smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000292731387 520249213 /nfs/dbraw/zinc/24/92/13/520249213.db2.gz GQNXRTQNPLYBLI-KRWDZBQOSA-N 2 0 289.467 2.835 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](CC)c1ccccc1O ZINC000156291056 520503160 /nfs/dbraw/zinc/50/31/60/520503160.db2.gz NODQQYWVZOGZEE-GDBMZVCRSA-N 2 0 294.439 2.790 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000360253574 521155258 /nfs/dbraw/zinc/15/52/58/521155258.db2.gz IUIQFVFCURVCNF-GJZGRUSLSA-N 2 0 290.407 2.507 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H](C)C[NH+](C)C)c1ccc(C)cc1O ZINC000293272204 522848635 /nfs/dbraw/zinc/84/86/35/522848635.db2.gz CIWDGTPCUYYRDA-UKRRQHHQSA-N 2 0 264.413 2.939 20 10 CFCDRP Cc1cccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1O ZINC000276739064 524429844 /nfs/dbraw/zinc/42/98/44/524429844.db2.gz CUQZCYYTMGEPTD-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cc(O)c(C[N@H+](C)CC2CC[NH+](C)CC2)cc1C ZINC000103462127 525311162 /nfs/dbraw/zinc/31/11/62/525311162.db2.gz BLPTYZOTSPIYRX-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1C ZINC000164773594 525318173 /nfs/dbraw/zinc/31/81/73/525318173.db2.gz GHRSSTHSHCGRDK-WBVHZDCISA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC2(C)CC[NH+](C)CC2)c1 ZINC000227330758 525345296 /nfs/dbraw/zinc/34/52/96/525345296.db2.gz SAQPOQANAOCIFA-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1O ZINC000167444865 525430236 /nfs/dbraw/zinc/43/02/36/525430236.db2.gz TVQIXBVRFWUTNL-CYBMUJFWSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1O ZINC000157344305 525571463 /nfs/dbraw/zinc/57/14/63/525571463.db2.gz VTXBHWDOLNNYHU-BFHYXJOUSA-N 2 0 260.381 2.670 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)c(O)c1 ZINC000049553637 525744399 /nfs/dbraw/zinc/74/43/99/525744399.db2.gz DIVKWVHBQWDJEY-CHWSQXEVSA-N 2 0 250.386 2.691 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+](C)C)c(O)c1 ZINC000045663674 525920608 /nfs/dbraw/zinc/92/06/08/525920608.db2.gz ZYCLICRHKCQSPE-ZDUSSCGKSA-N 2 0 250.386 2.693 20 10 CFCDRP COc1cccc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1O ZINC000019913062 526014563 /nfs/dbraw/zinc/01/45/63/526014563.db2.gz WJYCUJVYHJFZNZ-CQSZACIVSA-N 2 0 292.423 2.755 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)c1 ZINC000168758546 618198975 /nfs/dbraw/zinc/19/89/75/618198975.db2.gz DLHCCFLWUZSAQM-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH2+]C)CC2)cc1 ZINC000066057122 618439917 /nfs/dbraw/zinc/43/99/17/618439917.db2.gz SUUCLBFUUYSBIP-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)[C@H](N)C2)c1 ZINC000314384239 618792969 /nfs/dbraw/zinc/79/29/69/618792969.db2.gz UEGDQKIFSOQLTI-DLBZAZTESA-N 2 0 282.387 2.627 20 10 CFCDRP Nc1ccc(CC[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000925692567 618937862 /nfs/dbraw/zinc/93/78/62/618937862.db2.gz MWNJGNDBUAMJCZ-GOSISDBHSA-N 2 0 283.419 2.881 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)c1 ZINC000182472178 625312619 /nfs/dbraw/zinc/31/26/19/625312619.db2.gz XWACFAHBTGACOV-QWHCGFSZSA-N 2 0 278.396 2.536 20 10 CFCDRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c1O ZINC000894315018 619329596 /nfs/dbraw/zinc/32/95/96/619329596.db2.gz ANZRDQGJDZEMFY-LSDHHAIUSA-N 2 0 292.423 2.672 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1C ZINC000841029553 620256767 /nfs/dbraw/zinc/25/67/67/620256767.db2.gz IFRBODCMUATJSF-UKRRQHHQSA-N 2 0 262.397 2.616 20 10 CFCDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841030631 620257528 /nfs/dbraw/zinc/25/75/28/620257528.db2.gz YGPYKHWQBJWKEW-NSHDSACASA-N 2 0 274.339 2.841 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]4CCC[C@@H]43)cc2)CC1 ZINC000897955567 620310878 /nfs/dbraw/zinc/31/08/78/620310878.db2.gz WPZRMNUMMSWFKB-NZSAHSFTSA-N 2 0 299.462 2.717 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000902483738 621110290 /nfs/dbraw/zinc/11/02/90/621110290.db2.gz AMYQBAFYZDMHGM-HUBLWGQQSA-N 2 0 274.408 2.659 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)c1O ZINC000903959722 621480275 /nfs/dbraw/zinc/48/02/75/621480275.db2.gz MZHWELCTZKAFOQ-QGZVFWFLSA-N 2 0 274.408 2.666 20 10 CFCDRP Cc1cc(C)c(O)c(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC000164294319 622948632 /nfs/dbraw/zinc/94/86/32/622948632.db2.gz VLTYPPIKFYFBNO-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP C[C@@H](C[NH2+]Cc1cc(F)ccc1O)C[NH+]1CCCCC1 ZINC000226585452 623083859 /nfs/dbraw/zinc/08/38/59/623083859.db2.gz CYMIWBVDHPOKLJ-ZDUSSCGKSA-N 2 0 280.387 2.743 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@H]21 ZINC000228534966 623147826 /nfs/dbraw/zinc/14/78/26/623147826.db2.gz UYWMSGQARHWPOF-LERXQTSPSA-N 2 0 280.799 2.605 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c1O ZINC000229103812 623182985 /nfs/dbraw/zinc/18/29/85/623182985.db2.gz LIMHSQYLKMTMOT-MNOVXSKESA-N 2 0 298.814 2.613 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](C)CC2)cc1Cl ZINC000825247430 623658978 /nfs/dbraw/zinc/65/89/78/623658978.db2.gz RSRLOSCNBHPTOC-UHFFFAOYSA-N 2 0 282.815 2.785 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])c(O)c1 ZINC000817975728 625972594 /nfs/dbraw/zinc/97/25/94/625972594.db2.gz AAJBZQKTMDRKNV-STQMWFEESA-N 2 0 250.386 2.869 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)CC[N@@H+]1C ZINC000921779662 626120006 /nfs/dbraw/zinc/12/00/06/626120006.db2.gz KTPFLKPUSZWPFV-CJNGLKHVSA-N 2 0 274.408 2.584 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)CC[N@@H+]1C ZINC000921779663 626120351 /nfs/dbraw/zinc/12/03/51/626120351.db2.gz KTPFLKPUSZWPFV-CZUORRHYSA-N 2 0 274.408 2.584 20 10 CFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922181107 626232767 /nfs/dbraw/zinc/23/27/67/626232767.db2.gz NBAJGNGSQKXUAO-HNNXBMFYSA-N 2 0 288.435 2.833 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N(C)C)c(C)c2)CC[C@@H]1[NH3+] ZINC000923346472 626468409 /nfs/dbraw/zinc/46/84/09/626468409.db2.gz YSONQNWKNRLGDZ-CVEARBPZSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1C ZINC000839183506 626530032 /nfs/dbraw/zinc/53/00/32/626530032.db2.gz XLHXTUYFFIYLTA-OAHLLOKOSA-N 2 0 276.424 2.831 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000766030603 627172520 /nfs/dbraw/zinc/17/25/20/627172520.db2.gz UPSCXPISSSSZSQ-HOCLYGCPSA-N 2 0 275.440 2.633 20 10 CFCDRP CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771824961 627634281 /nfs/dbraw/zinc/63/42/81/627634281.db2.gz UFQPJBXLHOWMHF-HZPDHXFCSA-N 2 0 289.467 2.963 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)C3CC3)cc2)CC1 ZINC000771844264 627636865 /nfs/dbraw/zinc/63/68/65/627636865.db2.gz XXKBPTFIOARPSW-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC000775708953 628057700 /nfs/dbraw/zinc/05/77/00/628057700.db2.gz QLRXYEAQBUCYJO-HOTGVXAUSA-N 2 0 287.451 2.526 20 10 CFCDRP C[C@H]1C[C@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775715804 628058291 /nfs/dbraw/zinc/05/82/91/628058291.db2.gz LORMGGQJBLPHIL-HOTGVXAUSA-N 2 0 287.451 2.669 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2O)C[C@@H]1C ZINC000779027966 628346082 /nfs/dbraw/zinc/34/60/82/628346082.db2.gz UKODJLYYVSNVTF-DZGCQCFKSA-N 2 0 262.397 2.697 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C34CCC(CC3)C4)cc2)CC1 ZINC000784643255 628833689 /nfs/dbraw/zinc/83/36/89/628833689.db2.gz JIMQZGSEDVZDAK-UHFFFAOYSA-N 2 0 299.462 2.861 20 10 CFCDRP CC[NH+]1CCC([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835034017 629329768 /nfs/dbraw/zinc/32/97/68/629329768.db2.gz NFIOVIMFIOYLSE-AATRIKPKSA-N 2 0 287.451 2.840 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000835039681 629334106 /nfs/dbraw/zinc/33/41/06/629334106.db2.gz KBKSUEGQCJUQCX-YXMMZVCTSA-N 2 0 287.451 2.697 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC000040623333 649985820 /nfs/dbraw/zinc/98/58/20/649985820.db2.gz XSNNIWRGEZQHTM-MRXNPFEDSA-N 2 0 276.424 2.824 20 10 CFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1C ZINC000841032179 631312527 /nfs/dbraw/zinc/31/25/27/631312527.db2.gz OFYXNBLXKBNSCT-UHFFFAOYSA-N 2 0 284.403 2.800 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000841064072 631327061 /nfs/dbraw/zinc/32/70/61/631327061.db2.gz OWFLLHSXWWZJDQ-RHSMWYFYSA-N 2 0 275.440 2.620 20 10 CFCDRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841064911 631327744 /nfs/dbraw/zinc/32/77/44/631327744.db2.gz VVFZPKXBBVJQJU-YJBOKZPZSA-N 2 0 287.451 2.765 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000841081591 631333212 /nfs/dbraw/zinc/33/32/12/631333212.db2.gz YLVYVONHCFLZSY-CQSZACIVSA-N 2 0 263.429 2.668 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000841083170 631334071 /nfs/dbraw/zinc/33/40/71/631334071.db2.gz PFRRXUQKZILRNO-HAQNSBGRSA-N 2 0 282.815 2.900 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1O ZINC000841085220 631334589 /nfs/dbraw/zinc/33/45/89/631334589.db2.gz XBFPUDYCUBPQMR-ZWNOBZJWSA-N 2 0 268.788 2.571 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086482 631335374 /nfs/dbraw/zinc/33/53/74/631335374.db2.gz JNPZJDZFRCUXIA-GDBMZVCRSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000155295128 650016348 /nfs/dbraw/zinc/01/63/48/650016348.db2.gz CIMIFMMGWQLHER-AWEZNQCLSA-N 2 0 293.430 2.856 20 10 CFCDRP CCOc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c(O)c1 ZINC000843046962 631813502 /nfs/dbraw/zinc/81/35/02/631813502.db2.gz JCLSZPCUOVOBMV-YIONKMFJSA-N 2 0 290.407 2.506 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000843055018 631819225 /nfs/dbraw/zinc/81/92/25/631819225.db2.gz DCRCKBNVGFMSSU-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1F ZINC000843057053 631819785 /nfs/dbraw/zinc/81/97/85/631819785.db2.gz FULYQOUAXOLNGW-ZFWWWQNUSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cccc(C[N@@H+](C)CC[C@@H]([NH3+])C(C)C)c1O ZINC000843056717 631819819 /nfs/dbraw/zinc/81/98/19/631819819.db2.gz XPINLBZNOCJLIA-CQSZACIVSA-N 2 0 250.386 2.506 20 10 CFCDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843057180 631820880 /nfs/dbraw/zinc/82/08/80/631820880.db2.gz GJHNPHKOVDMGFI-NVXWUHKLSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000843059159 631821761 /nfs/dbraw/zinc/82/17/61/631821761.db2.gz DYPALZCMSFOZME-JQHSSLGASA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000843059160 631822227 /nfs/dbraw/zinc/82/22/27/631822227.db2.gz DYPALZCMSFOZME-RYQLBKOJSA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1O ZINC000843060183 631822767 /nfs/dbraw/zinc/82/27/67/631822767.db2.gz XLBRRPPJYSONIE-CQDKDKBSSA-N 2 0 294.826 2.913 20 10 CFCDRP CCCC[N@@H+](Cc1ccccc1O)CC1CC[NH2+]CC1 ZINC000843119367 631841159 /nfs/dbraw/zinc/84/11/59/631841159.db2.gz KHDPGWSMUUAWPQ-UHFFFAOYSA-N 2 0 276.424 2.994 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843124419 631844156 /nfs/dbraw/zinc/84/41/56/631844156.db2.gz ASFCNJXSUDLWPX-CABCVRRESA-N 2 0 274.408 2.522 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125534 631844741 /nfs/dbraw/zinc/84/47/41/631844741.db2.gz BAXZTEHLCIARMC-SJORKVTESA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1O ZINC000843130164 631848640 /nfs/dbraw/zinc/84/86/40/631848640.db2.gz ZBLYNDSPCRLOME-VHSXEESVSA-N 2 0 256.777 2.569 20 10 CFCDRP Cc1cc(C[N@H+](C)CCC[NH+]2CCCC2)ccc1N(C)C ZINC000815107323 632203136 /nfs/dbraw/zinc/20/31/36/632203136.db2.gz OGJQSJBCAWECEB-UHFFFAOYSA-N 2 0 289.467 2.979 20 10 CFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c(F)c2)[C@@H]1CC[NH3+] ZINC000844900666 632331072 /nfs/dbraw/zinc/33/10/72/632331072.db2.gz CIODMKMWLINTNP-XJKSGUPXSA-N 2 0 293.430 2.841 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000844927021 632339585 /nfs/dbraw/zinc/33/95/85/632339585.db2.gz YPPWCTBHZJCQJT-CYBMUJFWSA-N 2 0 270.376 2.962 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C[NH3+] ZINC000817864827 632714444 /nfs/dbraw/zinc/71/44/44/632714444.db2.gz CWPJDKCJXQOWKN-WZRBSPASSA-N 2 0 282.815 2.851 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000817865734 632715636 /nfs/dbraw/zinc/71/56/36/632715636.db2.gz XYLOYCVKNPTNKO-KMFMINBZSA-N 2 0 289.467 2.866 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000817887699 632717338 /nfs/dbraw/zinc/71/73/38/632717338.db2.gz CHQNICCLLNMQRA-KGLIPLIRSA-N 2 0 263.429 2.748 20 10 CFCDRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817896383 632720802 /nfs/dbraw/zinc/72/08/02/632720802.db2.gz IACVITYYTSPTKY-DNVCBOLYSA-N 2 0 297.446 2.801 20 10 CFCDRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899745 632723896 /nfs/dbraw/zinc/72/38/96/632723896.db2.gz PDMCBIPADXSSOL-YJBOKZPZSA-N 2 0 287.451 2.765 20 10 CFCDRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899743 632724413 /nfs/dbraw/zinc/72/44/13/632724413.db2.gz PDMCBIPADXSSOL-MAUKXSAKSA-N 2 0 287.451 2.765 20 10 CFCDRP C[NH2+]CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000817939230 632742835 /nfs/dbraw/zinc/74/28/35/632742835.db2.gz BDHOHDSSAAZADD-JTQLQIEISA-N 2 0 256.777 2.614 20 10 CFCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817937352 632742837 /nfs/dbraw/zinc/74/28/37/632742837.db2.gz WVOQCCSNPVZFHM-SECBINFHSA-N 2 0 299.212 2.557 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000817943962 632746050 /nfs/dbraw/zinc/74/60/50/632746050.db2.gz TXFLFFJRPJJBNU-JTQLQIEISA-N 2 0 256.777 2.696 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817945364 632747787 /nfs/dbraw/zinc/74/77/87/632747787.db2.gz AGUSZRMXUFFVPE-PBHICJAKSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2c1c(F)ccc2O ZINC000817946074 632748101 /nfs/dbraw/zinc/74/81/01/632748101.db2.gz QVWVXGJVDVXABQ-NTZNESFSSA-N 2 0 278.371 2.669 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(O)c1 ZINC000817945701 632748195 /nfs/dbraw/zinc/74/81/95/632748195.db2.gz JZTOOASZEUJALZ-KBPBESRZSA-N 2 0 262.397 2.659 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2c1c(F)ccc2O ZINC000817946077 632748311 /nfs/dbraw/zinc/74/83/11/632748311.db2.gz QVWVXGJVDVXABQ-WZRBSPASSA-N 2 0 278.371 2.669 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(N(C)C)cc1 ZINC000817959033 632757238 /nfs/dbraw/zinc/75/72/38/632757238.db2.gz ANYFZPNDXSUDMN-YSVLISHTSA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccccc1O ZINC000817959477 632758294 /nfs/dbraw/zinc/75/82/94/632758294.db2.gz GIAGYMVPTJKZNI-SNPRPXQTSA-N 2 0 262.397 2.950 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000817959862 632758341 /nfs/dbraw/zinc/75/83/41/632758341.db2.gz WBWKBFGGPWYZOH-CABZTGNLSA-N 2 0 256.777 2.680 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000817960339 632759173 /nfs/dbraw/zinc/75/91/73/632759173.db2.gz MFCUZARFODHKDE-GUTXKFCHSA-N 2 0 262.397 2.869 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1cc(Cl)ccc1O ZINC000817962209 632761783 /nfs/dbraw/zinc/76/17/83/632761783.db2.gz IYQWBNMUKSLOSM-BXKDBHETSA-N 2 0 256.777 2.681 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c1O ZINC000817963335 632762598 /nfs/dbraw/zinc/76/25/98/632762598.db2.gz UGUZFDMRRLWSPN-WCBMZHEXSA-N 2 0 256.777 2.599 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc2ccccc2c1O ZINC000817963950 632763206 /nfs/dbraw/zinc/76/32/06/632763206.db2.gz ZCFXWHNHVMTNHR-NWDGAFQWSA-N 2 0 258.365 2.791 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]([NH3+])C2CC2)c1O ZINC000817966032 632764073 /nfs/dbraw/zinc/76/40/73/632764073.db2.gz ZLRLTYLTLGTFKU-TVQRCGJNSA-N 2 0 268.788 2.742 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCC1)c1cc(Cl)ccc1O ZINC000817965774 632764287 /nfs/dbraw/zinc/76/42/87/632764287.db2.gz ZXJPKCKHMAPVOC-SECBINFHSA-N 2 0 254.761 2.578 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817965717 632764368 /nfs/dbraw/zinc/76/43/68/632764368.db2.gz UMXWUEYGWCFZQP-CVEARBPZSA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c(O)c1 ZINC000817967016 632766380 /nfs/dbraw/zinc/76/63/80/632766380.db2.gz CGVDQNZWIGQAGJ-ZDUSSCGKSA-N 2 0 260.381 2.579 