smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3c4ccccc4C[C@H]3C)cn2)CC1 ZINC000159494085 495744703 /nfs/dbraw/zinc/74/47/03/495744703.db2.gz CCDHTKXIDNZZJY-VGSWGCGISA-N 2 0 350.510 3.247 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494074 495745647 /nfs/dbraw/zinc/74/56/47/495745647.db2.gz JBNXGQSDILKWFH-AZUAARDMSA-N 2 0 360.546 3.021 20 70 FGIDRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCc3c2cnn3C)cc1 ZINC000160282481 495925745 /nfs/dbraw/zinc/92/57/45/495925745.db2.gz ASQJHNXOUVLKIB-HXUWFJFHSA-N 2 0 356.514 3.308 20 70 FGIDRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000160719233 496027226 /nfs/dbraw/zinc/02/72/26/496027226.db2.gz RFVKTOMOPCOLHK-CRAIPNDOSA-N 2 0 374.554 3.401 20 70 FGIDRP C[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc(OCC[NH+](C)C)c1 ZINC000161122724 496108846 /nfs/dbraw/zinc/10/88/46/496108846.db2.gz ZSGKIDLNSUOOGV-MRXNPFEDSA-N 2 0 356.466 3.249 20 70 FGIDRP C[NH+](C)CCCC1CC[NH+](CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000161332429 496153616 /nfs/dbraw/zinc/15/36/16/496153616.db2.gz UTTSBFLNRQYPGM-UHFFFAOYSA-N 2 0 351.579 3.325 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3c4ccccc4C[C@@H]3C)cn2)CC1 ZINC000159493830 495743351 /nfs/dbraw/zinc/74/33/51/495743351.db2.gz CCDHTKXIDNZZJY-JTSKRJEESA-N 2 0 350.510 3.247 20 70 FGIDRP COC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000160234917 495915234 /nfs/dbraw/zinc/91/52/34/495915234.db2.gz CZNGSKQKOKARKN-GOSISDBHSA-N 2 0 373.463 3.009 20 70 FGIDRP COc1cc(OC)c([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1Cl ZINC000160262770 495921617 /nfs/dbraw/zinc/92/16/17/495921617.db2.gz HPPJPPOVNVZDCI-CQSZACIVSA-N 2 0 369.937 3.034 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000160271441 495923259 /nfs/dbraw/zinc/92/32/59/495923259.db2.gz UOLYWDHULNZWNJ-INIZCTEOSA-N 2 0 358.555 3.487 20 70 FGIDRP c1cc(CN2CCOCC2)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000160568321 495993306 /nfs/dbraw/zinc/99/33/06/495993306.db2.gz LUVACYZSADQRLO-UHFFFAOYSA-N 2 0 371.569 3.406 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)NC[C@H]2CCCC[N@@H+]2CC(C)C)CC1 ZINC000161011621 496085428 /nfs/dbraw/zinc/08/54/28/496085428.db2.gz JNENEDLFKNIAQF-LJQANCHMSA-N 2 0 352.567 3.013 20 70 FGIDRP CCOc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161282390 496144419 /nfs/dbraw/zinc/14/44/19/496144419.db2.gz LYZMMVFNKJYHLL-KRWDZBQOSA-N 2 0 369.509 3.228 20 70 FGIDRP COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000161298365 496145938 /nfs/dbraw/zinc/14/59/38/496145938.db2.gz XTZIFHGNXPKGPR-KKSFZXQISA-N 2 0 358.482 3.020 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](CC(C)C)c3ccccn3)cn2)CC1 ZINC000159466910 495739380 /nfs/dbraw/zinc/73/93/80/495739380.db2.gz MFPIFSBYLVHKMP-NRFANRHFSA-N 2 0 367.541 3.496 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OC)c(F)c3)cn2)CC1 ZINC000159483952 495742555 /nfs/dbraw/zinc/74/25/55/495742555.db2.gz VNEVCVJLLIPMEY-MRXNPFEDSA-N 2 0 372.488 3.222 20 70 FGIDRP C[NH+](C)Cc1ccc(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000159599740 495767960 /nfs/dbraw/zinc/76/79/60/495767960.db2.gz GNOFJFMIGGGJBW-NRFANRHFSA-N 2 0 351.494 3.315 20 70 FGIDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)N2CCc3ccccc3C2)[C@H](C)C1 ZINC000159804846 495812784 /nfs/dbraw/zinc/81/27/84/495812784.db2.gz JRFQNUKSULSZOH-VIZSFHNOSA-N 2 0 373.585 3.160 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1Br ZINC000160181496 495903050 /nfs/dbraw/zinc/90/30/50/495903050.db2.gz YMILNHJDSFRXDO-AWEZNQCLSA-N 2 0 354.336 3.126 20 70 FGIDRP CCOc1cccc([C@@H](C)[NH2+]CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000160379388 495949579 /nfs/dbraw/zinc/94/95/79/495949579.db2.gz CFKLKYFPOVXKJY-UTKZUKDTSA-N 2 0 369.509 3.155 20 70 FGIDRP C[C@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000160587508 495997912 /nfs/dbraw/zinc/99/79/12/495997912.db2.gz PKKHJNXOESGFAM-FUHWJXTLSA-N 2 0 367.493 3.404 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690688 496021246 /nfs/dbraw/zinc/02/12/46/496021246.db2.gz RFWSYWOITGHKEE-UKRRQHHQSA-N 2 0 373.310 3.476 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3c4cc(F)ccc4C[C@H]3C)cn2)CC1 ZINC000159542967 495755955 /nfs/dbraw/zinc/75/59/55/495755955.db2.gz MLHHZCYUPOHQRA-ZHRRBRCNSA-N 2 0 368.500 3.386 20 70 FGIDRP C[C@@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+](C)Cc1ccccc1 ZINC000159586009 495764714 /nfs/dbraw/zinc/76/47/14/495764714.db2.gz QPGXVFPRHMCZIL-PZJWPPBQSA-N 2 0 372.557 3.167 20 70 FGIDRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)CC[C@@H]1CCCC[NH+]1C ZINC000160012612 495863582 /nfs/dbraw/zinc/86/35/82/495863582.db2.gz IOGTYAVMYRGKPC-GIVPXCGWSA-N 2 0 372.557 3.023 20 70 FGIDRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCc3c2cnn3C)cc1 ZINC000160282613 495926128 /nfs/dbraw/zinc/92/61/28/495926128.db2.gz ASQJHNXOUVLKIB-FQEVSTJZSA-N 2 0 356.514 3.308 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NCCC[N@H+](C)C2CCCCC2)CC1 ZINC000160312506 495932340 /nfs/dbraw/zinc/93/23/40/495932340.db2.gz SENAEJQXXGLQKM-UHFFFAOYSA-N 2 0 366.594 3.404 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686189 496019684 /nfs/dbraw/zinc/01/96/84/496019684.db2.gz NSUDCBXWKSVZHC-HUUCEWRRSA-N 2 0 355.320 3.337 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685797 496019839 /nfs/dbraw/zinc/01/98/39/496019839.db2.gz BPTWMKNDWANJLQ-QWHCGFSZSA-N 2 0 361.349 3.398 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000160761539 496036780 /nfs/dbraw/zinc/03/67/80/496036780.db2.gz FWHZJUQBDANQKB-GOEBONIOSA-N 2 0 360.420 3.473 20 70 FGIDRP Cc1nc2ccccn2c1C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000160982056 496079101 /nfs/dbraw/zinc/07/91/01/496079101.db2.gz BBKQSHZWXHQKSA-HDICACEKSA-N 2 0 370.541 3.354 20 70 FGIDRP Cc1cc(C)cc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000161195564 496125080 /nfs/dbraw/zinc/12/50/80/496125080.db2.gz VGYIMPSKLOGQEQ-SFHVURJKSA-N 2 0 353.510 3.446 20 70 FGIDRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161233820 496133436 /nfs/dbraw/zinc/13/34/36/496133436.db2.gz OODYCVAPSPFCMZ-IERDGZPVSA-N 2 0 351.494 3.001 20 70 FGIDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)c1 ZINC000161260178 496139695 /nfs/dbraw/zinc/13/96/95/496139695.db2.gz AUDKRYWTDJCETD-SFHVURJKSA-N 2 0 353.510 3.446 20 70 FGIDRP C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[N@H+](C)Cc1ccccc1 ZINC000159586148 495764629 /nfs/dbraw/zinc/76/46/29/495764629.db2.gz QPGXVFPRHMCZIL-TZIWHRDSSA-N 2 0 372.557 3.167 20 70 FGIDRP C[C@H]1C[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CN1C1CC1 ZINC000159743915 495798881 /nfs/dbraw/zinc/79/88/81/495798881.db2.gz WZTQQVPKESWBNY-FPOVZHCZSA-N 2 0 371.569 3.273 20 70 FGIDRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C1CCOCC1 ZINC000159761080 495803563 /nfs/dbraw/zinc/80/35/63/495803563.db2.gz OLMLZJHCACTSKC-IBGZPJMESA-N 2 0 360.542 3.462 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159920062 495841652 /nfs/dbraw/zinc/84/16/52/495841652.db2.gz IMXKNWNOYMPLNX-GHTZIAJQSA-N 2 0 372.557 3.023 20 70 FGIDRP CCOc1ccc([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1OCC ZINC000160285270 495927077 /nfs/dbraw/zinc/92/70/77/495927077.db2.gz JKLMZTOWJWHSBI-QGZVFWFLSA-N 2 0 363.546 3.161 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(-c2ccncc2)c1 ZINC000160295097 495929500 /nfs/dbraw/zinc/92/95/00/495929500.db2.gz DZULNGVKGARUQF-GOSISDBHSA-N 2 0 352.526 3.425 20 70 FGIDRP c1ccc(CN2CCOCC2)c(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000160422014 495959118 /nfs/dbraw/zinc/95/91/18/495959118.db2.gz TVZHIBXUXQRMJQ-UHFFFAOYSA-N 2 0 371.569 3.406 20 70 FGIDRP C[C@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160482262 495973806 /nfs/dbraw/zinc/97/38/06/495973806.db2.gz ANNWYJVLXYUJDY-CYBMUJFWSA-N 2 0 355.324 3.031 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1)c1ccccc1 ZINC000160541800 495988604 /nfs/dbraw/zinc/98/86/04/495988604.db2.gz UIUNSNDUQXIJJO-UNMCSNQZSA-N 2 0 351.494 3.146 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000160685930 496020001 /nfs/dbraw/zinc/02/00/01/496020001.db2.gz BPTWMKNDWANJLQ-CHWSQXEVSA-N 2 0 361.349 3.398 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000160760948 496037334 /nfs/dbraw/zinc/03/73/34/496037334.db2.gz GELZVNWDINKVGG-GOEBONIOSA-N 2 0 360.420 3.473 20 70 FGIDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000161250528 496137036 /nfs/dbraw/zinc/13/70/36/496137036.db2.gz POZUZRHELVUZHX-HNNXBMFYSA-N 2 0 371.550 3.379 20 70 FGIDRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292570 496146427 /nfs/dbraw/zinc/14/64/27/496146427.db2.gz AUCSNRZFOHLNPX-BTYIYWSLSA-N 2 0 369.484 3.140 20 70 FGIDRP COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000161298685 496146703 /nfs/dbraw/zinc/14/67/03/496146703.db2.gz XTZIFHGNXPKGPR-IIBYNOLFSA-N 2 0 358.482 3.020 20 70 FGIDRP CC[NH+](CC)[C@H](C)CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159601455 495768202 /nfs/dbraw/zinc/76/82/02/495768202.db2.gz JQWUPYBDHGOYII-GOSISDBHSA-N 2 0 352.567 3.014 20 70 FGIDRP CC[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000159742949 495798464 /nfs/dbraw/zinc/79/84/64/495798464.db2.gz IPSYLHZPLNQHHE-IRLDBZIGSA-N 2 0 360.542 3.462 20 70 FGIDRP C[C@H]1CCC[N@H+](CCCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160358760 495945060 /nfs/dbraw/zinc/94/50/60/495945060.db2.gz NJKWYOKRCUWKPT-IBGZPJMESA-N 2 0 366.594 3.262 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC1 ZINC000160421284 495958787 /nfs/dbraw/zinc/95/87/87/495958787.db2.gz UHHJPSRYQAKXND-UHFFFAOYSA-N 2 0 360.546 3.012 20 70 FGIDRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000161168357 496119014 /nfs/dbraw/zinc/11/90/14/496119014.db2.gz ZUCJORUEXTZOFM-HSZRJFAPSA-N 2 0 366.505 3.429 20 70 FGIDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C(C)(C)c1ccccc1 ZINC000161204702 496127109 /nfs/dbraw/zinc/12/71/09/496127109.db2.gz SBTKVNMWRLZLNW-SFHVURJKSA-N 2 0 367.537 3.434 20 70 FGIDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446476 495734447 /nfs/dbraw/zinc/73/44/47/495734447.db2.gz GZLCORSKJJBNMD-QGZVFWFLSA-N 2 0 373.501 3.016 20 70 FGIDRP C[C@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000160358502 495944747 /nfs/dbraw/zinc/94/47/47/495944747.db2.gz CCIYCJHUVRNCDZ-RXVVDRJESA-N 2 0 372.557 3.023 20 70 FGIDRP CCC[NH+]1CCC(NC(=O)N(CC)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000160399050 495954636 /nfs/dbraw/zinc/95/46/36/495954636.db2.gz CCKJLBGWCONNBP-OAQYLSRUSA-N 2 0 372.557 3.167 20 70 FGIDRP C[C@@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000160587392 495998241 /nfs/dbraw/zinc/99/82/41/495998241.db2.gz PKKHJNXOESGFAM-AEFFLSMTSA-N 2 0 367.493 3.404 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(Br)c1 ZINC000160675347 496016843 /nfs/dbraw/zinc/01/68/43/496016843.db2.gz DVHCQYXRHMHFJY-DZGCQCFKSA-N 2 0 373.310 3.476 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCc2cc(Br)ccc21 ZINC000160675691 496017069 /nfs/dbraw/zinc/01/70/69/496017069.db2.gz XCKMTMWJKVJZAK-SJLPKXTDSA-N 2 0 367.331 3.263 20 70 FGIDRP COc1cc(OC)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160743048 496033419 /nfs/dbraw/zinc/03/34/19/496033419.db2.gz QYLBDYLPSZWTGK-HUUCEWRRSA-N 2 0 370.921 3.245 20 70 FGIDRP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1C ZINC000161218794 496129424 /nfs/dbraw/zinc/12/94/24/496129424.db2.gz KCZNRBAOKQDKEI-GOSISDBHSA-N 2 0 353.510 3.446 20 70 FGIDRP C[N@@H+]1CCC[C@@H]2CN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC[C@H]21 ZINC000159451820 495736200 /nfs/dbraw/zinc/73/62/00/495736200.db2.gz HCECGSKOBZNOEB-NHCUHLMSSA-N 2 0 369.553 3.231 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000159494361 495745345 /nfs/dbraw/zinc/74/53/45/495745345.db2.gz JBNXGQSDILKWFH-ICSRJNTNSA-N 2 0 360.546 3.021 20 70 FGIDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1OC ZINC000159532215 495753883 /nfs/dbraw/zinc/75/38/83/495753883.db2.gz DAWYMICPCUJMBW-FQEVSTJZSA-N 2 0 368.525 3.473 20 70 FGIDRP C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+](C)Cc1ccccc1 ZINC000159585906 495764042 /nfs/dbraw/zinc/76/40/42/495764042.db2.gz QPGXVFPRHMCZIL-CTNGQTDRSA-N 2 0 372.557 3.167 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cnc(C)nc2C)CC1 ZINC000160347022 495940938 /nfs/dbraw/zinc/94/09/38/495940938.db2.gz XASUXHBWGOPKGV-QGZVFWFLSA-N 2 0 367.541 3.082 20 70 FGIDRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000160719339 496027462 /nfs/dbraw/zinc/02/74/62/496027462.db2.gz RFVKTOMOPCOLHK-MAUKXSAKSA-N 2 0 374.554 3.401 20 70 FGIDRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cnc4ccccn34)CC2)C[C@H](C)O1 ZINC000160981786 496078543 /nfs/dbraw/zinc/07/85/43/496078543.db2.gz PIESUZHJYZRGOM-ROUUACIJSA-N 2 0 356.514 3.046 20 70 FGIDRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(OC)c1 ZINC000161219334 496129617 /nfs/dbraw/zinc/12/96/17/496129617.db2.gz FBOIKMWDDGWZIO-OAQYLSRUSA-N 2 0 369.509 3.228 20 70 FGIDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000161228277 496132409 /nfs/dbraw/zinc/13/24/09/496132409.db2.gz TYIMCHMGVMUTIY-KRWDZBQOSA-N 2 0 365.521 3.318 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)c1 ZINC000161231877 496133619 /nfs/dbraw/zinc/13/36/19/496133619.db2.gz KOPFASFKFXHGQU-IBGZPJMESA-N 2 0 369.509 3.374 20 70 FGIDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000161250606 496137112 /nfs/dbraw/zinc/13/71/12/496137112.db2.gz POZUZRHELVUZHX-OAHLLOKOSA-N 2 0 371.550 3.379 20 70 FGIDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260672 496139549 /nfs/dbraw/zinc/13/95/49/496139549.db2.gz MOYVZFXJPRQKQS-HXUWFJFHSA-N 2 0 368.525 3.031 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccccc3OC)cn2)CC1 ZINC000159495428 495744641 /nfs/dbraw/zinc/74/46/41/495744641.db2.gz MRUFXKQDWGICJJ-QGZVFWFLSA-N 2 0 354.498 3.083 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(F)cc(F)c3)cn2)CC1 ZINC000159509366 495748477 /nfs/dbraw/zinc/74/84/77/495748477.db2.gz SRZRPOZVAAGOSQ-OAHLLOKOSA-N 2 0 360.452 3.353 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4ccc(C)cc43)cn2)CC1 ZINC000159517972 495749978 /nfs/dbraw/zinc/74/99/78/495749978.db2.gz VHCIHAHEKQHNMN-NRFANRHFSA-N 2 0 350.510 3.309 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005814 496083755 /nfs/dbraw/zinc/08/37/55/496083755.db2.gz CBMREKQESRQVSI-SJORKVTESA-N 2 0 363.933 3.407 20 70 FGIDRP CCOc1ccccc1[C@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161268544 496140397 /nfs/dbraw/zinc/14/03/97/496140397.db2.gz JRMGXTOIGQYOQV-KRWDZBQOSA-N 2 0 369.509 3.228 20 70 FGIDRP COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000161298483 496145979 /nfs/dbraw/zinc/14/59/79/496145979.db2.gz XTZIFHGNXPKGPR-IERDGZPVSA-N 2 0 358.482 3.020 20 70 FGIDRP CC(C)[NH+](CCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)C(C)C ZINC000216910739 496993136 /nfs/dbraw/zinc/99/31/36/496993136.db2.gz SCODUEDVHVPFSO-FQEVSTJZSA-N 2 0 360.546 3.021 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000159718073 495793575 /nfs/dbraw/zinc/79/35/75/495793575.db2.gz YHUFBWICJZRCDT-HXUWFJFHSA-N 2 0 360.546 3.053 20 70 FGIDRP C[NH+]1CCC(CCNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)CC1 ZINC000159772138 495805673 /nfs/dbraw/zinc/80/56/73/495805673.db2.gz SALDSWNGCNIMJZ-UHFFFAOYSA-N 2 0 364.578 3.016 20 70 FGIDRP COc1cccc(CCC[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1 ZINC000159956618 495849603 /nfs/dbraw/zinc/84/96/03/495849603.db2.gz BFAOJGJZCLCWCX-WOJBJXKFSA-N 2 0 359.558 3.118 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000160179807 495901855 /nfs/dbraw/zinc/90/18/55/495901855.db2.gz PHYAGGVCYCYYGG-GOSISDBHSA-N 2 0 351.922 3.169 20 70 FGIDRP CC(C)[C@H]1C[N@H+](C)CCN1C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000160202482 495908131 /nfs/dbraw/zinc/90/81/31/495908131.db2.gz LQSURGKQWZSVJM-GHTZIAJQSA-N 2 0 372.557 3.194 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000160293276 495927735 /nfs/dbraw/zinc/92/77/35/495927735.db2.gz FCXCVTBAPKPFDN-SFHVURJKSA-N 2 0 371.447 3.188 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000160293141 495928235 /nfs/dbraw/zinc/92/82/35/495928235.db2.gz FCXCVTBAPKPFDN-GOSISDBHSA-N 2 0 371.447 3.188 20 70 FGIDRP Cc1cc([C@H](C)[NH2+]CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307518 495931748 /nfs/dbraw/zinc/93/17/48/495931748.db2.gz ROGOVCDJZJIOGZ-KXBFYZLASA-N 2 0 359.539 3.435 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cnn(C(C)C)c3)cc2)CC1 ZINC000160329333 495937391 /nfs/dbraw/zinc/93/73/91/495937391.db2.gz XTTDFGLWBIIDNR-IBGZPJMESA-N 2 0 369.557 3.452 20 70 FGIDRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N(CC[NH+](C)C)C2CCCC2)C1 ZINC000160405219 495955802 /nfs/dbraw/zinc/95/58/02/495955802.db2.gz VEOFXHHDEZTKKV-OALUTQOASA-N 2 0 366.594 3.260 20 70 FGIDRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000160872313 496057462 /nfs/dbraw/zinc/05/74/62/496057462.db2.gz UHININYBMPGOBW-SFHVURJKSA-N 2 0 353.510 3.446 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4cc(F)ccc4C[C@H]3C)cn2)CC1 ZINC000159543092 495755930 /nfs/dbraw/zinc/75/59/30/495755930.db2.gz MLHHZCYUPOHQRA-OPAMFIHVSA-N 2 0 368.500 3.386 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000159717943 495793688 /nfs/dbraw/zinc/79/36/88/495793688.db2.gz YHUFBWICJZRCDT-FQEVSTJZSA-N 2 0 360.546 3.053 20 70 FGIDRP CCN(C(=O)NCCC1CC[NH+](C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000160057094 495873482 /nfs/dbraw/zinc/87/34/82/495873482.db2.gz GJHWIFFIHBNNRG-NRFANRHFSA-N 2 0 372.557 3.024 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000160169845 495900447 /nfs/dbraw/zinc/90/04/47/495900447.db2.gz DGZWAAMKIRZOAS-SFHVURJKSA-N 2 0 366.347 3.052 20 70 FGIDRP COCCOc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1OC ZINC000161066822 496096570 /nfs/dbraw/zinc/09/65/70/496096570.db2.gz KVTBQDMIRSKESD-NJAFHUGGSA-N 2 0 350.503 3.244 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(F)cc(F)c3)cn2)CC1 ZINC000159509228 495749378 /nfs/dbraw/zinc/74/93/78/495749378.db2.gz SRZRPOZVAAGOSQ-HNNXBMFYSA-N 2 0 360.452 3.353 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OC)cc3)cn2)CC1 ZINC000159525778 495752849 /nfs/dbraw/zinc/75/28/49/495752849.db2.gz QDJOJWZVVKMMJN-QGZVFWFLSA-N 2 0 354.498 3.083 20 70 FGIDRP C[NH+](C)Cc1ccc(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000159599880 495767775 /nfs/dbraw/zinc/76/77/75/495767775.db2.gz GNOFJFMIGGGJBW-OAQYLSRUSA-N 2 0 351.494 3.315 20 70 FGIDRP C[C@H]1C[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000159705393 495791897 /nfs/dbraw/zinc/79/18/97/495791897.db2.gz LPGHPNKNJDEYNO-FPOVZHCZSA-N 3 0 359.558 3.130 20 70 FGIDRP CCC[N@@H+]1CC[C@@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000159766142 495805208 /nfs/dbraw/zinc/80/52/08/495805208.db2.gz KCRFYNRYGQWRGC-FQEVSTJZSA-N 2 0 364.578 3.016 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000159939753 495845492 /nfs/dbraw/zinc/84/54/92/495845492.db2.gz GNEQKBBBSDTUFN-AZUAARDMSA-N 2 0 372.557 3.165 20 70 FGIDRP C[NH+](C)CC[C@@H](NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)C(C)(C)C ZINC000160217924 495912041 /nfs/dbraw/zinc/91/20/41/495912041.db2.gz XGRSQBPSBZIBMG-ZWKOTPCHSA-N 2 0 352.567 3.013 20 70 FGIDRP CCN(CC)C(=O)C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000161097361 496102168 /nfs/dbraw/zinc/10/21/68/496102168.db2.gz LHBRSECPQCIHOM-LBFURVHYSA-N 2 0 357.542 3.419 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159724117 495795123 /nfs/dbraw/zinc/79/51/23/495795123.db2.gz MDMCNDOUYMUCHU-QTEQDKRBSA-N 3 0 373.585 3.376 20 70 FGIDRP C[C@H]1C[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CN1C1CC1 ZINC000159744158 495799870 /nfs/dbraw/zinc/79/98/70/495799870.db2.gz WZTQQVPKESWBNY-PZJWPPBQSA-N 2 0 371.569 3.273 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000159781402 495806989 /nfs/dbraw/zinc/80/69/89/495806989.db2.gz SJAFWIOIAKZKQV-UHFFFAOYSA-N 2 0 372.557 3.300 20 70 FGIDRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160220226 495912894 /nfs/dbraw/zinc/91/28/94/495912894.db2.gz QUEIQUOXJXXWPB-CVEARBPZSA-N 2 0 360.571 3.404 20 70 FGIDRP CC1CC[NH+](CCCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)CC1 ZINC000160354792 495943397 /nfs/dbraw/zinc/94/33/97/495943397.db2.gz NUSYJOVYQMNMRO-UHFFFAOYSA-N 2 0 366.594 3.262 20 70 FGIDRP CC[NH+]1CCC(NC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000160753522 496036095 /nfs/dbraw/zinc/03/60/95/496036095.db2.gz PQKGRMGHGJOTEI-SFHVURJKSA-N 2 0 364.578 3.157 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000161260570 496139828 /nfs/dbraw/zinc/13/98/28/496139828.db2.gz SLWKPQCYZIXXQE-GOSISDBHSA-N 2 0 357.523 3.207 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)NC[C@H](c1ccccc1OC)[NH+]1CCCCC1 ZINC000161268363 496140328 /nfs/dbraw/zinc/14/03/28/496140328.db2.gz IMTWNKZBQNGKMV-GOSISDBHSA-N 2 0 361.530 3.104 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000161268501 496140869 /nfs/dbraw/zinc/14/08/69/496140869.db2.gz JSJPEXCWJNCEQI-KRWDZBQOSA-N 2 0 351.922 3.358 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)cn2)CC1 ZINC000159466039 495738266 /nfs/dbraw/zinc/73/82/66/495738266.db2.gz ZGGHZCXPORRDRA-QFIPXVFZSA-N 2 0 364.537 3.334 20 70 FGIDRP O=C(c1ccc(Cl)cc1)N1CCC([NH2+]CCCC[NH+]2CCCC2)CC1 ZINC000159647837 495776999 /nfs/dbraw/zinc/77/69/99/495776999.db2.gz ZNUXYDVPDFESOG-UHFFFAOYSA-N 2 0 363.933 3.410 20 70 FGIDRP CC(C)Oc1ccc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@@H]2C)cn1 ZINC000160100087 495883115 /nfs/dbraw/zinc/88/31/15/495883115.db2.gz NWLBVWVBXOMDND-PXNSSMCTSA-N 2 0 354.498 3.264 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)(F)F ZINC000160676393 496017222 /nfs/dbraw/zinc/01/72/22/496017222.db2.gz FDTIPNDLBLZBJC-LSDHHAIUSA-N 2 0 360.420 3.473 20 70 FGIDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc(F)cc(F)c1 ZINC000161252518 496138119 /nfs/dbraw/zinc/13/81/19/496138119.db2.gz YCJMEDMHOVVPRP-AWEZNQCLSA-N 2 0 361.436 3.107 20 70 FGIDRP C[C@@H]1C[NH+](CCC2CC[NH+](CCC[NH+]3CCCCC3)CC2)C[C@@H](C)O1 ZINC000161399109 496168992 /nfs/dbraw/zinc/16/89/92/496168992.db2.gz KPRHJPDYUWJQQE-WOJBJXKFSA-N 2 0 351.579 3.074 20 70 FGIDRP Cc1cccc2nc(C[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)cn21 ZINC000160290355 495928188 /nfs/dbraw/zinc/92/81/88/495928188.db2.gz GETLTKREZQQJDT-QGZVFWFLSA-N 2 0 352.482 3.434 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cncc(F)c3)cc2)CC1 ZINC000160325454 495936149 /nfs/dbraw/zinc/93/61/49/495936149.db2.gz QFURWDJXIKXWSA-QGZVFWFLSA-N 2 0 356.489 3.209 20 70 FGIDRP O=C1C[C@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c2ccccc2N1 ZINC000160581385 495997284 /nfs/dbraw/zinc/99/72/84/495997284.db2.gz GYIUIZBEYDAFHH-LJQANCHMSA-N 2 0 363.505 3.409 20 70 FGIDRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000160711560 496025557 /nfs/dbraw/zinc/02/55/57/496025557.db2.gz RMHJQXSILGVMEI-LAUBAEHRSA-N 2 0 356.514 3.068 20 70 FGIDRP C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160867020 496057991 /nfs/dbraw/zinc/05/79/91/496057991.db2.gz USIWOPJCRWPWOH-GOSISDBHSA-N 2 0 366.594 3.260 20 70 FGIDRP CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000161029512 496089306 /nfs/dbraw/zinc/08/93/06/496089306.db2.gz HRDPNLDOKPKGBC-VQTJNVASSA-N 2 0 364.578 3.157 20 70 FGIDRP C[C@H](NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)C(C)(C)C[NH+](C)C ZINC000160032105 495868151 /nfs/dbraw/zinc/86/81/51/495868151.db2.gz JMNYLLLENWGBCG-SFHVURJKSA-N 2 0 366.594 3.260 20 70 FGIDRP CC[NH+]1CCN([C@@H]2CCN(Cc3ncc(-c4ccccc4)s3)C2)CC1 