3 351.485 3.249 20 70 FGIDHO C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292451 496146336 /nfs/dbraw/zinc/14/63/36/496146336.db2.gz AUCSNRZFOHLNPX-VFNWGFHPSA-N 1 3 369.484 3.140 20 70 FGIDHO Cc1ccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1C ZINC000161236429 496134731 /nfs/dbraw/zinc/13/47/31/496134731.db2.gz UWWBNOXQIYAOTR-GOSISDBHSA-N 1 3 353.510 3.446 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1 ZINC000159940171 495846601 /nfs/dbraw/zinc/84/66/01/495846601.db2.gz GNEQKBBBSDTUFN-QUCCMNQESA-N 1 3 372.557 3.165 20 70 FGIDHO CCOc1ccc(Cl)cc1[C@@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160199273 495906911 /nfs/dbraw/zinc/90/69/11/495906911.db2.gz ZCTHMZSIZAYTGI-OAHLLOKOSA-N 1 3 353.938 3.415 20 70 FGIDHO CCc1ccc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161283962 496143558 /nfs/dbraw/zinc/14/35/58/496143558.db2.gz NUMVTAGHFRHXBN-OAHLLOKOSA-N 1 3 359.539 3.453 20 70 FGIDHO CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@@H]2C)cc1 ZINC000160271360 495923872 /nfs/dbraw/zinc/92/38/72/495923872.db2.gz ZTRFOSMFCXLYAN-DLBZAZTESA-N 1 3 367.559 3.363 20 70 FGIDHO Cc1ccc2c(c1)[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)CC2 ZINC000161261376 496139659 /nfs/dbraw/zinc/13/96/59/496139659.db2.gz CBTMFXUUKWKPJL-NRFANRHFSA-N 1 3 351.494 3.064 20 70 FGIDHO CCN(C(=O)NC[C@@H](C)C[NH+]1CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000159400882 495725503 /nfs/dbraw/zinc/72/55/03/495725503.db2.gz NZQWBIITBPLXBR-CTNGQTDRSA-N 1 3 372.557 3.024 20 70 FGIDHO C[C@@H]1C[C@H]([NH2+]CCCOC2CCN(Cc3ccccc3)CC2)CN1C1CC1 ZINC000159743768 495798860 /nfs/dbraw/zinc/79/88/60/495798860.db2.gz WZTQQVPKESWBNY-CTNGQTDRSA-N 1 3 371.569 3.273 20 70 FGIDHO C[NH+](C)CCCC1CCN(C(=O)NCC(C)(C)N2CCCCC2)CC1 ZINC000159844331 495822443 /nfs/dbraw/zinc/82/24/43/495822443.db2.gz BQIBKEVZPSWLOZ-UHFFFAOYSA-N 1 3 352.567 3.014 20 70 FGIDHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N(CCN(C)C)C1CCCC1 ZINC000160394124 495952825 /nfs/dbraw/zinc/95/28/25/495952825.db2.gz YDNYKYVUSNFZKP-SFHVURJKSA-N 1 3 352.567 3.157 20 70 FGIDHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)N(CCN(C)C)C1CCCC1 ZINC000160394124 495952830 /nfs/dbraw/zinc/95/28/30/495952830.db2.gz YDNYKYVUSNFZKP-SFHVURJKSA-N 1 3 352.567 3.157 20 70 FGIDHO CCC[NH+]1CCC(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)CC1 ZINC000160399172 495954395 /nfs/dbraw/zinc/95/43/95/495954395.db2.gz CCKJLBGWCONNBP-NRFANRHFSA-N 1 3 372.557 3.167 20 70 FGIDHO C[NH+](C)CCNC(=O)c1cccc(CN[C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000161269219 496140704 /nfs/dbraw/zinc/14/07/04/496140704.db2.gz NUTBSKCTRXIBQD-HXUWFJFHSA-N 1 3 371.912 3.409 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000159778780 495806972 /nfs/dbraw/zinc/80/69/72/495806972.db2.gz YIWKGYZDUPHBFH-UHFFFAOYSA-N 1 3 372.557 3.300 20 70 FGIDHO C[C@@](O)(CNC1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccsc1 ZINC000159983077 495855141 /nfs/dbraw/zinc/85/51/41/495855141.db2.gz WFCZCZJKLYTXSP-HXUWFJFHSA-N 1 3 362.514 3.391 20 70 FGIDHO CCOc1ccc(Cl)cc1[C@H](C)NCCN1CCC([NH+](C)C)CC1 ZINC000160199406 495906698 /nfs/dbraw/zinc/90/66/98/495906698.db2.gz ZCTHMZSIZAYTGI-HNNXBMFYSA-N 1 3 353.938 3.415 20 70 FGIDHO C[NH+](C)C1CCN(CCN[C@H]2CC3(CCCC3)Oc3ccccc32)CC1 ZINC000160275391 495925112 /nfs/dbraw/zinc/92/51/12/495925112.db2.gz RIIWBSFSPWJDJW-FQEVSTJZSA-N 1 3 357.542 3.439 20 70 FGIDHO COc1ccc2c(c1)[C@@H](NCc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000161168494 496119536 /nfs/dbraw/zinc/11/95/36/496119536.db2.gz ZUCJORUEXTZOFM-QHCPKHFHSA-N 1 3 366.505 3.429 20 70 FGIDHO COc1ccc(CN2CCC(C[NH2+]C3CCC4(CC3)OCCO4)CC2)cc1 ZINC000161384166 496165373 /nfs/dbraw/zinc/16/53/73/496165373.db2.gz STWQIAMIKNHBCB-UHFFFAOYSA-N 1 3 374.525 3.183 20 70 FGIDHO CC[C@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000159743221 495798411 /nfs/dbraw/zinc/79/84/11/495798411.db2.gz IPSYLHZPLNQHHE-UNMCSNQZSA-N 1 3 360.542 3.462 20 70 FGIDHO CC[C@@H](NCCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000160248500 495917281 /nfs/dbraw/zinc/91/72/81/495917281.db2.gz MTQCTHDVZQJFLY-QGZVFWFLSA-N 1 3 355.473 3.355 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)NCCC[N@@H+]1CCCC[C@H]1C ZINC000160255757 495920070 /nfs/dbraw/zinc/92/00/70/495920070.db2.gz PVNVAOVFWRVKHB-LSDHHAIUSA-N 1 3 352.910 3.306 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)NCCC[N@H+]1CCCC[C@H]1C ZINC000160255757 495920075 /nfs/dbraw/zinc/92/00/75/495920075.db2.gz PVNVAOVFWRVKHB-LSDHHAIUSA-N 1 3 352.910 3.306 20 70 FGIDHO C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCCN1CCCC[C@H]1C ZINC000160255757 495920078 /nfs/dbraw/zinc/92/00/78/495920078.db2.gz PVNVAOVFWRVKHB-LSDHHAIUSA-N 1 3 352.910 3.306 20 70 FGIDHO Cc1cccc2c1CC[C@H]2NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161215222 496129237 /nfs/dbraw/zinc/12/92/37/496129237.db2.gz XTFPISZBRDOJMO-OAQYLSRUSA-N 1 3 351.494 3.064 20 70 FGIDHO CCN1CCCN(C(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)CC1 ZINC000159814305 495816021 /nfs/dbraw/zinc/81/60/21/495816021.db2.gz SDSOTHUXLWMWBN-UHFFFAOYSA-N 1 3 372.557 3.156 20 70 FGIDHO COCCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1OC ZINC000161066617 496097046 /nfs/dbraw/zinc/09/70/46/496097046.db2.gz KVTBQDMIRSKESD-NXHRZFHOSA-N 1 3 350.503 3.244 20 70 FGIDHO C[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccc(OCCN(C)C)cc1 ZINC000161110875 496104836 /nfs/dbraw/zinc/10/48/36/496104836.db2.gz UGNVVWSMNDAJKD-INIZCTEOSA-N 1 3 356.466 3.249 20 70 FGIDHO CCc1ccc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161211810 496128217 /nfs/dbraw/zinc/12/82/17/496128217.db2.gz WHDNNGZHKSYLPF-KRWDZBQOSA-N 1 3 353.510 3.391 20 70 FGIDHO C[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)N(C)C)[C@@H](C)c1ccccc1 ZINC000160564235 495992645 /nfs/dbraw/zinc/99/26/45/495992645.db2.gz PMVHAKQWOABOCL-LQWHRVPQSA-N 1 3 353.510 3.187 20 70 FGIDHO C[C@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690557 496021267 /nfs/dbraw/zinc/02/12/67/496021267.db2.gz RFWSYWOITGHKEE-DZGCQCFKSA-N 1 3 373.310 3.476 20 70 FGIDHO C[C@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690557 496021264 /nfs/dbraw/zinc/02/12/64/496021264.db2.gz RFWSYWOITGHKEE-DZGCQCFKSA-N 1 3 373.310 3.476 20 70 