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000817968202 632767216 /nfs/dbraw/zinc/76/72/16/632767216.db2.gz HJZZBIGZMWKFKP-HOCLYGCPSA-N 2 0 275.440 2.935 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)c(O)c1 ZINC000817971402 632771446 /nfs/dbraw/zinc/77/14/46/632771446.db2.gz LWMWJISQEAZFSK-RDBSUJKOSA-N 2 0 262.397 2.800 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000817972649 632772115 /nfs/dbraw/zinc/77/21/15/632772115.db2.gz ZGFOHJTYSXDXKS-RRQGHBQHSA-N 2 0 275.440 2.791 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972368 632772225 /nfs/dbraw/zinc/77/22/25/632772225.db2.gz WBAHXHKKUMFHFN-KMFMINBZSA-N 2 0 275.440 2.934 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1O ZINC000817977064 632775269 /nfs/dbraw/zinc/77/52/69/632775269.db2.gz ZXCPDHIVAWLFGC-YGRLFVJLSA-N 2 0 280.799 2.838 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817977602 632775506 /nfs/dbraw/zinc/77/55/06/632775506.db2.gz LHWVTDVFXVPUCQ-FOGDFJRCSA-N 2 0 266.360 2.797 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817979385 632776024 /nfs/dbraw/zinc/77/60/24/632776024.db2.gz JYHSKPKDKPFPTG-YPMHNXCESA-N 2 0 258.365 2.933 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(C)cc1O ZINC000817978169 632776336 /nfs/dbraw/zinc/77/63/36/632776336.db2.gz XUFYZVXOOIJHRV-OCCSQVGLSA-N 2 0 250.386 2.869 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CC2 ZINC000817980013 632776998 /nfs/dbraw/zinc/77/69/98/632776998.db2.gz HHYLDIDVHSGINR-KBPBESRZSA-N 2 0 260.381 2.501 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000817986586 632782325 /nfs/dbraw/zinc/78/23/25/632782325.db2.gz RWSZHGUGGOYNMX-RKTXRCNFSA-N 2 0 287.451 2.791 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1O ZINC000849350733 633626384 /nfs/dbraw/zinc/62/63/84/633626384.db2.gz ULTMJAJCTYFSGA-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000158731575 650234773 /nfs/dbraw/zinc/23/47/73/650234773.db2.gz JCDIWCTZZKMBCC-AWEZNQCLSA-N 2 0 262.397 2.521 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC34CC4)cc2)CC1 ZINC000865656251 638492169 /nfs/dbraw/zinc/49/21/69/638492169.db2.gz MVOKHRRBRXFAAO-GOSISDBHSA-N 2 0 299.462 2.861 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC34CC4)cc2)CC1 ZINC000865656252 638492412 /nfs/dbraw/zinc/49/24/12/638492412.db2.gz MVOKHRRBRXFAAO-SFHVURJKSA-N 2 0 299.462 2.861 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C)[C@H](C)C1 ZINC000122692499 639338220 /nfs/dbraw/zinc/33/82/20/639338220.db2.gz QTDCAKTWJSKADM-CRAIPNDOSA-N 2 0 289.467 2.881 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000872252113 641717723 /nfs/dbraw/zinc/71/77/23/641717723.db2.gz PTPLXHKWADIKRO-ZDUSSCGKSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220084 642073051 /nfs/dbraw/zinc/07/30/51/642073051.db2.gz JABJPHHTHJYXKH-CQSZACIVSA-N 2 0 275.440 2.539 20 10 CFCDRP Cc1cccc(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1O ZINC000873223898 642078638 /nfs/dbraw/zinc/07/86/38/642078638.db2.gz UIWOZWWMDBEGDD-KRWDZBQOSA-N 2 0 276.424 2.898 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)CCCCCC[NH3+])c1 ZINC000873231601 642085249 /nfs/dbraw/zinc/08/52/49/642085249.db2.gz RFWUQNYZBISPTI-UHFFFAOYSA-N 2 0 280.412 2.742 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(F)ccc1O ZINC000873244206 642091435 /nfs/dbraw/zinc/09/14/35/642091435.db2.gz KEINSAVXSOTIIF-AAEUAGOBSA-N 2 0 280.387 2.960 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1O ZINC000873265808 642109251 /nfs/dbraw/zinc/10/92/51/642109251.db2.gz XYMVADNQGYIVSH-FQLMCAECSA-N 2 0 274.408 2.964 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000876631592 642950965 /nfs/dbraw/zinc/95/09/65/642950965.db2.gz KLFDKNNNMNYPLB-UHFFFAOYSA-N 2 0 276.424 2.864 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)cc2O)[C@@H](C)C1 ZINC000876763598 642999146 /nfs/dbraw/zinc/99/91/46/642999146.db2.gz LCHHFCJLJKPNNG-HOCLYGCPSA-N 2 0 276.424 2.863 20 10 CFCDRP Cc1ccc(C[N@H+](C)CCC[NH+]2CCCC2)c(O)c1 ZINC000877495998 643308532 /nfs/dbraw/zinc/30/85/32/643308532.db2.gz KIZYSGPCRUKXGO-UHFFFAOYSA-N 2 0 262.397 2.618 20 10 CFCDRP Cc1cccc(O)c1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000877495364 643309157 /nfs/dbraw/zinc/30/91/57/643309157.db2.gz ACTVOCNNAZSWFB-UHFFFAOYSA-N 2 0 262.397 2.618 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H]2CCN2C2CCCC2)c(O)c1 ZINC000877656360 643435891 /nfs/dbraw/zinc/43/58/91/643435891.db2.gz FWZJUDOXQNCBGY-MRXNPFEDSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC000877740619 643508776 /nfs/dbraw/zinc/50/87/76/643508776.db2.gz KMQQNYABTNXXAQ-SJLPKXTDSA-N 2 0 287.451 2.587 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1O ZINC000877756587 643537685 /nfs/dbraw/zinc/53/76/85/643537685.db2.gz VTXBHWDOLNNYHU-MCIONIFRSA-N 2 0 260.381 2.670 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)ccc1N(C)C ZINC000879579514 644336475 /nfs/dbraw/zinc/33/64/75/644336475.db2.gz MZDPHXHVOSHDBQ-WMZOPIPTSA-N 2 0 287.451 2.587 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCSc2nccs2)[C@@H](C)C1 ZINC000248150216 650924928 /nfs/dbraw/zinc/92/49/28/650924928.db2.gz QQVJSKACPYJWDR-QWHCGFSZSA-N 2 0 299.509 2.945 20 10 CFCDRP C[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)ccc2O)CCN1C ZINC000093644260 650943657 /nfs/dbraw/zinc/94/36/57/650943657.db2.gz BTZDCOSOFDEULL-FZMZJTMJSA-N 2 0 282.815 2.960 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCSc2nccs2)[C@H](C)C1 ZINC000132196323 645890136 /nfs/dbraw/zinc/89/01/36/645890136.db2.gz QQVJSKACPYJWDR-CHWSQXEVSA-N 2 0 299.509 2.945 20 10 CFCDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000925559444 648216818 /nfs/dbraw/zinc/21/68/18/648216818.db2.gz UIQZQJNDXOZTPZ-LSDHHAIUSA-N 2 0 274.408 2.617 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925787680 648324221 /nfs/dbraw/zinc/32/42/21/648324221.db2.gz ZJKYMMYTQOGYSF-VWYCJHECSA-N 2 0 268.788 2.552 20 10 CFCDRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000925803136 648328179 /nfs/dbraw/zinc/32/81/79/648328179.db2.gz MLDUEIDUWBMOGT-FMKPAKJESA-N 2 0 276.424 2.987 20 10 CFCDRP Cc1c(CN2CC[NH2+][C@H](C)CC2)c2ccccc2n1C ZINC001210476952 770293617 /nfs/dbraw/zinc/29/36/17/770293617.db2.gz ZLZUKQMLDHRMNC-CYBMUJFWSA-N 2 0 271.408 2.671 20 10 CFCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(F)cc(C)c3O)(C1)CCC2 ZINC001277519274 777221193 /nfs/dbraw/zinc/22/11/93/777221193.db2.gz RAHWZJLAFWHXGN-DLBZAZTESA-N 2 0 292.398 2.994 20 10 CFCDRP CC(C)(C)c1ccc(CN2CC[C@](C)([NH3+])C2)c(O)c1 ZINC001204800810 777980928 /nfs/dbraw/zinc/98/09/28/777980928.db2.gz HBXXASOLPDKONB-INIZCTEOSA-N 2 0 262.397 2.613 20 10 CFCDRP CCN(CC)c1ccc(CN2CCC[C@@]23CC[NH2+]C3)cc1 ZINC001235111789 778384422 /nfs/dbraw/zinc/38/44/22/778384422.db2.gz VSLNRSYDYKGRPN-SFHVURJKSA-N 2 0 287.451 2.861 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001235224744 778420899 /nfs/dbraw/zinc/42/08/99/778420899.db2.gz OEOKACXUOQFJAY-MSOLQXFVSA-N 2 0 299.462 2.718 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235265711 778439311 /nfs/dbraw/zinc/43/93/11/778439311.db2.gz DOAWWXRRGIWVEG-BBRMVZONSA-N 2 0 288.435 2.874 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH2+]CC2)c(Cl)c1 ZINC001235432999 778488417 /nfs/dbraw/zinc/48/84/17/778488417.db2.gz DBCXCZDYVDBLLI-UHFFFAOYSA-N 2 0 295.858 2.837 20 10 CFCDRP C[C@H]1CC[C@@H]([NH3+])CN1Cc1ccc(N2CCCCC2)cc1 ZINC001235893113 778593769 /nfs/dbraw/zinc/59/37/69/778593769.db2.gz VCSCEJBRXWOYLT-DOTOQJQBSA-N 2 0 287.451 2.989 20 10 CFCDRP CC(C)(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c(O)c1 ZINC001235960661 778629883 /nfs/dbraw/zinc/62/98/83/778629883.db2.gz WCGDWQYPOYAONU-XOIINTDNSA-N 2 0 288.435 2.859 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC2(CCC2)C1 ZINC001236322204 778779209 /nfs/dbraw/zinc/77/92/09/778779209.db2.gz KAWGBXUZLMWDBZ-UHFFFAOYSA-N 2 0 299.462 2.862 20 10 CFCDRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1cc3ccccc3cc1O)C2 