ZINC000160051097 495872557 /nfs/dbraw/zinc/87/25/57/495872557.db2.gz BKKBPCLZBSVWFK-GOSISDBHSA-N 2 0 356.539 3.022 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1Br ZINC000160181640 495903080 /nfs/dbraw/zinc/90/30/80/495903080.db2.gz YMILNHJDSFRXDO-CQSZACIVSA-N 2 0 354.336 3.126 20 70 FGIDRP C[NH+](C)CC[C@H](NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)C(C)(C)C ZINC000160218059 495911960 /nfs/dbraw/zinc/91/19/60/495911960.db2.gz XGRSQBPSBZIBMG-ROUUACIJSA-N 2 0 352.567 3.013 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000160271523 495923789 /nfs/dbraw/zinc/92/37/89/495923789.db2.gz UOLYWDHULNZWNJ-MRXNPFEDSA-N 2 0 358.555 3.487 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CC3(CCCC3)Oc3ccccc32)CC1 ZINC000160275257 495924888 /nfs/dbraw/zinc/92/48/88/495924888.db2.gz RIIWBSFSPWJDJW-HXUWFJFHSA-N 2 0 357.542 3.439 20 70 FGIDRP C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160315738 495933991 /nfs/dbraw/zinc/93/39/91/495933991.db2.gz SBLQIQKWCMMKPY-RTBURBONSA-N 2 0 366.594 3.118 20 70 FGIDRP C[C@@H](Cn1cc(Br)cn1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160482128 495972143 /nfs/dbraw/zinc/97/21/43/495972143.db2.gz ANNWYJVLXYUJDY-ZDUSSCGKSA-N 2 0 355.324 3.031 20 70 FGIDRP CCn1nc(C)c([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1C ZINC000161214962 496128123 /nfs/dbraw/zinc/12/81/23/496128123.db2.gz MAGVESIZEYLJLX-INIZCTEOSA-N 2 0 370.541 3.327 20 70 FGIDRP Cc1cccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1C ZINC000161218918 496129375 /nfs/dbraw/zinc/12/93/75/496129375.db2.gz KCZNRBAOKQDKEI-SFHVURJKSA-N 2 0 353.510 3.446 20 70 FGIDRP CCOc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161268410 496140267 /nfs/dbraw/zinc/14/02/67/496140267.db2.gz JRMGXTOIGQYOQV-QGZVFWFLSA-N 2 0 369.509 3.228 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605799 496001496 /nfs/dbraw/zinc/00/14/96/496001496.db2.gz YWOFTLIGVBCHIO-FCHUYYIVSA-N 2 0 365.521 3.016 20 70 FGIDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186647 496122069 /nfs/dbraw/zinc/12/20/69/496122069.db2.gz IPNVCDRUFFPSNU-INIZCTEOSA-N 2 0 364.493 3.370 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(F)ccc43)cn2)CC1 ZINC000159462560 495737652 /nfs/dbraw/zinc/73/76/52/495737652.db2.gz DVXBBXMPCKDPPX-HXUWFJFHSA-N 2 0 354.473 3.140 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000160169267 495901013 /nfs/dbraw/zinc/90/10/13/495901013.db2.gz KGGWRXLKOLSBRE-CYBMUJFWSA-N 2 0 372.326 3.265 20 70 FGIDRP CC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC ZINC000160174783 495902335 /nfs/dbraw/zinc/90/23/35/495902335.db2.gz CBDZRGKILYLWMO-SFHVURJKSA-N 2 0 353.938 3.415 20 70 FGIDRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCc2c1cnn2C ZINC000160303154 495930847 /nfs/dbraw/zinc/93/08/47/495930847.db2.gz LXGOJLJRVZMXTH-LJQANCHMSA-N 2 0 356.514 3.308 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000160761658 496036914 /nfs/dbraw/zinc/03/69/14/496036914.db2.gz FWHZJUQBDANQKB-GDBMZVCRSA-N 2 0 360.420 3.473 20 70 FGIDRP CCc1nc(C)c([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161202248 496125717 /nfs/dbraw/zinc/12/57/17/496125717.db2.gz ANGZAFAEODUXHZ-AWEZNQCLSA-N 2 0 374.554 3.156 20 70 FGIDRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc2c(c1)OCO2 ZINC000161229241 496132252 /nfs/dbraw/zinc/13/22/52/496132252.db2.gz IMKADXGAKIDMOI-MRXNPFEDSA-N 2 0 368.477 3.223 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3cccc4C)cn2)CC1 ZINC000159473317 495739872 /nfs/dbraw/zinc/73/98/72/495739872.db2.gz JMGRIHHFAJFRFL-OAQYLSRUSA-N 2 0 350.510 3.309 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159724253 495795198 /nfs/dbraw/zinc/79/51/98/495795198.db2.gz MDMCNDOUYMUCHU-TXTKFYIRSA-N 3 0 373.585 3.376 20 70 FGIDRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160248640 495917767 /nfs/dbraw/zinc/91/77/67/495917767.db2.gz CXCJNIHPUKWFHG-CQSZACIVSA-N 2 0 352.592 3.426 20 70 FGIDRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160357912 495944476 /nfs/dbraw/zinc/94/44/76/495944476.db2.gz BNLAXCZTZGZOIV-IBGZPJMESA-N 2 0 366.594 3.404 20 70 FGIDRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cnn1-c1ccc(F)cc1 ZINC000160692511 496022181 /nfs/dbraw/zinc/02/21/81/496022181.db2.gz QNXSPFKGLLDJDH-OXQOHEQNSA-N 2 0 374.504 3.207 20 70 FGIDRP CC[NH+]1CCC(NC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000160753655 496036019 /nfs/dbraw/zinc/03/60/19/496036019.db2.gz PQKGRMGHGJOTEI-GOSISDBHSA-N 2 0 364.578 3.157 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103862 496104298 /nfs/dbraw/zinc/10/42/98/496104298.db2.gz ZIBLPEHYHKJDEK-MOPGFXCFSA-N 2 0 363.933 3.407 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103632 496104369 /nfs/dbraw/zinc/10/43/69/496104369.db2.gz ZIBLPEHYHKJDEK-OALUTQOASA-N 2 0 363.933 3.407 20 70 FGIDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1C ZINC000161236529 496134653 /nfs/dbraw/zinc/13/46/53/496134653.db2.gz UWWBNOXQIYAOTR-SFHVURJKSA-N 2 0 353.510 3.446 20 70 FGIDRP COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000161314834 496150297 /nfs/dbraw/zinc/15/02/97/496150297.db2.gz WHRYLKXLRPLEKH-KKSFZXQISA-N 2 0 358.482 3.020 20 70 FGIDRP O=C([C@@H]1CCCC[N@@H+]1Cc1ccccc1)N1CCC([NH2+]CC2CC2)CC1 ZINC000159842073 495823139 /nfs/dbraw/zinc/82/31/39/495823139.db2.gz ZDTKITNHCFWAOX-NRFANRHFSA-N 2 0 355.526 3.032 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)c1 ZINC000161204448 496127343 /nfs/dbraw/zinc/12/73/43/496127343.db2.gz MAXGXTRPRAXIJA-QFIPXVFZSA-N 2 0 365.521 3.089 20 70 FGIDRP COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000161298578 496146255 /nfs/dbraw/zinc/14/62/55/496146255.db2.gz XTZIFHGNXPKGPR-HRAATJIYSA-N 2 0 358.482 3.020 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccccc3OC)cn2)CC1 ZINC000159495308 495744739 /nfs/dbraw/zinc/74/47/39/495744739.db2.gz MRUFXKQDWGICJJ-KRWDZBQOSA-N 2 0 354.498 3.083 20 70 FGIDRP C[C@@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[N@H+](C)Cc1ccccc1 ZINC000159585780 495764554 /nfs/dbraw/zinc/76/45/54/495764554.db2.gz QPGXVFPRHMCZIL-FPOVZHCZSA-N 2 0 372.557 3.167 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000159940035 495846567 /nfs/dbraw/zinc/84/65/67/495846567.db2.gz GNEQKBBBSDTUFN-UYAOXDASSA-N 2 0 372.557 3.165 20 70 FGIDRP COc1cccc(CCC[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC000159956488 495849460 /nfs/dbraw/zinc/84/94/60/495849460.db2.gz BFAOJGJZCLCWCX-PMACEKPBSA-N 2 0 359.558 3.118 20 70 FGIDRP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161215101 496128527 /nfs/dbraw/zinc/12/85/27/496128527.db2.gz XTFPISZBRDOJMO-NRFANRHFSA-N 2 0 351.494 3.064 20 70 FGIDRP CC(C)n1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cn1 ZINC000161224736 496131113 /nfs/dbraw/zinc/13/11/13/496131113.db2.gz OUIGMRGFEAIGLA-QGZVFWFLSA-N 2 0 356.514 3.272 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000161291076 496144971 /nfs/dbraw/zinc/14/49/71/496144971.db2.gz YZOUDQNOTAQVLG-PPNDLDFTSA-N 2 0 357.542 3.455 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000159691512 495788335 /nfs/dbraw/zinc/78/83/35/495788335.db2.gz XWUZYHWABVZZSP-OALUTQOASA-N 2 0 374.573 3.125 20 70 FGIDRP C[C@@H]1C[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CN1C1CC1 ZINC000159744042 495800076 /nfs/dbraw/zinc/80/00/76/495800076.db2.gz WZTQQVPKESWBNY-TZIWHRDSSA-N 2 0 371.569 3.273 20 70 FGIDRP CCC[N@@H+]1CC[C@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000159766021 495805177 /nfs/dbraw/zinc/80/51/77/495805177.db2.gz KCRFYNRYGQWRGC-HXUWFJFHSA-N 2 0 364.578 3.016 20 70 FGIDRP CCCC[N@H+](C)CCNC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000159813675 495815901 /nfs/dbraw/zinc/81/59/01/495815901.db2.gz WAZWFBARHUOJNH-CTNGQTDRSA-N 2 0 374.573 3.413 20 70 FGIDRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)c1 ZINC000160183715 495903093 /nfs/dbraw/zinc/90/30/93/495903093.db2.gz BICFZAVLYXUUNH-HNNXBMFYSA-N 2 0 355.473 3.273 20 70 FGIDRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160357803 495944826 /nfs/dbraw/zinc/94/48/26/495944826.db2.gz BNLAXCZTZGZOIV-LJQANCHMSA-N 2 0 366.594 3.404 20 70 FGIDRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1c[nH]c2ncccc12 ZINC000161186788 496122355 /nfs/dbraw/zinc/12/23/55/496122355.db2.gz IPNVCDRUFFPSNU-MRXNPFEDSA-N 2 0 364.493 3.370 20 70 FGIDRP Cc1ccc([C@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)[NH+](C)C)cc1 ZINC000161210206 496128500 /nfs/dbraw/zinc/12/85/00/496128500.db2.gz KPKGIPNXVQVUBA-NRFANRHFSA-N 2 0 374.573 3.361 20 70 FGIDRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(OC)c1 ZINC000161219199 496129559 /nfs/dbraw/zinc/12/95/59/496129559.db2.gz FBOIKMWDDGWZIO-NRFANRHFSA-N 2 0 369.509 3.228 20 70 FGIDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)c1 ZINC000161260059 496139570 /nfs/dbraw/zinc/13/95/70/496139570.db2.gz AUDKRYWTDJCETD-GOSISDBHSA-N 2 0 353.510 3.446 20 70 FGIDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc2nc(C)ccc2c1 ZINC000161260810 496139894 /nfs/dbraw/zinc/13/98/94/496139894.db2.gz MOYVZFXJPRQKQS-FQEVSTJZSA-N 2 0 368.525 3.031 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159723986 495794670 /nfs/dbraw/zinc/79/46/70/495794670.db2.gz MDMCNDOUYMUCHU-VIZSFHNOSA-N 3 0 373.585 3.376 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159920201 495841428 /nfs/dbraw/zinc/84/14/28/495841428.db2.gz IMXKNWNOYMPLNX-RXVVDRJESA-N 2 0 372.557 3.023 20 70 FGIDRP C[C@@H](NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)C(C)(C)C[NH+](C)C ZINC000160032232 495868439 /nfs/dbraw/zinc/86/84/39/495868439.db2.gz JMNYLLLENWGBCG-GOSISDBHSA-N 2 0 366.594 3.260 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000160181363 495902749 /nfs/dbraw/zinc/90/27/49/495902749.db2.gz UZMUGKOEWXHIBH-GFCCVEGCSA-N 2 0 360.365 3.187 20 70 FGIDRP C[NH+](C)CC1CCC(NC(=O)NC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000160193553 495905302 /nfs/dbraw/zinc/90/53/02/495905302.db2.gz VTAYOVPVEIXZSY-UHFFFAOYSA-N 2 0 374.573 3.317 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cnn(C(C)C)c2)CC1 ZINC000160361859 495945525 /nfs/dbraw/zinc/94/55/25/495945525.db2.gz SPXNOWWQVAAPAT-IBGZPJMESA-N 2 0 369.557 3.452 20 70 FGIDRP COc1ccc(OC)c([C@@H](C)[NH2+]Cc2ccccc2CN2CCOCC2)c1 ZINC000160429243 495960302 /nfs/dbraw/zinc/96/03/02/495960302.db2.gz OJUZFSPQMSEGMJ-QGZVFWFLSA-N 2 0 370.493 3.387 20 70 FGIDRP Cc1ccc([C@@H](C)[NH2+]CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1F ZINC000160492803 495975149 /nfs/dbraw/zinc/97/51/49/495975149.db2.gz LBXKVYZTDILTDS-UZLBHIALSA-N 2 0 357.473 3.204 20 70 FGIDRP COc1cc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)ccc1SC ZINC000160734728 496030835 /nfs/dbraw/zinc/03/08/35/496030835.db2.gz PMKDORPTRLEFFK-NVXWUHKLSA-N 2 0 352.544 3.305 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000160911096 496066011 /nfs/dbraw/zinc/06/60/11/496066011.db2.gz MXKDZYOIJNBVLA-UXHICEINSA-N 2 0 364.578 3.157 20 70 FGIDRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000161195465 496125128 /nfs/dbraw/zinc/12/51/28/496125128.db2.gz VGYIMPSKLOGQEQ-GOSISDBHSA-N 2 0 353.510 3.446 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000161227523 496132073 /nfs/dbraw/zinc/13/20/73/496132073.db2.gz IPICCBXHOTVFSS-IBGZPJMESA-N 2 0 369.534 3.305 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000161268601 496140637 /nfs/dbraw/zinc/14/06/37/496140637.db2.gz JSJPEXCWJNCEQI-QGZVFWFLSA-N 2 0 351.922 3.358 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(OC)cc43)cn2)CC1 ZINC000159484531 495742279 /nfs/dbraw/zinc/74/22/79/495742279.db2.gz GFDSKFFUHHYBOT-OAQYLSRUSA-N 2 0 366.509 3.009 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OC)c(F)c3)cn2)CC1 ZINC000159483809 495742913 /nfs/dbraw/zinc/74/29/13/495742913.db2.gz VNEVCVJLLIPMEY-INIZCTEOSA-N 2 0 