FGIDHO C[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccc(OCCN(C)C)cc1 ZINC000161111003 496104590 /nfs/dbraw/zinc/10/45/90/496104590.db2.gz UGNVVWSMNDAJKD-MRXNPFEDSA-N 1 3 356.466 3.249 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159493920 495743716 /nfs/dbraw/zinc/74/37/16/495743716.db2.gz JBNXGQSDILKWFH-UYAOXDASSA-N 1 3 360.546 3.021 20 70 FGIDHO CC(C)N(CCN(C)C)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159493920 495743721 /nfs/dbraw/zinc/74/37/21/495743721.db2.gz JBNXGQSDILKWFH-UYAOXDASSA-N 1 3 360.546 3.021 20 70 FGIDHO COc1cc([C@H](C)NCCN2CCC([NH+](C)C)CC2)ccc1SC ZINC000160249420 495917814 /nfs/dbraw/zinc/91/78/14/495917814.db2.gz PRAWIJFVKXUVHU-HNNXBMFYSA-N 1 3 351.560 3.094 20 70 FGIDHO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000160405082 495955420 /nfs/dbraw/zinc/95/54/20/495955420.db2.gz VEOFXHHDEZTKKV-KDURUIRLSA-N 1 3 366.594 3.260 20 70 FGIDHO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000160405082 495955425 /nfs/dbraw/zinc/95/54/25/495955425.db2.gz VEOFXHHDEZTKKV-KDURUIRLSA-N 1 3 366.594 3.260 20 70 FGIDHO C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000160405353 495955857 /nfs/dbraw/zinc/95/58/57/495955857.db2.gz VEOFXHHDEZTKKV-RTBURBONSA-N 1 3 366.594 3.260 20 70 FGIDHO CCN1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000159856575 495824961 /nfs/dbraw/zinc/82/49/61/495824961.db2.gz OHTGLKRLQCADLJ-UHFFFAOYSA-N 1 3 372.557 3.300 20 70 FGIDHO CCC[NH+]1CCC(N(C)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1 ZINC000159939893 495846670 /nfs/dbraw/zinc/84/66/70/495846670.db2.gz GNEQKBBBSDTUFN-ICSRJNTNSA-N 1 3 372.557 3.165 20 70 FGIDHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000160181225 495903518 /nfs/dbraw/zinc/90/35/18/495903518.db2.gz UZMUGKOEWXHIBH-LBPRGKRZSA-N 1 3 360.365 3.187 20 70 FGIDHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005447 496083303 /nfs/dbraw/zinc/08/33/03/496083303.db2.gz CBMREKQESRQVSI-DLBZAZTESA-N 1 3 363.933 3.407 20 70 FGIDHO CCN(CC)C(=O)C[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000161097443 496102850 /nfs/dbraw/zinc/10/28/50/496102850.db2.gz LHBRSECPQCIHOM-XSLAUPDRSA-N 1 3 357.542 3.419 20 70 FGIDHO CCN(CC)C(=O)C[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000161097443 496102855 /nfs/dbraw/zinc/10/28/55/496102855.db2.gz LHBRSECPQCIHOM-XSLAUPDRSA-N 1 3 357.542 3.419 20 70 FGIDHO CCN(C(=O)NC[C@@H](C)C[NH+]1CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000159400738 495725289 /nfs/dbraw/zinc/72/52/89/495725289.db2.gz NZQWBIITBPLXBR-TZIWHRDSSA-N 1 3 372.557 3.024 20 70 FGIDHO C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000160564355 495992558 /nfs/dbraw/zinc/99/25/58/495992558.db2.gz PMVHAKQWOABOCL-WFXMLNOXSA-N 1 3 353.510 3.187 20 70 FGIDHO CC[C@@H]([NH2+]CCCOC1CCN(Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000159743349 495798593 /nfs/dbraw/zinc/79/85/93/495798593.db2.gz IPSYLHZPLNQHHE-RBBKRZOGSA-N 1 3 360.542 3.462 20 70 FGIDHO C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292223 496145297 /nfs/dbraw/zinc/14/52/97/496145297.db2.gz AUCSNRZFOHLNPX-QVKFZJNVSA-N 1 3 369.484 3.140 20 70 FGIDHO