ZINC001236838137 778960509 /nfs/dbraw/zinc/96/05/09/778960509.db2.gz VNNVZYZCEAVEME-IEBWSBKVSA-N 2 0 296.414 2.929 20 10 CFCDRP Oc1ccc(Cl)cc1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237383090 779088272 /nfs/dbraw/zinc/08/82/72/779088272.db2.gz OCZFZUAQWWFZGR-FZMZJTMJSA-N 2 0 280.799 2.620 20 10 CFCDRP CC[N@H+](CCn1ccnc1)Cc1cc(F)cc(C)c1O ZINC001238067434 779243976 /nfs/dbraw/zinc/24/39/76/779243976.db2.gz PDGMOELLYZOVGG-UHFFFAOYSA-N 2 0 277.343 2.558 20 10 CFCDRP C[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001235679894 779367456 /nfs/dbraw/zinc/36/74/56/779367456.db2.gz ZRAMXFRVBZADLT-UHFFFAOYSA-N 2 0 295.858 2.837 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH3+])CC2)cc1Cl ZINC001205046296 780463982 /nfs/dbraw/zinc/46/39/82/780463982.db2.gz BSIYCULUQASXNI-UHFFFAOYSA-N 2 0 268.788 2.525 20 10 CFCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000700798934 780721837 /nfs/dbraw/zinc/72/18/37/780721837.db2.gz DPIHWVAUVVKSEU-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1O ZINC000019912999 372207901 /nfs/dbraw/zinc/20/79/01/372207901.db2.gz XMMODOGKBNZCEV-CQSZACIVSA-N 2 0 262.397 2.746 20 10 CFCDRP COc1ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc1C ZINC000035052355 372534055 /nfs/dbraw/zinc/53/40/55/372534055.db2.gz QLCJPBSDNWZBIV-UHFFFAOYSA-N 2 0 264.413 2.681 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C)cc2O)C1 ZINC000037644186 372681740 /nfs/dbraw/zinc/68/17/40/372681740.db2.gz CWFPHBPKDKSFLN-KBPBESRZSA-N 2 0 262.397 2.693 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000093598035 375272664 /nfs/dbraw/zinc/27/26/64/375272664.db2.gz RYLJJDPKBVPZPC-HNNXBMFYSA-N 2 0 274.408 2.618 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)ccc21 ZINC000378896147 781970886 /nfs/dbraw/zinc/97/08/86/781970886.db2.gz UWDODAWJYKNAFC-ROUUACIJSA-N 2 0 299.462 2.785 20 10 CFCDRP CCC[NH+]1CCC([N@H+](C)Cc2ccccc2O)CC1 ZINC000179562003 380557302 /nfs/dbraw/zinc/55/73/02/380557302.db2.gz MLZWPNXIBVQOMN-UHFFFAOYSA-N 2 0 262.397 2.698 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CCN(Cc2cc(F)ccc2O)C1 ZINC000180215302 380633582 /nfs/dbraw/zinc/63/35/82/380633582.db2.gz PCAYMTRDJSYXFE-ZDUSSCGKSA-N 2 0 280.387 2.695 20 10 CFCDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000297836853 381573757 /nfs/dbraw/zinc/57/37/57/381573757.db2.gz SEJDHMXNPZNZOA-RRFJBIMHSA-N 2 0 274.408 2.842 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185670786 381699510 /nfs/dbraw/zinc/69/95/10/381699510.db2.gz NBMZKOBCKUGEKW-LSDHHAIUSA-N 2 0 294.439 2.708 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3nccn3C)C2)cc1 ZINC000376045101 382117440 /nfs/dbraw/zinc/11/74/40/382117440.db2.gz VILSOEGDPWFJJN-INIZCTEOSA-N 2 0 298.434 2.866 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1N(C)C ZINC000293950760 382351333 /nfs/dbraw/zinc/35/13/33/382351333.db2.gz BSFTZCWAZSLKHM-QGZVFWFLSA-N 2 0 289.467 2.977 20 10 CFCDRP C[NH+](C)C[C@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295230726 382594623 /nfs/dbraw/zinc/59/46/23/382594623.db2.gz CUXSZCSLAAOZBL-SNVBAGLBSA-N 2 0 286.778 2.568 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(F)ccc1O ZINC000251750377 383394810 /nfs/dbraw/zinc/39/48/10/383394810.db2.gz RAWUUUKHGQBCSA-UBHSHLNASA-N 2 0 278.371 2.809 20 10 CFCDRP Cc1cc(O)c(C[N@H+](C)CCC[NH+]2CCCC2)cc1C ZINC000281179628 385183705 /nfs/dbraw/zinc/18/37/05/385183705.db2.gz HPBBBXPJBAORKX-UHFFFAOYSA-N 2 0 276.424 2.927 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)c(O)c1C ZINC000273562989 385687908 /nfs/dbraw/zinc/68/79/08/385687908.db2.gz IRANUBBEIBKAAB-OCCSQVGLSA-N 2 0 264.413 3.000 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000093693517 276109484 /nfs/dbraw/zinc/10/94/84/276109484.db2.gz USQRRSFGYVUABB-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP CCOc1cccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c1O ZINC000092253596 276379691 /nfs/dbraw/zinc/37/96/91/276379691.db2.gz RKSNWLRKSWBCID-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC000278753444 327194356 /nfs/dbraw/zinc/19/43/56/327194356.db2.gz OBRBABHDFKQMFX-MQVJKMGUSA-N 2 0 274.408 2.718 20 10 CFCDRP CCCOc1ccc(C[N@H+](C)C[C@@H]2CC[NH+](C)C2)c(O)c1 ZINC000156021141 520346270 /nfs/dbraw/zinc/34/62/70/520346270.db2.gz SGWFKTFYWSURRC-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP CCCC[NH+]1CCC([NH2+]Cc2cc(OC)ccc2O)CC1 ZINC000037149777 520576263 /nfs/dbraw/zinc/57/62/63/520576263.db2.gz GQWTVBKCTBEBMS-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP CC[NH+](CC)CCC[N@H+](CC)Cc1cccc(OC)c1O ZINC000230744985 520595314 /nfs/dbraw/zinc/59/53/14/520595314.db2.gz JKOCXUAIWIJLBA-UHFFFAOYSA-N 2 0 294.439 2.955 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1C ZINC000278493292 525323581 /nfs/dbraw/zinc/32/35/81/525323581.db2.gz LXQKKQZLCQJIAM-UHFFFAOYSA-N 2 0 288.435 2.973 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000217913938 525345510 /nfs/dbraw/zinc/34/55/10/525345510.db2.gz UFSRLXYMYSFJBE-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)c1 ZINC000049553876 525362563 /nfs/dbraw/zinc/36/25/63/525362563.db2.gz GKQBPAZUCDEVNY-CHWSQXEVSA-N 2 0 250.386 2.691 20 10 CFCDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccccc1O ZINC000228808611 525418897 /nfs/dbraw/zinc/41/88/97/525418897.db2.gz FGYGQHLYTSUSEL-CYBMUJFWSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1 ZINC000293613937 525925739 /nfs/dbraw/zinc/92/57/39/525925739.db2.gz JHNAXOJDXNTMSI-STQMWFEESA-N 2 0 250.386 2.549 20 10 CFCDRP COc1cccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c1O ZINC000092381227 525931727 /nfs/dbraw/zinc/93/17/27/525931727.db2.gz OFYROGBSQZBYEL-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000051694156 618049196 /nfs/dbraw/zinc/04/91/96/618049196.db2.gz RAXBAHJZTUFPLM-GRTSSRMGSA-N 2 0 261.413 2.673 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)CC1CC[NH+](C)CC1 ZINC000891853249 617786931 /nfs/dbraw/zinc/78/69/31/617786931.db2.gz GJYKCYINEUIJMT-UHFFFAOYSA-N 2 0 276.424 2.946 20 10 CFCDRP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000075760859 617988209 /nfs/dbraw/zinc/98/82/09/617988209.db2.gz GWSWXCHSMJQPJV-UHFFFAOYSA-N 2 0 289.467 2.963 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000313375380 618984829 /nfs/dbraw/zinc/98/48/29/618984829.db2.gz QMLBVDCDNZDEMF-OAHLLOKOSA-N 2 0 274.408 2.844 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000894984785 619522760 /nfs/dbraw/zinc/52/27/60/619522760.db2.gz KNFLEYKLUHJKBK-CQSZACIVSA-N 2 0 292.423 2.531 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000322956133 620395201 /nfs/dbraw/zinc/39/52/01/620395201.db2.gz UPRZFCBAAPEBEI-FUDCBSFHSA-N 2 0 290.407 2.677 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1F ZINC000841062814 620425396 /nfs/dbraw/zinc/42/53/96/620425396.db2.gz CRPOBDRTOMGBRS-XJKSGUPXSA-N 2 0 293.430 2.760 20 10 CFCDRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(F)c2[O-])CC[C@H]1C[NH3+] ZINC000904412210 621593231 /nfs/dbraw/zinc/59/32/31/621593231.db2.gz SFGVBENGBTXGQK-UWVGGRQHSA-N 2 0 286.778 2.601 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c1O ZINC000841090011 622352134 /nfs/dbraw/zinc/35/21/34/622352134.db2.gz DCEWYVYQHOIWLM-IAQYHMDHSA-N 2 0 282.815 2.771 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cc(OC)ccc2O)CC1 ZINC000044517465 622918293 /nfs/dbraw/zinc/91/82/93/622918293.db2.gz YVKWYQUPQUSSNO-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000164532246 622958142 /nfs/dbraw/zinc/95/81/42/622958142.db2.gz XMSWNYHWDYXNQO-WBVHZDCISA-N 2 0 288.435 2.925 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1cc(F)ccc1O ZINC000157652155 623043982 /nfs/dbraw/zinc/04/39/82/623043982.db2.gz VVICQYPDAIUQFK-MDZLAQPJSA-N 2 0 266.360 2.665 20 10 CFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c1O ZINC000229103538 623182996 /nfs/dbraw/zinc/18/29/96/623182996.db2.gz