372.488 3.222 20 70 FGIDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1OC ZINC000159532359 495754098 /nfs/dbraw/zinc/75/40/98/495754098.db2.gz DAWYMICPCUJMBW-HXUWFJFHSA-N 2 0 368.525 3.473 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000159691665 495788258 /nfs/dbraw/zinc/78/82/58/495788258.db2.gz XWUZYHWABVZZSP-RTBURBONSA-N 2 0 374.573 3.125 20 70 FGIDRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c1 ZINC000160872168 496057707 /nfs/dbraw/zinc/05/77/07/496057707.db2.gz UHININYBMPGOBW-GOSISDBHSA-N 2 0 353.510 3.446 20 70 FGIDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000161228403 496131831 /nfs/dbraw/zinc/13/18/31/496131831.db2.gz TYIMCHMGVMUTIY-QGZVFWFLSA-N 2 0 365.521 3.318 20 70 FGIDRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000161238522 496134347 /nfs/dbraw/zinc/13/43/47/496134347.db2.gz WUNGMIFXMWIJLK-OAQYLSRUSA-N 2 0 369.509 3.228 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OC)cc3F)cn2)CC1 ZINC000159470497 495739398 /nfs/dbraw/zinc/73/93/98/495739398.db2.gz PWAHUUILRLPSGR-MRXNPFEDSA-N 2 0 372.488 3.222 20 70 FGIDRP Cc1cc([C@H](C)[NH2+]CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307764 495931937 /nfs/dbraw/zinc/93/19/37/495931937.db2.gz ROGOVCDJZJIOGZ-HNAYVOBHSA-N 2 0 359.539 3.435 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1)c1ccccc1 ZINC000160541938 495987864 /nfs/dbraw/zinc/98/78/64/495987864.db2.gz UIUNSNDUQXIJJO-IRLDBZIGSA-N 2 0 351.494 3.146 20 70 FGIDRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000160711426 496025512 /nfs/dbraw/zinc/02/55/12/496025512.db2.gz RMHJQXSILGVMEI-DYESRHJHSA-N 2 0 356.514 3.068 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000160767902 496037522 /nfs/dbraw/zinc/03/75/22/496037522.db2.gz GDFMYPHDRIQCJZ-CRAIPNDOSA-N 2 0 372.431 3.399 20 70 FGIDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C(C)(C)c1ccccc1 ZINC000161204798 496126981 /nfs/dbraw/zinc/12/69/81/496126981.db2.gz SBTKVNMWRLZLNW-GOSISDBHSA-N 2 0 367.537 3.434 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000160169709 495900733 /nfs/dbraw/zinc/90/07/33/495900733.db2.gz DGZWAAMKIRZOAS-GOSISDBHSA-N 2 0 366.347 3.052 20 70 FGIDRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000160271464 495923638 /nfs/dbraw/zinc/92/36/38/495923638.db2.gz ZTRFOSMFCXLYAN-IRXDYDNUSA-N 2 0 367.559 3.363 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000160279303 495925817 /nfs/dbraw/zinc/92/58/17/495925817.db2.gz RVYNSNOUBKXUNI-CQSZACIVSA-N 2 0 354.336 3.126 20 70 FGIDRP Cc1nc2ccccn2c1C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000160982206 496079240 /nfs/dbraw/zinc/07/92/40/496079240.db2.gz BBKQSHZWXHQKSA-QZTJIDSGSA-N 2 0 370.541 3.354 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005571 496083402 /nfs/dbraw/zinc/08/34/02/496083402.db2.gz CBMREKQESRQVSI-IRXDYDNUSA-N 2 0 363.933 3.407 20 70 FGIDRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000161238393 496134700 /nfs/dbraw/zinc/13/47/00/496134700.db2.gz WUNGMIFXMWIJLK-NRFANRHFSA-N 2 0 369.509 3.228 20 70 FGIDRP C[NH+](C)CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)C1CCCC1 ZINC000159381876 495721041 /nfs/dbraw/zinc/72/10/41/495721041.db2.gz MMFIRDQGRJZEOT-UHFFFAOYSA-N 2 0 372.557 3.298 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(C)ccc3OC)cn2)CC1 ZINC000159499947 495746389 /nfs/dbraw/zinc/74/63/89/495746389.db2.gz YKCVLOLPYKOUCR-GOSISDBHSA-N 2 0 368.525 3.391 20 70 FGIDRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000159726308 495796338 /nfs/dbraw/zinc/79/63/38/495796338.db2.gz ZOYQNVMLBOGSII-GOSISDBHSA-N 2 0 356.514 3.142 20 70 FGIDRP CC[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000159743094 495798755 /nfs/dbraw/zinc/79/87/55/495798755.db2.gz IPSYLHZPLNQHHE-IFMALSPDSA-N 2 0 360.542 3.462 20 70 FGIDRP CC(C)Oc1ccc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)cn1 ZINC000160099953 495882799 /nfs/dbraw/zinc/88/27/99/495882799.db2.gz NWLBVWVBXOMDND-XLIONFOSSA-N 2 0 354.498 3.264 20 70 FGIDRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160248741 495917366 /nfs/dbraw/zinc/91/73/66/495917366.db2.gz CXCJNIHPUKWFHG-AWEZNQCLSA-N 2 0 352.592 3.426 20 70 FGIDRP CC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(OC(F)F)cc1 ZINC000160261972 495921432 /nfs/dbraw/zinc/92/14/32/495921432.db2.gz XUTQYQNKPOXWGT-GOSISDBHSA-N 2 0 355.473 3.355 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000160287693 495926599 /nfs/dbraw/zinc/92/65/99/495926599.db2.gz WNTWBJWNQPOXFB-CQSZACIVSA-N 2 0 359.436 3.262 20 70 FGIDRP CCOc1ccc([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1OCC ZINC000160285399 495927072 /nfs/dbraw/zinc/92/70/72/495927072.db2.gz JKLMZTOWJWHSBI-KRWDZBQOSA-N 2 0 363.546 3.161 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cnc(C)nc2C)CC1 ZINC000160346906 495941564 /nfs/dbraw/zinc/94/15/64/495941564.db2.gz XASUXHBWGOPKGV-KRWDZBQOSA-N 2 0 367.541 3.082 20 70 FGIDRP C[NH+](C)[C@H]1CCC[C@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000160910849 496065915 /nfs/dbraw/zinc/06/59/15/496065915.db2.gz MXKDZYOIJNBVLA-PMACEKPBSA-N 2 0 364.578 3.157 20 70 FGIDRP CC(C)C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccn1 ZINC000161207049 496127268 /nfs/dbraw/zinc/12/72/68/496127268.db2.gz FAPXDJFQQXCPOB-NRFANRHFSA-N 2 0 368.525 3.250 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000159598474 495766213 /nfs/dbraw/zinc/76/62/13/495766213.db2.gz WABBWJKVUPBIDM-UHFFFAOYSA-N 2 0 372.557 3.156 20 70 FGIDRP C[C@H](C[NH+]1CCCCC1)NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159614713 495769862 /nfs/dbraw/zinc/76/98/62/495769862.db2.gz VKUACWOVJKNBHG-LJQANCHMSA-N 2 0 364.578 3.158 20 70 FGIDRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)c1 ZINC000160183604 495903542 /nfs/dbraw/zinc/90/35/42/495903542.db2.gz BICFZAVLYXUUNH-OAHLLOKOSA-N 2 0 355.473 3.273 20 70 FGIDRP CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000160202345 495908002 /nfs/dbraw/zinc/90/80/02/495908002.db2.gz LQSURGKQWZSVJM-RXVVDRJESA-N 2 0 372.557 3.194 20 70 FGIDRP C[C@@H]1C[C@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000160358370 495944335 /nfs/dbraw/zinc/94/43/35/495944335.db2.gz CCIYCJHUVRNCDZ-NQIIRXRSSA-N 2 0 372.557 3.023 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605661 496001740 /nfs/dbraw/zinc/00/17/40/496001740.db2.gz YWOFTLIGVBCHIO-VXKWHMMOSA-N 2 0 365.521 3.016 20 70 FGIDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc2c(c1)OCO2 ZINC000161229115 496132180 /nfs/dbraw/zinc/13/21/80/496132180.db2.gz IMKADXGAKIDMOI-INIZCTEOSA-N 2 0 368.477 3.223 20 70 FGIDRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000159620164 495772287 /nfs/dbraw/zinc/77/22/87/495772287.db2.gz ZJZIIXSOTVHHCU-CQSZACIVSA-N 2 0 367.559 3.408 20 70 FGIDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000159716836 495794276 /nfs/dbraw/zinc/79/42/76/495794276.db2.gz ADTNQFWFJZPMIG-NFBKMPQASA-N 3 0 373.585 3.378 20 70 FGIDRP CC[NH+]1CCN([C@H]2CCN(Cc3ncc(-c4ccccc4)s3)C2)CC1 ZINC000160051219 495872462 /nfs/dbraw/zinc/87/24/62/495872462.db2.gz BKKBPCLZBSVWFK-SFHVURJKSA-N 2 0 356.539 3.022 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000160179943 495901738 /nfs/dbraw/zinc/90/17/38/495901738.db2.gz PHYAGGVCYCYYGG-SFHVURJKSA-N 2 0 351.922 3.169 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cncc(F)c3)cc2)CC1 ZINC000160325354 495935981 /nfs/dbraw/zinc/93/59/81/495935981.db2.gz QFURWDJXIKXWSA-KRWDZBQOSA-N 2 0 356.489 3.209 20 70 FGIDRP C[C@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000160358744 495944584 /nfs/dbraw/zinc/94/45/84/495944584.db2.gz CCIYCJHUVRNCDZ-GHTZIAJQSA-N 2 0 372.557 3.023 20 70 FGIDRP C[C@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000160532814 495985603 /nfs/dbraw/zinc/98/56/03/495985603.db2.gz GSDJLCGPZNEQTL-WMZOPIPTSA-N 2 0 367.493 3.404 20 70 FGIDRP Cc1csc(CCCC[NH2+][C@@H]2CC[N@@H+](C[C@@H]3CCCO3)C[C@@H]2C)n1 ZINC000160693645 496022393 /nfs/dbraw/zinc/02/23/93/496022393.db2.gz SIAYXMMJLSERJA-RYQLBKOJSA-N 2 0 351.560 3.253 20 70 FGIDRP C[N@@H+]1CCC[C@@H]2CN([C@@H]3CCN(c4ccc(Cl)c(F)c4)C3=O)CC[C@@H]21 ZINC000161392481 496167607 /nfs/dbraw/zinc/16/76/07/496167607.db2.gz BDBXLWWWOQRKHK-JEBQAFNWSA-N 2 0 365.880 3.001 20 70 FGIDRP COc1cccc(CCC[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000159956365 495849643 /nfs/dbraw/zinc/84/96/43/495849643.db2.gz BFAOJGJZCLCWCX-BGYRXZFFSA-N 2 0 359.558 3.118 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000160191503 495905870 /nfs/dbraw/zinc/90/58/70/495905870.db2.gz BXJIWSIERQFKTL-ZDUSSCGKSA-N 2 0 372.326 3.265 20 70 FGIDRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N(CC[NH+](C)C)C1CCCC1 ZINC000160393980 495953166 /nfs/dbraw/zinc/95/31/66/495953166.db2.gz YDNYKYVUSNFZKP-GOSISDBHSA-N 2 0 352.567 3.157 20 70 FGIDRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)c1 ZINC000160841932 496052017 /nfs/dbraw/zinc/05/20/17/496052017.db2.gz YEFJHZDKYIPDFK-HXUWFJFHSA-N 2 0 372.557 3.085 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H](Cc2ccccc2)C2CC2)c1 ZINC000161204540 496126901 /nfs/dbraw/zinc/12/69/01/496126901.db2.gz MAXGXTRPRAXIJA-JOCHJYFZSA-N 2 0 365.521 3.089 20 70 FGIDRP C[C@@H]1C[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000159705258 495791632 /nfs/dbraw/zinc/79/16/32/495791632.db2.gz LPGHPNKNJDEYNO-CTNGQTDRSA-N 3 0 359.558 3.130 20 70 FGIDRP C[NH+](C)CCN(C(=O)NCc1cn2cc(Cl)ccc2n1)C1CCCC1 ZINC000159864085 495826135 /nfs/dbraw/zinc/82/61/35/495826135.db2.gz SFDMSIQFMORWCM-UHFFFAOYSA-N 2 0 363.893 3.004 20 70 FGIDRP C[NH+](C)CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)C1CCCC1 ZINC000160130956 495891649 /nfs/dbraw/zinc/89/16/49/495891649.db2.gz JGHYAVVQPNRUCY-UHFFFAOYSA-N 2 0 372.557 3.298 20 70 FGIDRP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000160255853 495920418 /nfs/dbraw/zinc/92/04/18/495920418.db2.gz PVNVAOVFWRVKHB-GJZGRUSLSA-N 2 0 352.910 3.306 20 70 FGIDRP CCOc1cccc([C@H](C)[NH2+]CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000160379719 495949828 /nfs/dbraw/zinc/94/98/28/495949828.db2.gz CFKLKYFPOVXKJY-LAUBAEHRSA-N 2 0 369.509 3.155 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]C1CCN(c2ccc(Cl)cc2)CC1 ZINC000160706925 496024014 /nfs/dbraw/zinc/02/40/14/496024014.db2.gz PFOHHFBKZHJPHH-HXUWFJFHSA-N 2 0 365.949 3.135 20 70 FGIDRP COc1cc(OC)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000160742900 496033151 /nfs/dbraw/zinc/03/31/51/496033151.db2.gz QYLBDYLPSZWTGK-LSDHHAIUSA-N 2 0 370.921 3.245 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000160768034 496039270 /nfs/dbraw/zinc/03/92/70/496039270.db2.gz GDFMYPHDRIQCJZ-QAPCUYQASA-N 2 0 372.431 3.399 20 70 FGIDRP COCCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1OC ZINC000161066547 496096667 /nfs/dbraw/zinc/09/66/67/496096667.db2.gz KVTBQDMIRSKESD-JQHSSLGASA-N 2 0 350.503 3.244 20 70 FGIDRP CC(C)C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccn1 ZINC000161207183 496127406 /nfs/dbraw/zinc/12/74/06/496127406.db2.gz FAPXDJFQQXCPOB-OAQYLSRUSA-N 2 0 368.525 3.250 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4nc(C)sc43)cn2)CC1 ZINC000159519541 495751406 /nfs/dbraw/zinc/75/14/06/495751406.db2.gz WRNLZKDIKMZZSA-QGZVFWFLSA-N 2 0 371.554 3.156 20 70 FGIDRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000159537349 495754743 /nfs/dbraw/zinc/75/47/43/495754743.db2.gz RISMOYHENMVKKH-SFHVURJKSA-N 2 0 368.525 3.473 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cnc(C)nc3C)cc2)CC1 ZINC000160313890 495934283 /nfs/dbraw/zinc/93/42/83/495934283.db2.gz TYPHHDJPZVBTAB-KRWDZBQOSA-N 2 0 367.541 3.082 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160605933 496001955 /nfs/dbraw/zinc/00/19/55/496001955.db2.gz YWOFTLIGVBCHIO-YADHBBJMSA-N 2 0 365.521 3.016 20 70 FGIDRP CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161282293 