BZCMHHQOAMCSRB-SNVBAGLBSA-N 2 0 298.814 2.613 20 10 CFCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@@H]21 ZINC000230126053 623944159 /nfs/dbraw/zinc/94/41/59/623944159.db2.gz UYWMSGQARHWPOF-LEWSCRJBSA-N 2 0 280.799 2.605 20 10 CFCDRP Cc1cc(O)c(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1C ZINC000092253574 624154995 /nfs/dbraw/zinc/15/49/95/624154995.db2.gz XHYWWSPYDCSWDI-OAHLLOKOSA-N 2 0 276.424 2.783 20 10 CFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922285144 626259008 /nfs/dbraw/zinc/25/90/08/626259008.db2.gz WHEGKYIWYXLFPJ-INIZCTEOSA-N 2 0 288.435 2.833 20 10 CFCDRP Cc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)ccc1N(C)C ZINC000923331330 626466121 /nfs/dbraw/zinc/46/61/21/626466121.db2.gz FXHFBINCHNIQBS-YESZJQIVSA-N 2 0 287.451 2.620 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1 ZINC000839182164 626530010 /nfs/dbraw/zinc/53/00/10/626530010.db2.gz LFPHLMFUENYQTK-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000843056475 626549617 /nfs/dbraw/zinc/54/96/17/626549617.db2.gz LXZBEDPPXSOVIT-QGZVFWFLSA-N 2 0 277.456 2.866 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccco1 ZINC000771822753 627634694 /nfs/dbraw/zinc/63/46/94/627634694.db2.gz IIWYQLSBVRTTLX-OAHLLOKOSA-N 2 0 299.418 2.882 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC(C)(C)C3)cc2)CC1 ZINC000775690245 628055427 /nfs/dbraw/zinc/05/54/27/628055427.db2.gz MJLPYZFRRBOSNX-UHFFFAOYSA-N 2 0 287.451 2.670 20 10 CFCDRP CC(C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000776252573 628123081 /nfs/dbraw/zinc/12/30/81/628123081.db2.gz GYZDBGISTCSNSV-INIZCTEOSA-N 2 0 289.467 2.963 20 10 CFCDRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835038343 629332792 /nfs/dbraw/zinc/33/27/92/629332792.db2.gz WGAGWQMGEPCMJB-LFAOLKIESA-N 2 0 275.440 2.696 20 10 CFCDRP CN(C)c1ccc(/C=C/CN(C)CCC[NH+](C)C)cc1 ZINC000835052101 629350945 /nfs/dbraw/zinc/35/09/45/629350945.db2.gz AVSFNXLGWXJYBN-SOFGYWHQSA-N 2 0 275.440 2.649 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCCC[N@@H+](C)C2CC2)cc1C ZINC000835060402 629362502 /nfs/dbraw/zinc/36/25/02/629362502.db2.gz ACPVTGXQQUBHOW-UHFFFAOYSA-N 2 0 276.424 2.973 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1C ZINC000843120207 630785145 /nfs/dbraw/zinc/78/51/45/630785145.db2.gz WUDWBDCIIGZIPR-UHFFFAOYSA-N 2 0 274.408 2.585 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000840808613 631228657 /nfs/dbraw/zinc/22/86/57/631228657.db2.gz NASNRKSNCDVLEZ-ZIAGYGMSSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000840929634 631266964 /nfs/dbraw/zinc/26/69/64/631266964.db2.gz TVOUVKSTKSSWHA-OAHLLOKOSA-N 2 0 287.451 2.635 20 10 CFCDRP [NH3+]CCC[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000841018042 631308305 /nfs/dbraw/zinc/30/83/05/631308305.db2.gz ALRSDEFUQRTHHU-UHFFFAOYSA-N 2 0 262.397 2.876 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031502 631312285 /nfs/dbraw/zinc/31/22/85/631312285.db2.gz STZCTTLGGIFDED-FZMZJTMJSA-N 2 0 282.815 2.961 20 10 CFCDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000841055721 631322796 /nfs/dbraw/zinc/32/27/96/631322796.db2.gz URKMFRQAEHIZQD-RYUDHWBXSA-N 2 0 299.212 2.514 20 10 CFCDRP C[C@]1(C[NH2+]Cc2cc(Cl)ccc2O)CCC[NH2+]C1 ZINC000841056630 631324246 /nfs/dbraw/zinc/32/42/46/631324246.db2.gz HIXSIGAFSQUBIM-AWEZNQCLSA-N 2 0 268.788 2.525 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000841056921 631324436 /nfs/dbraw/zinc/32/44/36/631324436.db2.gz JZTILQMPQQUNHS-JXTAAOLFSA-N 2 0 287.451 2.745 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000841056928 631324805 /nfs/dbraw/zinc/32/48/05/631324805.db2.gz JZTILQMPQQUNHS-WLPBJKJWSA-N 2 0 287.451 2.745 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841078303 631332289 /nfs/dbraw/zinc/33/22/89/631332289.db2.gz FLAZTVUOCQCNIT-HNNXBMFYSA-N 2 0 275.440 2.894 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000841089512 631337577 /nfs/dbraw/zinc/33/75/77/631337577.db2.gz NZFQVZOCYZHOKB-HNNXBMFYSA-N 2 0 273.424 2.517 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841091399 631338577 /nfs/dbraw/zinc/33/85/77/631338577.db2.gz WYCXHFKOYFQIQW-INIZCTEOSA-N 2 0 287.451 2.825 20 10 CFCDRP CCC[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccccc1O ZINC000842472281 631639359 /nfs/dbraw/zinc/63/93/59/631639359.db2.gz VWDOFFWDABSRTB-OAHLLOKOSA-N 2 0 276.424 2.994 20 10 CFCDRP CCC[N@H+](Cc1cccc(C)c1O)C1CC[NH2+]CC1 ZINC000843044979 631812139 /nfs/dbraw/zinc/81/21/39/631812139.db2.gz OLHAWPYWDXFBIB-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP CCC[N@H+](Cc1cc(C)ccc1O)C1CC[NH2+]CC1 ZINC000843045236 631812326 /nfs/dbraw/zinc/81/23/26/631812326.db2.gz RWGGHMVAQMPSSX-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000843047345 631813102 /nfs/dbraw/zinc/81/31/02/631813102.db2.gz RKEKHZGBDJWLGU-BYICEURKSA-N 2 0 287.451 2.776 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000843047630 631813166 /nfs/dbraw/zinc/81/31/66/631813166.db2.gz YZTWOHGLTQSPMX-YIONKMFJSA-N 2 0 290.407 2.506 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000843050951 631814681 /nfs/dbraw/zinc/81/46/81/631814681.db2.gz CJXYGYPWEBJWJX-BUPRPMBJSA-N 2 0 287.451 2.825 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000843057001 631820487 /nfs/dbraw/zinc/82/04/87/631820487.db2.gz FBIANZYVTWPAPP-ZBFHGGJFSA-N 2 0 275.440 2.702 20 10 CFCDRP COc1cccc(C[N@H+](CCC[NH3+])CC2CCCC2)c1O ZINC000843122620 631841016 /nfs/dbraw/zinc/84/10/16/631841016.db2.gz DCGFVJGSMANQCB-UHFFFAOYSA-N 2 0 292.423 2.742 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124605 631843021 /nfs/dbraw/zinc/84/30/21/631843021.db2.gz DBIJWJRUIDDPKW-CHWSQXEVSA-N 2 0 294.826 2.867 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000843342176 631932640 /nfs/dbraw/zinc/93/26/40/631932640.db2.gz KPLMITKWSHBGOX-GVDBMIGSSA-N 2 0 287.451 2.539 20 10 CFCDRP C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C[NH+](C)C ZINC000813877567 631971564 /nfs/dbraw/zinc/97/15/64/631971564.db2.gz ZYDULJKNJRBAGE-WZRBSPASSA-N 2 0 280.387 2.867 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])cc1C ZINC000844902289 632331236 /nfs/dbraw/zinc/33/12/36/632331236.db2.gz OUDBFODJYIUSRL-LRDDRELGSA-N 2 0 276.424 2.958 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC(CC[NH3+])CC2)cc1 ZINC000844913030 632334646 /nfs/dbraw/zinc/33/46/46/632334646.db2.gz XMSPZDDWIAYDRW-ARJAWSKDSA-N 2 0 287.451 2.827 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCC2(C[NH3+])CC2)c2c1c(F)ccc2O ZINC000844921606 632337155 /nfs/dbraw/zinc/33/71/55/632337155.db2.gz QGXKRGFIYGWRSA-PWSUYJOCSA-N 2 0 278.371 2.798 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)ccc1O ZINC000844924756 632338706 /nfs/dbraw/zinc/33/87/06/632338706.db2.gz QGZKFCMUNPPZHO-JTQLQIEISA-N 2 0 292.329 2.980 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000816644634 632501459 /nfs/dbraw/zinc/50/14/59/632501459.db2.gz RUTXSCVBZFXULA-UHFFFAOYSA-N 2 0 280.387 2.887 20 10 CFCDRP CC[C@H](C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000817411197 632623701 /nfs/dbraw/zinc/62/37/01/632623701.db2.gz OVWSQGAGVDFTQM-HNNXBMFYSA-N 2 0 275.440 2.574 20 10 CFCDRP CCOc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)c(O)c1 ZINC000817416126 632626650 /nfs/dbraw/zinc/62/66/50/632626650.db2.gz JZEMRNHASOPLLQ-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)c1O ZINC000846144866 632645706 /nfs/dbraw/zinc/64/57/06/632645706.db2.gz KRCVAGUMMSDHTB-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(OC)c2O)C1 ZINC000846145892 632647022 /nfs/dbraw/zinc/64/70/22/632647022.db2.gz QQCGEMCYKSEQDJ-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c1O ZINC000846151355 632647586 /nfs/dbraw/zinc/64/75/86/632647586.db2.gz XAYDQHKYCAAEPK-BFHYXJOUSA-N 2 0 292.423 2.924 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000846169129 632652055 /nfs/dbraw/zinc/65/20/55/632652055.db2.gz