496143898 /nfs/dbraw/zinc/14/38/98/496143898.db2.gz LYZMMVFNKJYHLL-QGZVFWFLSA-N 2 0 369.509 3.228 20 70 FGIDRP C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC000161501972 496187216 /nfs/dbraw/zinc/18/72/16/496187216.db2.gz KPNNPDORPQJSGB-UHFFFAOYSA-N 2 0 357.473 3.091 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4ccccc43)cn2)CC1 ZINC000159513871 495750068 /nfs/dbraw/zinc/75/00/68/495750068.db2.gz FILBKKRFTWBECM-FQEVSTJZSA-N 2 0 366.509 3.227 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1OC(F)F ZINC000160274535 495924655 /nfs/dbraw/zinc/92/46/55/495924655.db2.gz KDZWZUIQXRKULL-CYBMUJFWSA-N 2 0 359.436 3.104 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+]C(C)(C)c1cccc(F)c1)c1ccccc1 ZINC000160448859 495965821 /nfs/dbraw/zinc/96/58/21/495965821.db2.gz UNPOAQURPBMQFE-LJQANCHMSA-N 2 0 357.473 3.070 20 70 FGIDRP Cc1nc2ccccn2c1C[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000160982355 496079266 /nfs/dbraw/zinc/07/92/66/496079266.db2.gz BBKQSHZWXHQKSA-ROUUACIJSA-N 2 0 370.541 3.354 20 70 FGIDRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292337 496145001 /nfs/dbraw/zinc/14/50/01/496145001.db2.gz AUCSNRZFOHLNPX-YCRPNKLZSA-N 2 0 369.484 3.140 20 70 FGIDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2oc(C)nc2c1 ZINC000159446610 495734683 /nfs/dbraw/zinc/73/46/83/495734683.db2.gz GZLCORSKJJBNMD-KRWDZBQOSA-N 2 0 373.501 3.016 20 70 FGIDRP C[C@@H](C[NH+]1CCCCC1)NC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000159614573 495769918 /nfs/dbraw/zinc/76/99/18/495769918.db2.gz VKUACWOVJKNBHG-IBGZPJMESA-N 2 0 364.578 3.158 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000160162168 495898524 /nfs/dbraw/zinc/89/85/24/495898524.db2.gz ZZQZVWBXXRCPNA-SFHVURJKSA-N 2 0 351.922 3.169 20 70 FGIDRP CCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000160158165 495898643 /nfs/dbraw/zinc/89/86/43/495898643.db2.gz BHMBMXYOTWTCIN-QGZVFWFLSA-N 2 0 369.509 3.228 20 70 FGIDRP C[C@@H]1C[C@H](NC(=O)N(C)CC[C@@H]2CCCC[NH+]2C)C[N@@H+]1Cc1ccccc1 ZINC000160333831 495939085 /nfs/dbraw/zinc/93/90/85/495939085.db2.gz KBBLEVXWIPYYMP-GIVPXCGWSA-N 2 0 372.557 3.165 20 70 FGIDRP CCOCCC[N@@H+]1CC[C@H](NC[C@@H](C2CCCCC2)[NH+](C)C)[C@H](C)C1 ZINC000160400473 495954214 /nfs/dbraw/zinc/95/42/14/495954214.db2.gz QNTGHSFYMGXOOO-GIVPXCGWSA-N 2 0 353.595 3.224 20 70 FGIDRP Cc1ccc([C@@H](C)[NH2+]CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1F ZINC000160493078 495975364 /nfs/dbraw/zinc/97/53/64/495975364.db2.gz LBXKVYZTDILTDS-OXQOHEQNSA-N 2 0 357.473 3.204 20 70 FGIDRP C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160867152 496057790 /nfs/dbraw/zinc/05/77/90/496057790.db2.gz USIWOPJCRWPWOH-SFHVURJKSA-N 2 0 366.594 3.260 20 70 FGIDRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N(C)[C@@H]2CCCC[C@@H]2C)CC1 ZINC000217198308 496996271 /nfs/dbraw/zinc/99/62/71/496996271.db2.gz XNAXYLJFVZWENL-AZUAARDMSA-N 2 0 351.579 3.467 20 70 FGIDRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)cc1 ZINC000159537471 495755023 /nfs/dbraw/zinc/75/50/23/495755023.db2.gz RISMOYHENMVKKH-GOSISDBHSA-N 2 0 368.525 3.473 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)CC1 ZINC000159599259 495767525 /nfs/dbraw/zinc/76/75/25/495767525.db2.gz KLQKWPYBBARMIX-IBGZPJMESA-N 2 0 372.557 3.298 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)CC1 ZINC000159599836 495767800 /nfs/dbraw/zinc/76/78/00/495767800.db2.gz VNQMWCGTGGWMIY-IBGZPJMESA-N 2 0 372.557 3.156 20 70 FGIDRP C[C@H]1C[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000159705143 495792189 /nfs/dbraw/zinc/79/21/89/495792189.db2.gz LPGHPNKNJDEYNO-PZJWPPBQSA-N 3 0 359.558 3.130 20 70 FGIDRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C1CCOCC1 ZINC000159761212 495803818 /nfs/dbraw/zinc/80/38/18/495803818.db2.gz OLMLZJHCACTSKC-LJQANCHMSA-N 2 0 360.542 3.462 20 70 FGIDRP CCN(C(=O)NCCC1CC[NH+](C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000160056991 495873388 /nfs/dbraw/zinc/87/33/88/495873388.db2.gz GJHWIFFIHBNNRG-OAQYLSRUSA-N 2 0 372.557 3.024 20 70 FGIDRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCN(C)Cc1ccc(F)cc1 ZINC000160141765 495894118 /nfs/dbraw/zinc/89/41/18/495894118.db2.gz VKIAEWIBUVWSQJ-AVRDEDQJSA-N 2 0 370.516 3.153 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000160209598 495908684 /nfs/dbraw/zinc/90/86/84/495908684.db2.gz PDTQTIPVWKTLIO-KRWDZBQOSA-N 2 0 353.963 3.493 20 70 FGIDRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cnn1-c1ccc(F)cc1 ZINC000160692647 496021949 /nfs/dbraw/zinc/02/19/49/496021949.db2.gz QNXSPFKGLLDJDH-OXJNMPFZSA-N 2 0 374.504 3.207 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000161288957 496145270 /nfs/dbraw/zinc/14/52/70/496145270.db2.gz CPRKBHJGHRFBNY-YTXWROIDSA-N 2 0 357.542 3.455 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000161288831 496145655 /nfs/dbraw/zinc/14/56/55/496145655.db2.gz CPRKBHJGHRFBNY-PPNDLDFTSA-N 2 0 357.542 3.455 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4ccccc4C[C@@H]3C)cn2)CC1 ZINC000159493961 495744046 /nfs/dbraw/zinc/74/40/46/495744046.db2.gz CCDHTKXIDNZZJY-HTAPYJJXSA-N 2 0 350.510 3.247 20 70 FGIDRP O=C(c1ccccc1Cl)N1CCC([NH2+]CCCC[NH+]2CCCC2)CC1 ZINC000159575846 495761683 /nfs/dbraw/zinc/76/16/83/495761683.db2.gz QYHIGGNIWZSARZ-UHFFFAOYSA-N 2 0 363.933 3.410 20 70 FGIDRP COC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000160234775 495915789 /nfs/dbraw/zinc/91/57/89/495915789.db2.gz CZNGSKQKOKARKN-SFHVURJKSA-N 2 0 373.463 3.009 20 70 FGIDRP COc1cc([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)ccc1SC ZINC000160249559 495918983 /nfs/dbraw/zinc/91/89/83/495918983.db2.gz PRAWIJFVKXUVHU-OAHLLOKOSA-N 2 0 351.560 3.094 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000160279164 495926328 /nfs/dbraw/zinc/92/63/28/495926328.db2.gz RVYNSNOUBKXUNI-AWEZNQCLSA-N 2 0 354.336 3.126 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cnn(C(C)C)c3)cc2)CC1 ZINC000160329476 495937449 /nfs/dbraw/zinc/93/74/49/495937449.db2.gz XTTDFGLWBIIDNR-LJQANCHMSA-N 2 0 369.557 3.452 20 70 FGIDRP C[C@@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000160533194 495985435 /nfs/dbraw/zinc/98/54/35/495985435.db2.gz GSDJLCGPZNEQTL-SJLPKXTDSA-N 2 0 367.493 3.404 20 70 FGIDRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@@H+](C3CCCC3)C2)c1 ZINC000160842045 496052165 /nfs/dbraw/zinc/05/21/65/496052165.db2.gz YEFJHZDKYIPDFK-FQEVSTJZSA-N 2 0 372.557 3.085 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000161295770 496146016 /nfs/dbraw/zinc/14/60/16/496146016.db2.gz KPSSCIJEKPLDRL-MRXNPFEDSA-N 2 0 371.447 3.161 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)CC1 ZINC000159598627 495766910 /nfs/dbraw/zinc/76/69/10/495766910.db2.gz TUNGTMXDWSJQND-UHFFFAOYSA-N 2 0 372.557 3.156 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000160169127 495900701 /nfs/dbraw/zinc/90/07/01/495900701.db2.gz KGGWRXLKOLSBRE-ZDUSSCGKSA-N 2 0 372.326 3.265 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000160209463 495909527 /nfs/dbraw/zinc/90/95/27/495909527.db2.gz PDTQTIPVWKTLIO-QGZVFWFLSA-N 2 0 353.963 3.493 20 70 FGIDRP C[C@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000160533061 495985394 /nfs/dbraw/zinc/98/53/94/495985394.db2.gz GSDJLCGPZNEQTL-FUHWJXTLSA-N 2 0 367.493 3.404 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@H](c1ccccc1)C1CC1)c1ccccc1 ZINC000160542128 495988226 /nfs/dbraw/zinc/98/82/26/495988226.db2.gz UIUNSNDUQXIJJO-IFMALSPDSA-N 2 0 351.494 3.146 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751096 496034388 /nfs/dbraw/zinc/03/43/88/496034388.db2.gz FQKISABHCIMPIK-DZGCQCFKSA-N 2 0 360.420 3.315 20 70 FGIDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cc(F)cc(F)c1 ZINC000161252632 496137961 /nfs/dbraw/zinc/13/79/61/496137961.db2.gz YCJMEDMHOVVPRP-CQSZACIVSA-N 2 0 361.436 3.107 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)NC[C@@H](c1ccccc1OC)[NH+]1CCCCC1 ZINC000161268239 496140649 /nfs/dbraw/zinc/14/06/49/496140649.db2.gz IMTWNKZBQNGKMV-SFHVURJKSA-N 2 0 361.530 3.104 20 70 FGIDRP CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1 ZINC000159528403 495752761 /nfs/dbraw/zinc/75/27/61/495752761.db2.gz RKIASBVTHWSBJO-SFHVURJKSA-N 2 0 368.525 3.473 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)CC1 ZINC000159598915 495766248 /nfs/dbraw/zinc/76/62/48/495766248.db2.gz USTDOMKAOGNADP-IBGZPJMESA-N 2 0 372.557 3.298 20 70 FGIDRP CCCC[N@H+](C)CCNC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000159813501 495815497 /nfs/dbraw/zinc/81/54/97/495815497.db2.gz WAZWFBARHUOJNH-TZIWHRDSSA-N 2 0 374.573 3.413 20 70 FGIDRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCN(C)Cc1ccc(F)cc1 ZINC000160141638 495894344 /nfs/dbraw/zinc/89/43/44/495894344.db2.gz VKIAEWIBUVWSQJ-GCJKJVERSA-N 2 0 370.516 3.153 20 70 FGIDRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)C1 ZINC000160274387 495924580 /nfs/dbraw/zinc/92/45/80/495924580.db2.gz NNRBNAKINACESG-SESVDKBCSA-N 2 0 372.557 3.023 20 70 FGIDRP O=C1C[C@@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c2ccccc2N1 ZINC000160581261 495996075 /nfs/dbraw/zinc/99/60/75/495996075.db2.gz GYIUIZBEYDAFHH-IBGZPJMESA-N 2 0 363.505 3.409 20 70 FGIDRP C[C@@H]([NH2+]C[C@H]1CC(=O)Nc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000160587626 495997938 /nfs/dbraw/zinc/99/79/38/495997938.db2.gz PKKHJNXOESGFAM-SJLPKXTDSA-N 2 0 367.493 3.404 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000160751189 496034709 /nfs/dbraw/zinc/03/47/09/496034709.db2.gz FQKISABHCIMPIK-UKRRQHHQSA-N 2 0 360.420 3.315 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000160910964 496065816 /nfs/dbraw/zinc/06/58/16/496065816.db2.gz MXKDZYOIJNBVLA-WOJBJXKFSA-N 2 0 364.578 3.157 20 70 FGIDRP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161211669 496128169 /nfs/dbraw/zinc/12/81/69/496128169.db2.gz WHDNNGZHKSYLPF-QGZVFWFLSA-N 2 0 353.510 3.391 20 70 FGIDRP C[C@@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)C[NH+]1CCCC1 ZINC000159662269 495781474 /nfs/dbraw/zinc/78/14/74/495781474.db2.gz RZNHTRSZHCWZOK-IBGZPJMESA-N 2 0 364.578 3.016 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000160191639 495905206 /nfs/dbraw/zinc/90/52/06/495905206.db2.gz BXJIWSIERQFKTL-CYBMUJFWSA-N 2 0 372.326 3.265 20 70 FGIDRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160232838 495914488 /nfs/dbraw/zinc/91/44/88/495914488.db2.gz YCDWTFKMOBOPHT-OAHLLOKOSA-N 2 0 373.570 3.190 20 70 FGIDRP Cc1cc([C@@H](C)[NH2+]CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307637 495931927 /nfs/dbraw/zinc/93/19/27/495931927.db2.gz ROGOVCDJZJIOGZ-DNVCBOLYSA-N 2 0 359.539 3.435 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cnn(C(C)C)c2)CC1 ZINC000160361949 495946135 /nfs/dbraw/zinc/94/61/35/495946135.db2.gz SPXNOWWQVAAPAT-LJQANCHMSA-N 2 0 369.557 3.452 20 70 FGIDRP CC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(F)cc1F ZINC000160763030 496038021 /nfs/dbraw/zinc/03/80/21/496038021.db2.gz PBEFZQQPEPNERZ-LJQANCHMSA-N 2 0 360.452 3.353 20 70 FGIDRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1OC ZINC000161270238 496142007 /nfs/dbraw/zinc/14/20/07/496142007.db2.gz KWOBXISVZAXMEW-FQEVSTJZSA-N 2 0 369.509 3.228 20 70 FGIDRP CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000160158017 495898393 /nfs/dbraw/zinc/89/83/93/495898393.db2.gz BHMBMXYOTWTCIN-KRWDZBQOSA-N 2 0 369.509 3.228 20 70 FGIDRP C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160315616 495933834 /nfs/dbraw/zinc/93/38/34/495933834.db2.gz SBLQIQKWCMMKPY-OALUTQOASA-N 2 0 366.594 3.118 20 70 FGIDRP C[C@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000160587247 495998022 /nfs/dbraw/zinc/99/80/22/495998022.db2.gz PKKHJNXOESGFAM-WMZOPIPTSA-N 2 0 367.493 3.404 20 70 FGIDRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000160872844 496058657 /nfs/dbraw/zinc/05/86/57/496058657.db2.gz MJSOQZRMQSYVBG-HXUWFJFHSA-N 2 0 357.473 3.358 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4ccccc4C[C@H]3C)cn2)CC1 ZINC000159494215 495744618 /nfs/dbraw/zinc/74/46/18/495744618.db2.gz CCDHTKXIDNZZJY-VGOFRKELSA-N 2 0 350.510 3.247 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4sccc43)cn2)CC1 ZINC000159516962 495749776 /nfs/dbraw/zinc/74/97/76/495749776.db2.gz SAILOOOICWLYAO-GOSISDBHSA-N 2 0 356.539 3.452 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000160669761 496016403 /nfs/dbraw/zinc/01/64/03/496016403.db2.gz CZXKUQQWOWQCKE-AEFFLSMTSA-N 2 0 352.906 3.380 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCc2cc(Br)ccc21 ZINC000160675621 496017628 /nfs/dbraw/zinc/01/76/28/496017628.db2.gz XCKMTMWJKVJZAK-AEFFLSMTSA-N 2 0 367.331 3.263 20 70 FGIDRP C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160910903 496065673 /nfs/dbraw/zinc/06/56/73/496065673.db2.gz NJCICFYZVHHBFJ-GUDVDZBRSA-N 2 0 366.594 3.116 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4c3cccc4C)cn2)CC1 ZINC000159473451 495739775 /nfs/dbraw/zinc/73/97/75/495739775.db2.gz JMGRIHHFAJFRFL-NRFANRHFSA-N 2 0 350.510 3.309 20 70 FGIDRP CC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC ZINC000160174878 495901984 /nfs/dbraw/zinc/90/19/84/495901984.db2.gz CBDZRGKILYLWMO-GOSISDBHSA-N 2 0 353.938 3.415 20 70 FGIDRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160232973 495915116 /nfs/dbraw/zinc/91/51/16/495915116.db2.gz YCDWTFKMOBOPHT-HNNXBMFYSA-N 2 0 373.570 3.190 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+]C(C)(C)c1cccc(F)c1)c1ccccc1 ZINC000160448728 495965046 /nfs/dbraw/zinc/96/50/46/495965046.db2.gz UNPOAQURPBMQFE-IBGZPJMESA-N 2 0 357.473 3.070 20 70 FGIDRP C[C@H](CC(=O)Nc1cccnc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160458266 495967777 /nfs/dbraw/zinc/96/77/77/495967777.db2.gz PNFYDAMBQVKTLT-CQSZACIVSA-N 2 0 364.921 3.449 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(Br)c1 ZINC000160675459 496017579 /nfs/dbraw/zinc/01/75/79/496017579.db2.gz DVHCQYXRHMHFJY-UKRRQHHQSA-N 2 0 373.310 3.476 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)CC1 ZINC000160701581 496023302 /nfs/dbraw/zinc/02/33/02/496023302.db2.gz MVGXEZXNPGTRFP-UHFFFAOYSA-N 2 0 352.567 3.013 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103741 496103422 /nfs/dbraw/zinc/10/34/22/496103422.db2.gz ZIBLPEHYHKJDEK-RTBURBONSA-N 2 0 363.933 3.407 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4ccc(OC)cc43)cn2)CC1 ZINC000159484678 495742499 /nfs/dbraw/zinc/74/24/99/495742499.db2.gz GFDSKFFUHHYBOT-NRFANRHFSA-N 2 0 366.509 3.009 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000160162057 495898663 /nfs/dbraw/zinc/89/86/63/495898663.db2.gz ZZQZVWBXXRCPNA-GOSISDBHSA-N 2 0 351.922 3.169 20 70 FGIDRP COc1cc(OC)c([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1Cl ZINC000160262684 495921078 /nfs/dbraw/zinc/92/10/78/495921078.db2.gz HPPJPPOVNVZDCI-AWEZNQCLSA-N 2 0 369.937 3.034 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cncc(F)c2)CC1 ZINC000160357276 495944953 /nfs/dbraw/zinc/94/49/53/495944953.db2.gz CFLSIUDPCWEXHC-KRWDZBQOSA-N 2 0 356.489 3.209 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000160684984 496019772 /nfs/dbraw/zinc/01/97/72/496019772.db2.gz HGXZRJZXPYLKEG-QAPCUYQASA-N 2 0 352.906 3.380 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000160761079 496037419 /nfs/dbraw/zinc/03/74/19/496037419.db2.gz GELZVNWDINKVGG-GDBMZVCRSA-N 2 0 360.420 3.473 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000161103499 496104075 /nfs/dbraw/zinc/10/40/75/496104075.db2.gz ZIBLPEHYHKJDEK-RBUKOAKNSA-N 2 0 363.933 3.407 20 70 FGIDRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]C3CCC4(CC3)OCCO4)cc2)C[C@H](C)O1 ZINC000161256608 496137856 /nfs/dbraw/zinc/13/78/56/496137856.db2.gz AEQAGNSVTDUFIA-HDICACEKSA-N 2 0 374.525 3.071 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000161269363 496140667 /nfs/dbraw/zinc/14/06/67/496140667.db2.gz NUTBSKCTRXIBQD-FQEVSTJZSA-N 2 0 371.912 3.409 20 70 FGIDRP CCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)s1 ZINC000159465548 495737842 /nfs/dbraw/zinc/73/78/42/495737842.db2.gz SJMSVGKGSQITPO-HNNXBMFYSA-N 2 0 373.570 3.402 20 70 FGIDRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159583469 495763895 /nfs/dbraw/zinc/76/38/95/495763895.db2.gz WYCHMXZNFMBPGZ-HBMCJLEFSA-N 2 0 356.510 3.208 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1 ZINC000159660934 495781138 /nfs/dbraw/zinc/78/11/38/495781138.db2.gz RKLWXOZXXPYFSO-UHFFFAOYSA-N 2 0 352.567 3.059 20 70 FGIDRP C[C@@H]1C[C@@H](NC(=O)N(C)CC[C@@H]2CCCC[NH+]2C)C[N@@H+]1Cc1ccccc1 ZINC000160334128 495938446 /nfs/dbraw/zinc/93/84/46/495938446.db2.gz KBBLEVXWIPYYMP-NRSPTQNISA-N 2 0 372.557 3.165 20 70 FGIDRP CC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(F)cc1F ZINC000160762901 496037936 /nfs/dbraw/zinc/03/79/36/496037936.db2.gz PBEFZQQPEPNERZ-IBGZPJMESA-N 2 0 360.452 3.353 20 70 FGIDRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](C3CCCC3)C2)CC1 ZINC000160866612 496056884 /nfs/dbraw/zinc/05/68/84/496056884.db2.gz FVJGANDFJAEWKL-IBGZPJMESA-N 2 0 364.578 3.157 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000160910704 496065396 /nfs/dbraw/zinc/06/53/96/496065396.db2.gz MXKDZYOIJNBVLA-VQTJNVASSA-N 2 0 364.578 3.157 20 70 FGIDRP C[NH+](C)CCN(Cc1ccccc1F)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC000161035151 496089530 /nfs/dbraw/zinc/08/95/30/496089530.db2.gz RMXSJEKMGXDXFB-UHFFFAOYSA-N 2 0 357.473 3.091 20 70 FGIDRP COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161239819 496135643 /nfs/dbraw/zinc/13/56/43/496135643.db2.gz JMLDIMRRYNCHHW-KRWDZBQOSA-N 2 0 369.509 3.146 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000161285202 496143889 /nfs/dbraw/zinc/14/38/89/496143889.db2.gz YHRYBMDDTBBRFU-UHFFFAOYSA-N 2 0 365.949 3.433 20 70 FGIDRP C[C@H]1C[NH+](CCC2CC[NH+](CCC[NH+]3CCCCC3)CC2)C[C@H](C)O1 ZINC000161398968 496168551 /nfs/dbraw/zinc/16/85/51/496168551.db2.gz KPRHJPDYUWJQQE-PMACEKPBSA-N 2 0 351.579 3.074 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(F)ccc43)cn2)CC1 ZINC000159462675 495738079 /nfs/dbraw/zinc/73/80/79/495738079.db2.gz DVXBBXMPCKDPPX-FQEVSTJZSA-N 2 0 354.473 3.140 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OC)cc3)cn2)CC1 ZINC000159525641 495752409 /nfs/dbraw/zinc/75/24/09/495752409.db2.gz QDJOJWZVVKMMJN-KRWDZBQOSA-N 2 0 354.498 3.083 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)CC1 ZINC000159600002 495768160 /nfs/dbraw/zinc/76/81/60/495768160.db2.gz DHAFCXONQIBIFN-IBGZPJMESA-N 2 0 372.557 3.156 20 70 FGIDRP Cc1cc([C@@H](C)[NH2+]CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c(C)s1 ZINC000160307397 495931901 /nfs/dbraw/zinc/93/19/01/495931901.db2.gz ROGOVCDJZJIOGZ-BEFAXECRSA-N 2 0 359.539 3.435 20 70 FGIDRP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160458143 495967370 /nfs/dbraw/zinc/96/73/70/495967370.db2.gz PNFYDAMBQVKTLT-AWEZNQCLSA-N 2 0 364.921 3.449 20 70 FGIDRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c1 ZINC000160687311 496020723 /nfs/dbraw/zinc/02/07/23/496020723.db2.gz ICVNXVNPFDQCAM-JKSUJKDBSA-N 2 0 356.457 3.484 20 70 FGIDRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]C1CCN(c2ccc(Cl)cc2)CC1 ZINC000160707075 496023796 /nfs/dbraw/zinc/02/37/96/496023796.db2.gz PFOHHFBKZHJPHH-FQEVSTJZSA-N 2 0 365.949 3.135 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005672 496083160 /nfs/dbraw/zinc/08/31/60/496083160.db2.gz CBMREKQESRQVSI-IAGOWNOFSA-N 2 0 363.933 3.407 20 70 FGIDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(OC)c1 ZINC000159475259 495740513 /nfs/dbraw/zinc/74/05/13/495740513.db2.gz UUJSXNDTPYUICP-NRFANRHFSA-N 2 0 368.525 3.473 20 70 FGIDRP C[C@@H]([NH2+]C[C@@H]1CC(=O)Nc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000160532903 495985508 /nfs/dbraw/zinc/98/55/08/495985508.db2.gz GSDJLCGPZNEQTL-AEFFLSMTSA-N 2 0 367.493 3.404 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159494209 495745191 /nfs/dbraw/zinc/74/51/91/495745191.db2.gz JBNXGQSDILKWFH-QUCCMNQESA-N 2 0 360.546 3.021 20 70 FGIDRP CC[N@@H+]1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000159716672 495794131 /nfs/dbraw/zinc/79/41/31/495794131.db2.gz ADTNQFWFJZPMIG-OFNKIYASSA-N 3 0 373.585 3.378 20 70 FGIDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)(F)F ZINC000160676513 496017208 /nfs/dbraw/zinc/01/72/08/496017208.db2.gz FDTIPNDLBLZBJC-HUUCEWRRSA-N 2 0 360.420 3.473 20 70 FGIDRP C[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc(OCC[NH+](C)C)c1 ZINC000161122586 496108964 /nfs/dbraw/zinc/10/89/64/496108964.db2.gz ZSGKIDLNSUOOGV-INIZCTEOSA-N 2 0 356.466 3.249 20 70 FGIDRP CCc1nc(C)c([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161202130 496125795 /nfs/dbraw/zinc/12/57/95/496125795.db2.gz ANGZAFAEODUXHZ-CQSZACIVSA-N 2 0 374.554 3.156 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCCc3sccc32)c1 ZINC000161260671 496139119 /nfs/dbraw/zinc/13/91/19/496139119.db2.gz SLWKPQCYZIXXQE-SFHVURJKSA-N 2 0 357.523 3.207 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CC1 ZINC000161463533 496181986 /nfs/dbraw/zinc/18/19/86/496181986.db2.gz FVWKPGJCLCUSEB-UHFFFAOYSA-N 2 0 357.542 3.455 20 70 FGIDRP C[NH+](C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC000161509193 496188412 /nfs/dbraw/zinc/18/84/12/496188412.db2.gz KBABLOFKSGUDHJ-UHFFFAOYSA-N 2 0 357.473 3.091 20 70 FGIDRP C[NH+](C)Cc1ccc(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000160060999 495875077 /nfs/dbraw/zinc/87/50/77/495875077.db2.gz BEUKHQMGTIQKTN-OAQYLSRUSA-N 2 0 351.494 3.143 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000160219950 495913178 /nfs/dbraw/zinc/91/31/78/495913178.db2.gz QUEIQUOXJXXWPB-HZPDHXFCSA-N 2 0 360.571 3.404 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)C1CC1)c1ccccc1 ZINC000160606054 496001819 /nfs/dbraw/zinc/00/18/19/496001819.db2.gz YWOFTLIGVBCHIO-FGZHOGPDSA-N 2 0 365.521 3.016 20 70 FGIDRP CC(C)n1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cn1 ZINC000161224866 496131011 /nfs/dbraw/zinc/13/10/11/496131011.db2.gz OUIGMRGFEAIGLA-KRWDZBQOSA-N 2 0 356.514 3.272 20 70 FGIDRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1OC ZINC000161270322 496142289 /nfs/dbraw/zinc/14/22/89/496142289.db2.gz KWOBXISVZAXMEW-HXUWFJFHSA-N 2 0 369.509 3.228 20 70 FGIDRP CCc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161284066 496144319 /nfs/dbraw/zinc/14/43/19/496144319.db2.gz NUMVTAGHFRHXBN-HNNXBMFYSA-N 2 0 359.539 3.453 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4ccccc43)cn2)CC1 ZINC000159513730 495750044 /nfs/dbraw/zinc/75/00/44/495750044.db2.gz FILBKKRFTWBECM-HXUWFJFHSA-N 2 0 366.509 3.227 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4cc(F)ccc4C[C@@H]3C)cn2)CC1 ZINC000159542832 495755982 /nfs/dbraw/zinc/75/59/82/495755982.db2.gz MLHHZCYUPOHQRA-KSFYIVLOSA-N 2 0 368.500 3.386 20 70 FGIDRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000159620289 495772408 /nfs/dbraw/zinc/77/24/08/495772408.db2.gz ZJZIIXSOTVHHCU-AWEZNQCLSA-N 2 0 367.559 3.408 20 70 FGIDRP C[NH+](C)Cc1ccc(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000160061141 495874599 /nfs/dbraw/zinc/87/45/99/495874599.db2.gz BEUKHQMGTIQKTN-NRFANRHFSA-N 2 0 351.494 3.143 20 70 FGIDRP CC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000160248383 495917218 /nfs/dbraw/zinc/91/72/18/495917218.db2.gz MTQCTHDVZQJFLY-KRWDZBQOSA-N 2 0 355.473 3.355 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(F)cc1OC(F)F ZINC000160274404 495925133 /nfs/dbraw/zinc/92/51/33/495925133.db2.gz KDZWZUIQXRKULL-ZDUSSCGKSA-N 2 0 359.436 3.104 20 70 FGIDRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000160872726 496058914 /nfs/dbraw/zinc/05/89/14/496058914.db2.gz MJSOQZRMQSYVBG-FQEVSTJZSA-N 