OZKSSYGZGFQVNB-ZDUSSCGKSA-N 2 0 292.423 2.926 20 10 CFCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C[NH3+] ZINC000817864825 632714950 /nfs/dbraw/zinc/71/49/50/632714950.db2.gz CWPJDKCJXQOWKN-NTZNESFSSA-N 2 0 282.815 2.851 20 10 CFCDRP Cc1cccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817865752 632715559 /nfs/dbraw/zinc/71/55/59/632715559.db2.gz NOBLHGCWSCOEPP-YDHLFZDLSA-N 2 0 262.397 2.506 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCCC[C@@H]3C[NH3+])ccc21 ZINC000817901443 632724923 /nfs/dbraw/zinc/72/49/23/632724923.db2.gz VSERDAHWTFXVNB-IAGOWNOFSA-N 2 0 287.451 2.676 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CCCC[C@@H]3C[NH3+])ccc21 ZINC000817901445 632725738 /nfs/dbraw/zinc/72/57/38/632725738.db2.gz VSERDAHWTFXVNB-SJORKVTESA-N 2 0 287.451 2.676 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCCC[C@H]3C[NH3+])ccc21 ZINC000817901442 632725938 /nfs/dbraw/zinc/72/59/38/632725938.db2.gz VSERDAHWTFXVNB-DLBZAZTESA-N 2 0 287.451 2.676 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000817935757 632741870 /nfs/dbraw/zinc/74/18/70/632741870.db2.gz ZQRMEFCBCUFNRR-KKUMJFAQSA-N 2 0 277.456 2.707 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000817935755 632741900 /nfs/dbraw/zinc/74/19/00/632741900.db2.gz ZQRMEFCBCUFNRR-ILXRZTDVSA-N 2 0 277.456 2.707 20 10 CFCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817937675 632742655 /nfs/dbraw/zinc/74/26/55/632742655.db2.gz ZLHMSEFOQCIAJZ-GFCCVEGCSA-N 2 0 274.408 2.674 20 10 CFCDRP C[NH2+]CCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817942216 632745593 /nfs/dbraw/zinc/74/55/93/632745593.db2.gz YRWBENPBJVOKMS-GFCCVEGCSA-N 2 0 262.397 2.531 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000817946863 632748095 /nfs/dbraw/zinc/74/80/95/632748095.db2.gz GQFROLGHRNLLBH-MELADBBJSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(O)c1C ZINC000817955089 632754743 /nfs/dbraw/zinc/75/47/43/632754743.db2.gz QCCYCGYILQJDLM-UONOGXRCSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c1O ZINC000817958932 632756272 /nfs/dbraw/zinc/75/62/72/632756272.db2.gz MZZPPRMWKKPEJQ-GXFFZTMASA-N 2 0 270.804 2.988 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817963949 632763157 /nfs/dbraw/zinc/76/31/57/632763157.db2.gz ZCFXWHNHVMTNHR-NEPJUHHUSA-N 2 0 258.365 2.791 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc(Br)ccc1O ZINC000817965119 632764065 /nfs/dbraw/zinc/76/40/65/632764065.db2.gz LYFYGKPJOPEVMG-PRHODGIISA-N 2 0 299.212 2.543 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc2c(cc1O)CCCC2 ZINC000817965895 632764296 /nfs/dbraw/zinc/76/42/96/632764296.db2.gz WTMMFCRYCDTZDP-BZNIZROVSA-N 2 0 274.408 2.659 20 10 CFCDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(F)ccc1O ZINC000817965065 632764491 /nfs/dbraw/zinc/76/44/91/632764491.db2.gz ORSSPOCUECKFEK-NSHDSACASA-N 2 0 266.360 2.572 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000817966124 632765414 /nfs/dbraw/zinc/76/54/14/632765414.db2.gz GVVOCNDZRSXXBE-XJKSGUPXSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817968878 632767128 /nfs/dbraw/zinc/76/71/28/632767128.db2.gz OMQOVXDTMZQKJG-UKRRQHHQSA-N 2 0 261.413 2.545 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(C)cc1O ZINC000817970784 632770046 /nfs/dbraw/zinc/77/00/46/632770046.db2.gz FCZUWSMHPMPJFU-NFAWXSAZSA-N 2 0 262.397 2.882 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c(O)c1C ZINC000817971700 632770978 /nfs/dbraw/zinc/77/09/78/632770978.db2.gz PEPTXOTXCWTYGP-FPMFFAJLSA-N 2 0 262.397 2.800 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cc(Cl)ccc1O ZINC000817972217 632772050 /nfs/dbraw/zinc/77/20/50/632772050.db2.gz VFAMPBNZRXEXGC-OUJBWJOFSA-N 2 0 268.788 2.694 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000817972416 632772197 /nfs/dbraw/zinc/77/21/97/632772197.db2.gz XATXSYMXMCAXDM-IGCXYCKISA-N 2 0 288.435 2.920 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c(O)c1C ZINC000817976734 632774105 /nfs/dbraw/zinc/77/41/05/632774105.db2.gz SONMTOKVRMJITP-UKRRQHHQSA-N 2 0 274.408 2.802 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c(O)c1 ZINC000817976577 632774657 /nfs/dbraw/zinc/77/46/57/632774657.db2.gz ODRAGNMYNQQYBT-HIFRSBDPSA-N 2 0 274.408 2.802 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817979379 632776358 /nfs/dbraw/zinc/77/63/58/632776358.db2.gz JYHSKPKDKPFPTG-AAEUAGOBSA-N 2 0 258.365 2.933 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817981435 632778047 /nfs/dbraw/zinc/77/80/47/632778047.db2.gz JIDFYEYYPYCYCT-LXZKKBNFSA-N 2 0 275.440 2.921 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817982308 632778712 /nfs/dbraw/zinc/77/87/12/632778712.db2.gz RMKGEQGCBBBGKS-GZBFAFLISA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2c1c(F)ccc2O ZINC000817982464 632778857 /nfs/dbraw/zinc/77/88/57/632778857.db2.gz SQKRFEJEPPUEER-UZWSLXQKSA-N 2 0 278.371 2.797 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000817982158 632778998 /nfs/dbraw/zinc/77/89/98/632778998.db2.gz YOJKUQVEKHUVDK-OLZOCXBDSA-N 2 0 278.396 2.584 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N(C)C)cc1 ZINC000817983383 632779965 /nfs/dbraw/zinc/77/99/65/632779965.db2.gz BEFMJLRLXUKWRW-QGZVFWFLSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817984976 632781232 /nfs/dbraw/zinc/78/12/32/632781232.db2.gz DJWSLGNCFSUGEK-BXUZGUMPSA-N 2 0 290.382 2.979 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000817986589 632781773 /nfs/dbraw/zinc/78/17/73/632781773.db2.gz RXKNNHPLOZAVGF-CYBMUJFWSA-N 2 0 260.381 2.661 20 10 CFCDRP Cc1cccc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c1O ZINC000818431334 632843516 /nfs/dbraw/zinc/84/35/16/632843516.db2.gz JKCPUEMTLYGZNJ-AWEZNQCLSA-N 2 0 274.408 2.665 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cc(Cl)ccc1O ZINC000818614799 632880201 /nfs/dbraw/zinc/88/02/01/632880201.db2.gz GMXFSQXNTADVQA-ZWKOPEQDSA-N 2 0 268.788 2.966 20 10 CFCDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000848923938 633406381 /nfs/dbraw/zinc/40/63/81/633406381.db2.gz TUNOANMMCJYXID-AKAXFMLLSA-N 2 0 284.403 2.975 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CC[C@@H]1[NH3+] ZINC000122324387 638988839 /nfs/dbraw/zinc/98/88/39/638988839.db2.gz RNAKRWFNTSVJBU-GWCFXTLKSA-N 2 0 268.788 2.605 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C[NH3+] ZINC000873216681 642071388 /nfs/dbraw/zinc/07/13/88/642071388.db2.gz QWPZROAZSCTVHE-NVXWUHKLSA-N 2 0 287.451 2.704 20 10 CFCDRP C[C@H]([NH2+]Cc1c(O)cccc1Cl)C1CC[NH2+]CC1 ZINC000873222547 642075810 /nfs/dbraw/zinc/07/58/10/642075810.db2.gz YWGIBDHPLCZWDH-JTQLQIEISA-N 2 0 268.788 2.523 20 10 CFCDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccccc2O)C1 ZINC000873223681 642075833 /nfs/dbraw/zinc/07/58/33/642075833.db2.gz QYEFHLKNWHWPMQ-INIZCTEOSA-N 2 0 262.397 2.589 20 10 CFCDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccccc2O)C1 ZINC000873223682 642076373 /nfs/dbraw/zinc/07/63/73/642076373.db2.gz QYEFHLKNWHWPMQ-MRXNPFEDSA-N 2 0 262.397 2.589 20 10 CFCDRP C[C@H](NC[C@H]1CCC(C)(C)C[NH2+]1)c1ccccc1O ZINC000873234059 642086351 /nfs/dbraw/zinc/08/63/51/642086351.db2.gz BWRLIGYXDNNLNQ-QWHCGFSZSA-N 2 0 262.397 2.821 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000873239850 642089256 /nfs/dbraw/zinc/08/92/56/642089256.db2.gz DXQHWAXVPMZZEZ-AVGNSLFASA-N 2 0 278.396 2.569 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2ccccc2c1O ZINC000873250729 642096513 /nfs/dbraw/zinc/09/65/13/642096513.db2.gz INNRXYUMRGMCSZ-SGMGOOAPSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2ccccc2c1O ZINC000873255817 642101858 /nfs/dbraw/zinc/10/18/58/642101858.db2.gz INNRXYUMRGMCSZ-OBJOEFQTSA-N 2 0 270.376 2.933 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccccc1O ZINC000873268250 642111050 /nfs/dbraw/zinc/11/10/50/642111050.db2.gz BAZIGTWHGLHIQE-DOMZBBRYSA-N 2 0 262.397 2.821 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@H](C)c1ccccc1O