2 0 357.473 3.358 20 70 FGIDRP Brc1cccc(OCC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000161019139 496086656 /nfs/dbraw/zinc/08/66/56/496086656.db2.gz QDLDVNVEEUDYJB-UHFFFAOYSA-N 2 0 353.304 3.292 20 70 FGIDRP Cc1ccc([C@@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)[NH+](C)C)cc1 ZINC000161210074 496128477 /nfs/dbraw/zinc/12/84/77/496128477.db2.gz KPKGIPNXVQVUBA-OAQYLSRUSA-N 2 0 374.573 3.361 20 70 FGIDRP CC[N@H+](C)Cc1cccc(CNC(=O)N2CCC(CCC[NH+](C)C)CC2)c1 ZINC000161311637 496150446 /nfs/dbraw/zinc/15/04/46/496150446.db2.gz BOKJUNGUWJNAQJ-UHFFFAOYSA-N 2 0 374.573 3.402 20 70 FGIDRP CCCC[NH+]1CCC(NC(=O)N2CCC(CCC[NH+](C)C)CC2)CC1 ZINC000161427400 496174802 /nfs/dbraw/zinc/17/48/02/496174802.db2.gz RNLVIACWVUTBEX-UHFFFAOYSA-N 2 0 352.567 3.014 20 70 FGIDRP C[N@@H+]1CCC[C@@H]2CN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC[C@@H]21 ZINC000159451971 495736157 /nfs/dbraw/zinc/73/61/57/495736157.db2.gz HCECGSKOBZNOEB-RTWAWAEBSA-N 2 0 369.553 3.231 20 70 FGIDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC)cc1 ZINC000159498677 495746166 /nfs/dbraw/zinc/74/61/66/495746166.db2.gz WRDGUFLWUTWFOQ-NRFANRHFSA-N 2 0 368.525 3.473 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(C)cc43)cn2)CC1 ZINC000159517846 495750331 /nfs/dbraw/zinc/75/03/31/495750331.db2.gz VHCIHAHEKQHNMN-OAQYLSRUSA-N 2 0 350.510 3.309 20 70 FGIDRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000159583655 495764538 /nfs/dbraw/zinc/76/45/38/495764538.db2.gz WYCHMXZNFMBPGZ-NJYVYQBISA-N 2 0 356.510 3.208 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000159724354 495795173 /nfs/dbraw/zinc/79/51/73/495795173.db2.gz MDMCNDOUYMUCHU-ZRCGQRJVSA-N 3 0 373.585 3.376 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NCc2ccc(C[NH+](C)C)cc2)CC1 ZINC000159932080 495843787 /nfs/dbraw/zinc/84/37/87/495843787.db2.gz XOEIVDSZRNUOSA-UHFFFAOYSA-N 2 0 360.546 3.012 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000160171090 495900923 /nfs/dbraw/zinc/90/09/23/495900923.db2.gz NNBCUDMDSPUOOB-AWEZNQCLSA-N 2 0 359.436 3.262 20 70 FGIDRP CCOc1cccc([C@H](C)[NH2+]CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c1 ZINC000160379488 495949378 /nfs/dbraw/zinc/94/93/78/495949378.db2.gz CFKLKYFPOVXKJY-UWJYYQICSA-N 2 0 369.509 3.155 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1Br ZINC000160686077 496020071 /nfs/dbraw/zinc/02/00/71/496020071.db2.gz NSUDCBXWKSVZHC-LSDHHAIUSA-N 2 0 355.320 3.337 20 70 FGIDRP CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000161029646 496088769 /nfs/dbraw/zinc/08/87/69/496088769.db2.gz HRDPNLDOKPKGBC-PMACEKPBSA-N 2 0 364.578 3.157 20 70 FGIDRP COCCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1OC ZINC000161066722 496096512 /nfs/dbraw/zinc/09/65/12/496096512.db2.gz KVTBQDMIRSKESD-SZMVWBNQSA-N 2 0 350.503 3.244 20 70 FGIDRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)CC2 ZINC000161261287 496139392 /nfs/dbraw/zinc/13/93/92/496139392.db2.gz CBTMFXUUKWKPJL-OAQYLSRUSA-N 2 0 351.494 3.064 20 70 FGIDRP C[C@@H]1C[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000159705000 495791607 /nfs/dbraw/zinc/79/16/07/495791607.db2.gz LPGHPNKNJDEYNO-TZIWHRDSSA-N 3 0 359.558 3.130 20 70 FGIDRP O=C([C@H]1CCCC[N@@H+]1Cc1ccccc1)N1CCC([NH2+]CC2CC2)CC1 ZINC000159841903 495821741 /nfs/dbraw/zinc/82/17/41/495821741.db2.gz ZDTKITNHCFWAOX-OAQYLSRUSA-N 2 0 355.526 3.032 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000160171229 495900650 /nfs/dbraw/zinc/90/06/50/495900650.db2.gz NNBCUDMDSPUOOB-CQSZACIVSA-N 2 0 359.436 3.262 20 70 FGIDRP CC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(OC(F)F)cc1 ZINC000160261861 495921180 /nfs/dbraw/zinc/92/11/80/495921180.db2.gz XUTQYQNKPOXWGT-SFHVURJKSA-N 2 0 355.473 3.355 20 70 FGIDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160315487 495933662 /nfs/dbraw/zinc/93/36/62/495933662.db2.gz SBLQIQKWCMMKPY-KDURUIRLSA-N 2 0 366.594 3.118 20 70 FGIDRP C[C@@H]1C[C@@H](NC(=O)N2CCC(CC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000160358637 495945038 /nfs/dbraw/zinc/94/50/38/495945038.db2.gz CCIYCJHUVRNCDZ-WIYYLYMNSA-N 2 0 372.557 3.023 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+]C1(c2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000160430429 495961847 /nfs/dbraw/zinc/96/18/47/495961847.db2.gz KPYYDYSINYLZQS-IBGZPJMESA-N 2 0 371.912 3.338 20 70 FGIDRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161233560 496133197 /nfs/dbraw/zinc/13/31/97/496133197.db2.gz OODYCVAPSPFCMZ-IIBYNOLFSA-N 2 0 351.494 3.001 20 70 FGIDRP CC1CC[NH+](CCCCNC(=O)N(CC[NH+](C)C)C2CCCC2)CC1 ZINC000160381788 495949875 /nfs/dbraw/zinc/94/98/75/495949875.db2.gz AOTPRVSDLNEEAM-UHFFFAOYSA-N 2 0 352.567 3.014 20 70 FGIDRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(Cc3c(F)cccc3F)C2)[C@H](C)C1 ZINC000161117688 496107609 /nfs/dbraw/zinc/10/76/09/496107609.db2.gz AIZQWVWNSDFOFB-QINHECLXSA-N 2 0 351.485 3.249 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)c1 ZINC000161231762 496133142 /nfs/dbraw/zinc/13/31/42/496133142.db2.gz KOPFASFKFXHGQU-LJQANCHMSA-N 2 0 369.509 3.374 20 70 FGIDRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292451 496146329 /nfs/dbraw/zinc/14/63/29/496146329.db2.gz AUCSNRZFOHLNPX-VFNWGFHPSA-N 2 0 369.484 3.140 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3c4cc(F)ccc4C[C@@H]3C)cn2)CC1 ZINC000159542696 495756169 /nfs/dbraw/zinc/75/61/69/495756169.db2.gz MLHHZCYUPOHQRA-AOMKIAJQSA-N 2 0 368.500 3.386 20 70 FGIDRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000159612293 495770225 /nfs/dbraw/zinc/77/02/25/495770225.db2.gz MEKPOHGUIOAYEO-ZDUSSCGKSA-N 2 0 353.532 3.018 20 70 FGIDRP CCOc1cccc([C@@H](C)[NH2+]CC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c1 ZINC000160379628 495949107 /nfs/dbraw/zinc/94/91/07/495949107.db2.gz CFKLKYFPOVXKJY-DYESRHJHSA-N 2 0 369.509 3.155 20 70 FGIDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1C ZINC000161236429 496134728 /nfs/dbraw/zinc/13/47/28/496134728.db2.gz UWWBNOXQIYAOTR-GOSISDBHSA-N 2 0 353.510 3.446 20 70 FGIDRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC4(CC3)OCCO4)cc2)C[C@@H](C)O1 ZINC000161256865 496138148 /nfs/dbraw/zinc/13/81/48/496138148.db2.gz AEQAGNSVTDUFIA-QZTJIDSGSA-N 2 0 374.525 3.071 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000159940171 495846587 /nfs/dbraw/zinc/84/65/87/495846587.db2.gz GNEQKBBBSDTUFN-QUCCMNQESA-N 2 0 372.557 3.165 20 70 FGIDRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160199273 495906907 /nfs/dbraw/zinc/90/69/07/495906907.db2.gz ZCTHMZSIZAYTGI-OAHLLOKOSA-N 2 0 353.938 3.415 20 70 FGIDRP C[NH+](C)CC[C@H](NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)C(C)(C)C ZINC000160218294 495911190 /nfs/dbraw/zinc/91/11/90/495911190.db2.gz XGRSQBPSBZIBMG-MSOLQXFVSA-N 2 0 352.567 3.013 20 70 FGIDRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCc2c1cnn2C ZINC000160303269 495930841 /nfs/dbraw/zinc/93/08/41/495930841.db2.gz LXGOJLJRVZMXTH-IBGZPJMESA-N 2 0 356.514 3.308 20 70 FGIDRP C[NH+](C)Cc1ccc(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)cc1 ZINC000160617107 496005140 /nfs/dbraw/zinc/00/51/40/496005140.db2.gz XUJPKTLSKCJIQD-UHFFFAOYSA-N 2 0 369.484 3.282 20 70 FGIDRP COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161239700 496134681 /nfs/dbraw/zinc/13/46/81/496134681.db2.gz JMLDIMRRYNCHHW-QGZVFWFLSA-N 2 0 369.509 3.146 20 70 FGIDRP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)s1 ZINC000161283962 496143546 /nfs/dbraw/zinc/14/35/46/496143546.db2.gz NUMVTAGHFRHXBN-OAHLLOKOSA-N 2 0 359.539 3.453 20 70 FGIDRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000159612456 495770377 /nfs/dbraw/zinc/77/03/77/495770377.db2.gz MEKPOHGUIOAYEO-CYBMUJFWSA-N 2 0 353.532 3.018 20 70 FGIDRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1cnn(C)c1 ZINC000159726164 495796374 /nfs/dbraw/zinc/79/63/74/495796374.db2.gz ZOYQNVMLBOGSII-SFHVURJKSA-N 2 0 356.514 3.142 20 70 FGIDRP C[NH+](C)CC[C@@H](NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)C(C)(C)C ZINC000160218170 495912091 /nfs/dbraw/zinc/91/20/91/495912091.db2.gz XGRSQBPSBZIBMG-QZTJIDSGSA-N 2 0 352.567 3.013 20 70 FGIDRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000160271360 495923847 /nfs/dbraw/zinc/92/38/47/495923847.db2.gz ZTRFOSMFCXLYAN-DLBZAZTESA-N 2 0 367.559 3.363 20 70 FGIDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cncc(F)c2)CC1 ZINC000160357402 495944763 /nfs/dbraw/zinc/94/47/63/495944763.db2.gz CFLSIUDPCWEXHC-QGZVFWFLSA-N 2 0 356.489 3.209 20 70 FGIDRP COc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)ccc1SC ZINC000160734624 496031580 /nfs/dbraw/zinc/03/15/80/496031580.db2.gz PMKDORPTRLEFFK-DOTOQJQBSA-N 2 0 352.544 3.305 20 70 FGIDRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)CC2 ZINC000161261376 496139657 /nfs/dbraw/zinc/13/96/57/496139657.db2.gz CBTMFXUUKWKPJL-NRFANRHFSA-N 2 0 351.494 3.064 20 70 FGIDRP CCN(C(=O)NC[C@@H](C)C[NH+]1CCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000159400882 495725494 /nfs/dbraw/zinc/72/54/94/495725494.db2.gz NZQWBIITBPLXBR-CTNGQTDRSA-N 2 0 372.557 3.024 20 70 FGIDRP CCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](CC)CC3)nc2)s1 ZINC000159465397 495738297 /nfs/dbraw/zinc/73/82/97/495738297.db2.gz SJMSVGKGSQITPO-OAHLLOKOSA-N 2 0 373.570 3.402 20 70 FGIDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC)cc1 ZINC000159498807 495746096 /nfs/dbraw/zinc/74/60/96/495746096.db2.gz WRDGUFLWUTWFOQ-OAQYLSRUSA-N 2 0 368.525 3.473 20 70 FGIDRP C[C@@H]1C[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CN1C1CC1 ZINC000159743768 495798840 /nfs/dbraw/zinc/79/88/40/495798840.db2.gz WZTQQVPKESWBNY-CTNGQTDRSA-N 2 0 371.569 3.273 20 70 FGIDRP C[NH+](C)CCCC1CCN(C(=O)NCC(C)(C)[NH+]2CCCCC2)CC1 ZINC000159844331 495822436 /nfs/dbraw/zinc/82/24/36/495822436.db2.gz BQIBKEVZPSWLOZ-UHFFFAOYSA-N 2 0 352.567 3.014 20 70 FGIDRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N(CC[NH+](C)C)C1CCCC1 ZINC000160394124 495952813 /nfs/dbraw/zinc/95/28/13/495952813.db2.gz YDNYKYVUSNFZKP-SFHVURJKSA-N 2 0 352.567 3.157 20 70 FGIDRP CCC[NH+]1CCC(NC(=O)N(CC)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000160399172 495954386 /nfs/dbraw/zinc/95/43/86/495954386.db2.gz CCKJLBGWCONNBP-NRFANRHFSA-N 2 0 372.557 3.167 20 70 FGIDRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@H](c1ccccc1)C1CC1)c1ccccc1 ZINC000160542046 495987894 /nfs/dbraw/zinc/98/78/94/495987894.db2.gz UIUNSNDUQXIJJO-RBBKRZOGSA-N 2 0 351.494 3.146 20 70 FGIDRP C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000160910642 496065548 /nfs/dbraw/zinc/06/55/48/496065548.db2.gz NJCICFYZVHHBFJ-CEXWTWQISA-N 2 0 366.594 3.116 20 70 FGIDRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cnc4ccccn34)CC2)C[C@H](C)O1 ZINC000160981651 496078877 /nfs/dbraw/zinc/07/88/77/496078877.db2.gz PIESUZHJYZRGOM-HDICACEKSA-N 2 0 356.514 3.046 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000161269219 496140699 /nfs/dbraw/zinc/14/06/99/496140699.db2.gz NUTBSKCTRXIBQD-HXUWFJFHSA-N 2 0 371.912 3.409 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000159778780 495806967 /nfs/dbraw/zinc/80/69/67/495806967.db2.gz YIWKGYZDUPHBFH-UHFFFAOYSA-N 2 0 372.557 3.300 20 70 FGIDRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000160199406 495906692 /nfs/dbraw/zinc/90/66/92/495906692.db2.gz ZCTHMZSIZAYTGI-HNNXBMFYSA-N 2 0 353.938 3.415 20 70 FGIDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000160220090 495913313 /nfs/dbraw/zinc/91/33/13/495913313.db2.gz QUEIQUOXJXXWPB-JKSUJKDBSA-N 2 0 360.571 3.404 20 70 FGIDRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CC3(CCCC3)Oc3ccccc32)CC1 ZINC000160275391 495925105 /nfs/dbraw/zinc/92/51/05/495925105.db2.gz RIIWBSFSPWJDJW-FQEVSTJZSA-N 2 0 357.542 3.439 20 70 FGIDRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000160358625 495945031 /nfs/dbraw/zinc/94/50/31/495945031.db2.gz NJKWYOKRCUWKPT-LJQANCHMSA-N 2 0 366.594 3.262 20 70 FGIDRP C[NH+](C)[C@H](CNC(=O)C[NH2+]C1(c2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000160430558 495961323 /nfs/dbraw/zinc/96/13/23/495961323.db2.gz KPYYDYSINYLZQS-LJQANCHMSA-N 2 0 371.912 3.338 20 70 FGIDRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC2 ZINC000161168494 496119535 /nfs/dbraw/zinc/11/95/35/496119535.db2.gz ZUCJORUEXTZOFM-QHCPKHFHSA-N 2 0 366.505 3.429 20 70 FGIDRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000161227408 496132090 /nfs/dbraw/zinc/13/20/90/496132090.db2.gz IPICCBXHOTVFSS-LJQANCHMSA-N 2 0 369.534 3.305 20 70 FGIDRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC4(CC3)OCCO4)CC2)cc1 ZINC000161384166 496165367 /nfs/dbraw/zinc/16/53/67/496165367.db2.gz STWQIAMIKNHBCB-UHFFFAOYSA-N 2 0 374.525 3.183 20 70 FGIDRP CC[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000159743221 495798407 /nfs/dbraw/zinc/79/84/07/495798407.db2.gz IPSYLHZPLNQHHE-UNMCSNQZSA-N 2 0 360.542 3.462 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000160220372 495913256 /nfs/dbraw/zinc/91/32/56/495913256.db2.gz QUEIQUOXJXXWPB-HOTGVXAUSA-N 2 0 360.571 3.404 20 70 FGIDRP CC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000160248500 495917276 /nfs/dbraw/zinc/91/72/76/495917276.db2.gz MTQCTHDVZQJFLY-QGZVFWFLSA-N 2 0 355.473 3.355 20 70 FGIDRP C[C@@H](CC(=O)Nc1cccnc1Cl)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000160255757 495920064 /nfs/dbraw/zinc/92/00/64/495920064.db2.gz PVNVAOVFWRVKHB-LSDHHAIUSA-N 2 0 352.910 3.306 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000160287580 495926728 /nfs/dbraw/zinc/92/67/28/495926728.db2.gz WNTWBJWNQPOXFB-AWEZNQCLSA-N 2 0 359.436 3.262 20 70 FGIDRP Cc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161215222 496129230 /nfs/dbraw/zinc/12/92/30/496129230.db2.gz XTFPISZBRDOJMO-OAQYLSRUSA-N 2 0 351.494 3.064 20 70 FGIDRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161233920 496133452 /nfs/dbraw/zinc/13/34/52/496133452.db2.gz OODYCVAPSPFCMZ-KKSFZXQISA-N 2 0 351.494 3.001 20 70 FGIDRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC4(CC3)OCCO4)cc2)C[C@H](C)O1 ZINC000161256727 496137914 /nfs/dbraw/zinc/13/79/14/496137914.db2.gz AEQAGNSVTDUFIA-ROUUACIJSA-N 2 0 374.525 3.071 20 70 FGIDRP C[N@@H+]1CCC[C@H]2CN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC[C@H]21 ZINC000159452111 495735655 /nfs/dbraw/zinc/73/56/55/495735655.db2.gz HCECGSKOBZNOEB-LEWJYISDSA-N 2 0 369.553 3.231 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](CC(C)C)c3ccccn3)cn2)CC1 ZINC000159467056 495738780 /nfs/dbraw/zinc/73/87/80/495738780.db2.gz MFPIFSBYLVHKMP-OAQYLSRUSA-N 2 0 367.541 3.496 20 70 FGIDRP C[C@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)C[NH+]1CCCC1 ZINC000159662401 495781439 /nfs/dbraw/zinc/78/14/39/495781439.db2.gz RZNHTRSZHCWZOK-LJQANCHMSA-N 2 0 364.578 3.016 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)CC1 ZINC000159814305 495816012 /nfs/dbraw/zinc/81/60/12/495816012.db2.gz SDSOTHUXLWMWBN-UHFFFAOYSA-N 2 0 372.557 3.156 20 70 FGIDRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c1 ZINC000160687172 496020429 /nfs/dbraw/zinc/02/04/29/496020429.db2.gz ICVNXVNPFDQCAM-HZPDHXFCSA-N 2 0 356.457 3.484 20 70 FGIDRP COCCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1OC ZINC000161066617 496097037 /nfs/dbraw/zinc/09/70/37/496097037.db2.gz KVTBQDMIRSKESD-NXHRZFHOSA-N 2 0 350.503 3.244 20 70 FGIDRP C[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccc(OCC[NH+](C)C)cc1 ZINC000161110875 496104831 /nfs/dbraw/zinc/10/48/31/496104831.db2.gz UGNVVWSMNDAJKD-INIZCTEOSA-N 2 0 356.466 3.249 20 70 FGIDRP CCc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1 ZINC000161211810 496128210 /nfs/dbraw/zinc/12/82/10/496128210.db2.gz WHDNNGZHKSYLPF-KRWDZBQOSA-N 2 0 353.510 3.391 20 70 FGIDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(OC)c1 ZINC000159475403 495740098 /nfs/dbraw/zinc/74/00/98/495740098.db2.gz UUJSXNDTPYUICP-OAQYLSRUSA-N 2 0 368.525 3.473 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4sccc43)cn2)CC1 ZINC000159517088 495749788 /nfs/dbraw/zinc/74/97/88/495749788.db2.gz SAILOOOICWLYAO-SFHVURJKSA-N 2 0 356.539 3.452 20 70 FGIDRP Cc1cccc2nc(C[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)cn21 ZINC000160290227 495928439 /nfs/dbraw/zinc/92/84/39/495928439.db2.gz GETLTKREZQQJDT-KRWDZBQOSA-N 2 0 352.482 3.434 20 70 FGIDRP C[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)[C@@H](C)c1ccccc1 ZINC000160564235 495992639 /nfs/dbraw/zinc/99/26/39/495992639.db2.gz PMVHAKQWOABOCL-LQWHRVPQSA-N 2 0 353.510 3.187 20 70 FGIDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1Br ZINC000160690557 496021258 /nfs/dbraw/zinc/02/12/58/496021258.db2.gz RFWSYWOITGHKEE-DZGCQCFKSA-N 2 0 373.310 3.476 20 70 FGIDRP C[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccc(OCC[NH+](C)C)cc1 ZINC000161111003 496104577 /nfs/dbraw/zinc/10/45/77/496104577.db2.gz UGNVVWSMNDAJKD-MRXNPFEDSA-N 2 0 356.466 3.249 20 70 FGIDRP C[N@@H+]1CCC[C@H]2CN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC[C@@H]21 ZINC000159452247 495736256 /nfs/dbraw/zinc/73/62/56/495736256.db2.gz HCECGSKOBZNOEB-SFTDATJTSA-N 2 0 369.553 3.231 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccccc3)C3CC3)cn2)CC1 ZINC000159466198 495738092 /nfs/dbraw/zinc/73/80/92/495738092.db2.gz ZGGHZCXPORRDRA-JOCHJYFZSA-N 2 0 364.537 3.334 20 70 FGIDRP CC(C)N(CC[NH+](C)C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159493920 495743702 /nfs/dbraw/zinc/74/37/02/495743702.db2.gz JBNXGQSDILKWFH-UYAOXDASSA-N 2 0 360.546 3.021 20 70 FGIDRP CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1 ZINC000159528532 495752567 /nfs/dbraw/zinc/75/25/67/495752567.db2.gz RKIASBVTHWSBJO-GOSISDBHSA-N 2 0 368.525 3.473 20 70 FGIDRP COc1cc([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)ccc1SC ZINC000160249420 495917807 /nfs/dbraw/zinc/91/78/07/495917807.db2.gz PRAWIJFVKXUVHU-HNNXBMFYSA-N 2 0 351.560 3.094 20 70 FGIDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(CC[NH+](C)C)C2CCCC2)C1 ZINC000160405082 495955409 /nfs/dbraw/zinc/95/54/09/495955409.db2.gz VEOFXHHDEZTKKV-KDURUIRLSA-N 2 0 366.594 3.260 20 70 FGIDRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(CC[NH+](C)C)C2CCCC2)C1 ZINC000160405353 495955851 /nfs/dbraw/zinc/95/58/51/495955851.db2.gz VEOFXHHDEZTKKV-RTBURBONSA-N 2 0 366.594 3.260 20 70 FGIDRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cnc4ccccn34)CC2)C[C@@H](C)O1 ZINC000160981915 496078771 /nfs/dbraw/zinc/07/87/71/496078771.db2.gz PIESUZHJYZRGOM-QZTJIDSGSA-N 2 0 356.514 3.046 20 70 FGIDRP CCn1nc(C)c([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1C ZINC000161214838 496127928 /nfs/dbraw/zinc/12/79/28/496127928.db2.gz MAGVESIZEYLJLX-MRXNPFEDSA-N 2 0 370.541 3.327 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000161251036 496137847 /nfs/dbraw/zinc/13/78/47/496137847.db2.gz QBTCEPGPMAJBIB-UHFFFAOYSA-N 2 0 357.542 3.455 20 70 FGIDRP CCC(CC)(C[NH3+])C(=O)N[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000161295888 496146353 /nfs/dbraw/zinc/14/63/53/496146353.db2.gz KPSSCIJEKPLDRL-INIZCTEOSA-N 2 0 371.447 3.161 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OC)cc3F)cn2)CC1 ZINC000159470346 495739451 /nfs/dbraw/zinc/73/94/51/495739451.db2.gz PWAHUUILRLPSGR-INIZCTEOSA-N 2 0 372.488 3.222 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(C)ccc3OC)cn2)CC1 ZINC000159499825 495746215 /nfs/dbraw/zinc/74/62/15/495746215.db2.gz YKCVLOLPYKOUCR-SFHVURJKSA-N 2 0 368.525 3.391 20 70 FGIDRP CC[N@@H+]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000159856575 495824952 /nfs/dbraw/zinc/82/49/52/495824952.db2.gz OHTGLKRLQCADLJ-UHFFFAOYSA-N 2 0 372.557 3.300 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)N[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000159939893 495846650 /nfs/dbraw/zinc/84/66/50/495846650.db2.gz GNEQKBBBSDTUFN-ICSRJNTNSA-N 2 0 372.557 3.165 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000160181225 495903514 /nfs/dbraw/zinc/90/35/14/495903514.db2.gz UZMUGKOEWXHIBH-LBPRGKRZSA-N 2 0 360.365 3.187 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000160685096 496019237 /nfs/dbraw/zinc/01/92/37/496019237.db2.gz HGXZRJZXPYLKEG-CRAIPNDOSA-N 2 0 352.906 3.380 20 70 FGIDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000161005447 496083296 /nfs/dbraw/zinc/08/32/96/496083296.db2.gz CBMREKQESRQVSI-DLBZAZTESA-N 2 0 363.933 3.407 20 70 FGIDRP CCN(CC)C(=O)C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000161097443 496102831 /nfs/dbraw/zinc/10/28/31/496102831.db2.gz LHBRSECPQCIHOM-XSLAUPDRSA-N 2 0 357.542 3.419 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CCCN(Cc2c(F)cccc2F)C1 ZINC000161120789 496108054 /nfs/dbraw/zinc/10/80/54/496108054.db2.gz WGXKRQGWANSGGQ-AXHMDWHKSA-N 2 0 351.485 3.248 20 70 FGIDRP CCN(C(=O)NC[C@@H](C)C[NH+]1CCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000159400738 495725279 /nfs/dbraw/zinc/72/52/79/495725279.db2.gz NZQWBIITBPLXBR-TZIWHRDSSA-N 2 0 372.557 3.024 20 70 FGIDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cccc(-c2ccncc2)c1 ZINC000160294985 495927925 /nfs/dbraw/zinc/92/79/25/495927925.db2.gz DZULNGVKGARUQF-SFHVURJKSA-N 2 0 352.526 3.425 20 70 FGIDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cnc(C)nc3C)cc2)CC1 ZINC000160314014 495934118 /nfs/dbraw/zinc/93/41/18/495934118.db2.gz TYPHHDJPZVBTAB-QGZVFWFLSA-N 2 0 367.541 3.082 20 70 FGIDRP C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000160564355 495992556 /nfs/dbraw/zinc/99/25/56/495992556.db2.gz PMVHAKQWOABOCL-WFXMLNOXSA-N 2 0 353.510 3.187 20 70 FGIDRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161233686 496133661 /nfs/dbraw/zinc/13/36/61/496133661.db2.gz OODYCVAPSPFCMZ-HRAATJIYSA-N 2 0 351.494 3.001 20 70 FGIDRP CC(=O)NC1CCC([NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000161291208 496144879 /nfs/dbraw/zinc/14/48/79/496144879.db2.gz YZOUDQNOTAQVLG-YTXWROIDSA-N 2 0 357.542 3.455 20 70 FGIDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4nc(C)sc43)cn2)CC1 ZINC000159519687 495751265 /nfs/dbraw/zinc/75/12/65/495751265.db2.gz WRNLZKDIKMZZSA-KRWDZBQOSA-N 2 0 371.554 3.156 20 70 FGIDRP CC[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000159743349 495798588 /nfs/dbraw/zinc/79/85/88/495798588.db2.gz IPSYLHZPLNQHHE-RBBKRZOGSA-N 2 0 360.542 3.462 20 70 FGIDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000160669626 496015890 /nfs/dbraw/zinc/01/58/90/496015890.db2.gz CZXKUQQWOWQCKE-SJLPKXTDSA-N 2 0 352.906 3.380 20 70 FGIDRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](C3CCCC3)C2)CC1 ZINC000160866480 496056223 /nfs/dbraw/zinc/05/62/23/496056223.db2.gz FVJGANDFJAEWKL-LJQANCHMSA-N 2 0 364.578 3.157 20 70 FGIDRP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H]2CCCC[N@@H+]2CC(C)C)CC1 ZINC000161011497 496085489 /nfs/dbraw/zinc/08/54/89/496085489.db2.gz JNENEDLFKNIAQF-IBGZPJMESA-N 2 0 352.567 3.013 20 70 FGIDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCN(Cc2c(F)cccc2F)C1 ZINC000161120565 496107729 /nfs/dbraw/zinc/10/77/29/496107729.db2.gz WGXKRQGWANSGGQ-NLDJYOPPSA-N 2 0 351.485 3.248 20 70 FGIDRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000161292223 496145291 /nfs/dbraw/zinc/14/52/91/496145291.db2.gz AUCSNRZFOHLNPX-QVKFZJNVSA-N 2 0 369.484 3.140 20 70 FGIDRP C[C@@H]1C[N@@H+](CCC2CC[NH+](CCC[NH+]3CCCCC3)CC2)C[C@H](C)O1 ZINC000161398832 496168829 /nfs/dbraw/zinc/16/88/29/496168829.db2.gz KPRHJPDYUWJQQE-BGYRXZFFSA-N 3 0 351.579 3.074 20 70 FGIDRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N(C)[C@H]2CCCC[C@@H]2C)CC1 ZINC000217198314 496995923 /nfs/dbraw/zinc/99/59/23/496995923.db2.gz XNAXYLJFVZWENL-ICSRJNTNSA-N 2 0 351.579 3.467 20 70 FGIDRP