ZINC000019942928 642231734 /nfs/dbraw/zinc/23/17/34/642231734.db2.gz XKYLZXUDODQBAJ-CYBMUJFWSA-N 2 0 250.386 2.775 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(C)cc2O)C1 ZINC000876964025 643084667 /nfs/dbraw/zinc/08/46/67/643084667.db2.gz PGNGABIVGWMKNY-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c(O)c1 ZINC000877473730 643291815 /nfs/dbraw/zinc/29/18/15/643291815.db2.gz LIZWMLOGWSUDEX-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)c(O)c1 ZINC000877492480 643306521 /nfs/dbraw/zinc/30/65/21/643306521.db2.gz XGORZKYAVZMRBE-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000877643926 643428452 /nfs/dbraw/zinc/42/84/52/643428452.db2.gz PHMUDWKGOXIXJD-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP C[C@@H]([NH3+])C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000128328592 644639961 /nfs/dbraw/zinc/63/99/61/644639961.db2.gz YUOOKPXLBCKRAT-SNVBAGLBSA-N 2 0 268.788 2.605 20 10 CFCDRP CC[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883291018 645725292 /nfs/dbraw/zinc/72/52/92/645725292.db2.gz PMKUITDOJSXFQZ-WMZOPIPTSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CCC(C)(C)[NH3+])c(O)c1 ZINC000925737759 648304474 /nfs/dbraw/zinc/30/44/74/648304474.db2.gz KUWDBVZOYDUTNF-LBPRGKRZSA-N 2 0 250.386 2.787 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925781632 648320940 /nfs/dbraw/zinc/32/09/40/648320940.db2.gz IYJSYZQCDCITKT-NEPJUHHUSA-N 2 0 284.350 2.596 20 10 CFCDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cc(F)ccc1O ZINC000925847333 648343139 /nfs/dbraw/zinc/34/31/39/648343139.db2.gz UMUMEHLRIOARTJ-IUIKQTSFSA-N 2 0 278.371 2.714 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(CC)c2O)C1 ZINC000693036266 770128846 /nfs/dbraw/zinc/12/88/46/770128846.db2.gz RNPWWSXWRPOHHD-AWEZNQCLSA-N 2 0 276.424 2.776 20 10 CFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1c(O)cccc1Cl)CC2 ZINC001140342201 770530234 /nfs/dbraw/zinc/53/02/34/770530234.db2.gz XDSXGMGNDUIMIL-UHFFFAOYSA-N 2 0 280.799 2.573 20 10 CFCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(Cl)cc3O)C2)CC1 ZINC001140465668 770687104 /nfs/dbraw/zinc/68/71/04/770687104.db2.gz QJPCOEHQERVTNH-UHFFFAOYSA-N 2 0 280.799 2.573 20 10 CFCDRP CCN(CC)c1ccc(CN2CCC[C@](C)([NH3+])C2)cc1 ZINC001204938098 776973861 /nfs/dbraw/zinc/97/38/61/776973861.db2.gz IMAQUVRELNLZEU-KRWDZBQOSA-N 2 0 275.440 2.846 20 10 CFCDRP Cc1cc(F)cc(C[NH+]2CCC3(CC[N@@H+](C)C3)CC2)c1O ZINC001277519112 777221492 /nfs/dbraw/zinc/22/14/92/777221492.db2.gz LDRFXKXFRPLLFT-UHFFFAOYSA-N 2 0 292.398 2.757 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235265714 778439248 /nfs/dbraw/zinc/43/92/48/778439248.db2.gz DOAWWXRRGIWVEG-XJKSGUPXSA-N 2 0 288.435 2.874 20 10 CFCDRP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC(C)(C)C ZINC001235715433 778545832 /nfs/dbraw/zinc/54/58/32/778545832.db2.gz SFFQHIRTVXUWQE-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@@H]1CC[C@@H]([NH3+])CN1Cc1ccc(N2CCCCC2)cc1 ZINC001235893114 778593872 /nfs/dbraw/zinc/59/38/72/778593872.db2.gz VCSCEJBRXWOYLT-NVXWUHKLSA-N 2 0 287.451 2.989 20 10 CFCDRP Oc1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)ccc2ccccc21 ZINC001236321673 778779270 /nfs/dbraw/zinc/77/92/70/778779270.db2.gz KUNVLKYVDYVFRX-IYBDPMFKSA-N 2 0 296.414 2.977 20 10 CFCDRP CC(C)c1ccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)c(O)c1 ZINC001237049970 779000661 /nfs/dbraw/zinc/00/06/61/779000661.db2.gz VEBDWZFFCYBGOI-IYBDPMFKSA-N 2 0 274.408 2.509 20 10 CFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@@H]2C1 ZINC001237051082 779000917 /nfs/dbraw/zinc/00/09/17/779000917.db2.gz HGRKMUFAMHYFFU-CALCHBBNSA-N 2 0 288.435 2.899 20 10 CFCDRP Cc1cc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237404630 779097788 /nfs/dbraw/zinc/09/77/88/779097788.db2.gz ODLWUAHCDFQJEL-HOCLYGCPSA-N 2 0 274.408 2.583 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccccc1O ZINC000705991757 781151422 /nfs/dbraw/zinc/15/14/22/781151422.db2.gz VTVLEGRRPLFKAZ-KBPBESRZSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000037648827 372685340 /nfs/dbraw/zinc/68/53/40/372685340.db2.gz MOASRXMIFMCJEC-LSDHHAIUSA-N 2 0 287.451 2.888 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)ccc2O)[C@H](C)C1 ZINC000180415561 380654406 /nfs/dbraw/zinc/65/44/06/380654406.db2.gz GEBDGPOYYLIVMD-CJNGLKHVSA-N 2 0 292.423 2.563 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(C)c2O)[C@H](C)C1 ZINC000180415398 380654491 /nfs/dbraw/zinc/65/44/91/380654491.db2.gz OAEDDICGDOKFFR-ZBFHGGJFSA-N 2 0 276.424 2.863 20 10 CFCDRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1O ZINC000183431212 381272285 /nfs/dbraw/zinc/27/22/85/381272285.db2.gz RUVXMIYEBGIBJL-ZDUSSCGKSA-N 2 0 274.408 2.917 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000185112754 381539831 /nfs/dbraw/zinc/53/98/31/381539831.db2.gz KBEXTNOYDXOSFR-QWHCGFSZSA-N 2 0 280.387 2.914 20 10 CFCDRP C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3O)[C@@H]2C1 ZINC000359909360 381671772 /nfs/dbraw/zinc/67/17/72/381671772.db2.gz YXXNKVGQUCWZQB-BXUZGUMPSA-N 2 0 280.799 2.572 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185671573 381699691 /nfs/dbraw/zinc/69/96/91/381699691.db2.gz PJUKELASXVXKSM-JSGCOSHPSA-N 2 0 298.402 2.539 20 10 CFCDRP COc1ccc(O)c(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000271852880 385393333 /nfs/dbraw/zinc/39/33/33/385393333.db2.gz WLPFPDKSPFHFSI-UHFFFAOYSA-N 2 0 292.423 2.705 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(O)c1 ZINC000285396355 385555665 /nfs/dbraw/zinc/55/56/65/385555665.db2.gz WZMMSXBDTBGOKB-CQSZACIVSA-N 2 0 274.408 2.922 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185670768 286198137 /nfs/dbraw/zinc/19/81/37/286198137.db2.gz NBMZKOBCKUGEKW-GJZGRUSLSA-N 2 0 294.439 2.708 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[NH+]2CCCC2)c(O)c1 ZINC000020129202 171017063 /nfs/dbraw/zinc/01/70/63/171017063.db2.gz GTAIMXNJXMHRRI-AWEZNQCLSA-N 2 0 262.397 2.837 20 10 CFCDRP COc1cccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1O ZINC000038041763 174043045 /nfs/dbraw/zinc/04/30/45/174043045.db2.gz KIAVQTIQCVCJRV-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C[NH+]1CCCC1 ZINC000296066692 278285519 /nfs/dbraw/zinc/28/55/19/278285519.db2.gz RYUFOQMRQPTBSY-DZGCQCFKSA-N 2 0 274.408 2.701 20 10 CFCDRP CCOCc1cc(C[NH2+]C[C@@H](C)C[NH+](C)C)ccc1OC ZINC000291701629 520186015 /nfs/dbraw/zinc/18/60/15/520186015.db2.gz KERDSMRONUYNMU-CQSZACIVSA-N 2 0 294.439 2.519 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1cc(C)ccc1O ZINC000071406137 520622427 /nfs/dbraw/zinc/62/24/27/520622427.db2.gz XOTFWYCLEFZKHU-UHFFFAOYSA-N 2 0 250.386 2.522 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@H+](CC)C2)cc1 ZINC000037644243 520906436 /nfs/dbraw/zinc/90/64/36/520906436.db2.gz TXECTPWUMDUELA-QGZVFWFLSA-N 2 0 289.467 2.964 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(F)ccc2O)C1 ZINC000245916295 521711665 /nfs/dbraw/zinc/71/16/65/521711665.db2.gz YKSOLVQLMLLCKU-NEPJUHHUSA-N 2 0 266.360 2.524 20 10 CFCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)CC[C@H]21 ZINC000228183261 523858148 /nfs/dbraw/zinc/85/81/48/523858148.db2.gz XZIJPZZQSAQDIR-SWLSCSKDSA-N 2 0 294.826 2.962 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([NH2+]C(C)C)CC2)c1O ZINC000179964886 524389353 /nfs/dbraw/zinc/38/93/53/524389353.db2.gz GDQPIHNAKVPTJT-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c1O ZINC000124715460 524433776 /nfs/dbraw/zinc/43/37/76/524433776.db2.gz DBFIQVLRJVHXSW-ZDUSSCGKSA-N 2 0 262.397 2.522 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1 ZINC000230672013 524761389 /nfs/dbraw/zinc/76/13/89/524761389.db2.gz DGHVQBGMSXWPPY-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000036908287 524914189 /nfs/dbraw/zinc/91/41/89/524914189.db2.gz NIVRSMKUZWETNK-CKEIUWERSA-N 2 0 275.440 2.571 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1C ZINC000272573521 525319476 /nfs/dbraw/zinc/31/94/76/525319476.db2.gz OWAYNDVZHHPQKI-UHFFFAOYSA-N 2 0 276.424 2.831 20 10 CFCDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1O ZINC000167444758 525330710 /nfs/dbraw/zinc/33/07/10/525330710.db2.gz TVQIXBVRFWUTNL-ZDUSSCGKSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000290421430 525340875 /nfs/dbraw/zinc/34/08/75/525340875.db2.gz KRRKHXFLXUUZRM-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1 ZINC000071408208 525348555 /nfs/dbraw/zinc/34/85/55/525348555.db2.gz YMVSUXLZUNTGFW-HNNXBMFYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c(O)c1 ZINC000037649050 525923036 /nfs/dbraw/zinc/92/30/36/525923036.db2.gz IAACUQGPBGHZGM-KBPBESRZSA-N 2 0 274.408 2.836 20 10 CFCDRP Cc1nccn1CCC[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000756433908 574236463 /nfs/dbraw/zinc/23/64/63/574236463.db2.gz RBTZGCMQCLSVDG-LLVKDONJSA-N 2 0 277.343 2.777 20 10 CFCDRP CCOc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c(O)c1 ZINC000725848943 574329048 /nfs/dbraw/zinc/32/90/48/574329048.db2.gz DIYGYMAIMHEFRW-CQSZACIVSA-N 2 0 292.423 2.611 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CCC[N@H+](C)CC(C)C)c1O ZINC000895129276 618351084 /nfs/dbraw/zinc/35/10/84/618351084.db2.gz SAFFLEPWOBJGKH-UHFFFAOYSA-N 2 0 294.439 2.777 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)cc1 ZINC000925511883 618850849 /nfs/dbraw/zinc/85/08/49/618850849.db2.gz WCPXIWDAEPQTKY-GJZGRUSLSA-N 2 0 275.440 2.748 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1 ZINC000925691926 618936669 /nfs/dbraw/zinc/93/66/69/618936669.db2.gz KVOODOUIPLHFQC-ZWKOTPCHSA-N 2 0 287.451 2.569 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCn3ccnc3C2)c(Cl)c1 ZINC000840938797 619078654 /nfs/dbraw/zinc/07/86/54/619078654.db2.gz ROTDAHBYYDWEKA-LLVKDONJSA-N 2 0 291.782 2.655 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000925792146 619117180 /nfs/dbraw/zinc/11/71/80/619117180.db2.gz UIOGZKMZFNETQI-KMFMINBZSA-N 2 0 275.440 2.649 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)c(O)c1 ZINC000895557726 619554828 /nfs/dbraw/zinc/55/48/28/619554828.db2.gz QRMDJPFTMZWXGV-OAHLLOKOSA-N 2 0 297.402 2.806 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1C ZINC000841028530 620255930 /nfs/dbraw/zinc/25/59/30/620255930.db2.gz AVZCNGXBZVIKBT-CABCVRRESA-N 2 0 262.397 2.611 20 10 CFCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000902483739 621110385 /nfs/dbraw/zinc/11/03/85/621110385.db2.gz AMYQBAFYZDMHGM-LALPHHSUSA-N 2 0 274.408 2.659 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903432831 621372647 /nfs/dbraw/zinc/37/26/47/621372647.db2.gz MYRHPZPTHDLPHZ-HIFRSBDPSA-N 2 0 262.397 2.732 20 10 CFCDRP c1cc2c(cc1CN[C@@H]1CC[NH2+]C13CCCC3)CCCO2 ZINC000904373450 621584637 /nfs/dbraw/zinc/58/46/37/621584637.db2.gz DXXYEVDEFDZZTP-QGZVFWFLSA-N 2 0 286.419 2.776 20 10 CFCDRP COc1cccc(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)c1O ZINC000904445483 621599387 /nfs/dbraw/zinc/59/93/87/621599387.db2.gz XUDMUKBRYQQYIM-UHFFFAOYSA-N 2 0 292.423 2.598 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1F ZINC000841085240 622219570 /nfs/dbraw/zinc/21/95/70/622219570.db2.gz XJIWBZRHRCIKRM-HIFRSBDPSA-N 2 0 293.430 2.889 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000827951088 624135616 /nfs/dbraw/zinc/13/56/16/624135616.db2.gz WJJSALQBGABGNZ-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070171453 625279523 /nfs/dbraw/zinc/27/95/23/625279523.db2.gz WHFPGBGPZBOMQO-QWRGUYRKSA-N 2 0 268.788 2.605 20 10 CFCDRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccccc1O ZINC000834910437 625920230 /nfs/dbraw/zinc/92/02/30/625920230.db2.gz TWCJKXCYPFHDOO-CYBMUJFWSA-N 2 0 262.397 2.917 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])c(O)c1 ZINC000817975726 625972565 /nfs/dbraw/zinc/97/25/65/625972565.db2.gz AAJBZQKTMDRKNV-OLZOCXBDSA-N 2 0 250.386 2.869 20 10 CFCDRP c1cc2c(cc1C[NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000921526498 625978000 /nfs/dbraw/zinc/97/80/00/625978000.db2.gz FBCYADKLAMITOL-OAHLLOKOSA-N 2 0 286.419 2.586 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000921546494 625981990 /nfs/dbraw/zinc/98/19/90/625981990.db2.gz DYYJPFDZKBVRGU-IAGOWNOFSA-N 2 0 286.419 2.728 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)ccc1N(C)C ZINC000923328785 626465762 /nfs/dbraw/zinc/46/57/62/626465762.db2.gz VIBBEXIMOHKILE-UHFFFAOYSA-N 2 0 287.451 2.637 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N(C)C)c(C)c2)CC[C@H]1[NH3+] ZINC000923346474 626468366 /nfs/dbraw/zinc/46/83/66/626468366.db2.gz YSONQNWKNRLGDZ-HZPDHXFCSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)ccc1N(C)C ZINC000923357126 626468591 /nfs/dbraw/zinc/46/85/91/626468591.db2.gz WPVIKJKFDJZWDF-SFHVURJKSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+](C)CC[C@H]([NH3+])C(C)C ZINC000843056474 626549695 /nfs/dbraw/zinc/54/96/95/626549695.db2.gz LXZBEDPPXSOVIT-KRWDZBQOSA-N 2 0 277.456 2.866 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1F ZINC000768304141 627332349 /nfs/dbraw/zinc/33/23/49/627332349.db2.gz XAOLCYXPUYTFNU-UHFFFAOYSA-N 2 0 293.430 2.665 20 10 CFCDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775639280 628048153 /nfs/dbraw/zinc/04/81/53/628048153.db2.gz RVGRKAUSCWSXCD-MRXNPFEDSA-N 2 0 287.451 2.813 20 10 CFCDRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2O)CC1 ZINC000778994212 628343695 /nfs/dbraw/zinc/34/36/95/628343695.db2.gz BDTMMBFLWOHDCH-UHFFFAOYSA-N 2 0 276.424 2.946 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC000852105847 634659873 /nfs/dbraw/zinc/65/98/73/634659873.db2.gz OUGAGVSQFXOVID-GOSISDBHSA-N 2 0 287.451 2.670 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CC(C)(C)C[NH+](C)C)cc1 ZINC000835034219 629329560 /nfs/dbraw/zinc/32/95/60/629329560.db2.gz PSIAHWVVPMLWHO-BQYQJAHWSA-N 2 0 289.467 2.943 20 10 CFCDRP CCOc1cccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1O ZINC000040746573 649986532 /nfs/dbraw/zinc/98/65/32/649986532.db2.gz SFUOXKPVBZDXMD-YIONKMFJSA-N 2 0 290.407 2.506 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000840810368 631227992 /nfs/dbraw/zinc/22/79/92/631227992.db2.gz SOAFTDIGRQQMSZ-STQMWFEESA-N 2 0 280.387 2.914 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000841029473 631310277 /nfs/dbraw/zinc/31/02/77/631310277.db2.gz HQPMZNCLXABYCQ-DOTOQJQBSA-N 2 0 275.440 2.750 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000841030814 631312727 /nfs/dbraw/zinc/31/27/27/631312727.db2.gz QUNQWHOLOWYNHU-SJPCQFCGSA-N 2 0 287.451 2.905 20 10 CFCDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841031685 631312734 /nfs/dbraw/zinc/31/27/34/631312734.db2.gz VKYSBRWPFBAPEW-SJLPKXTDSA-N 2 0 287.451 2.894 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1O ZINC000841035285 631314850 /nfs/dbraw/zinc/31/48/50/631314850.db2.gz ZLPQSOUECWEEGO-QWRGUYRKSA-N 2 0 298.814 2.532 20 10 CFCDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841052460 631322627 /nfs/dbraw/zinc/32/26/27/631322627.db2.gz XVSYNCVYSXGVEH-CQSZACIVSA-N 2 0 261.413 2.504 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1F ZINC000841061884 631327956 /nfs/dbraw/zinc/32/79/56/631327956.db2.gz PLBIBUOWXXSJFO-DZGCQCFKSA-N 2 0 293.430 2.902 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1O ZINC000841072986 631330378 /nfs/dbraw/zinc/33/03/78/631330378.db2.gz OLUNMVIIJXKBET-CYBMUJFWSA-N 2 0 298.814 2.676 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000841077662 631331847 /nfs/dbraw/zinc/33/18/47/631331847.db2.gz AHTMEKYBZJOBJB-LYASGUKUSA-N 2 0 275.440 2.873 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)CCCC[NH3+])c(Cl)c1 ZINC000841079861 631333239 /nfs/dbraw/zinc/33/32/39/631333239.db2.gz NKHRNBRMMDEONB-NSHDSACASA-N 2 0 270.804 2.961 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000841083575 631334035 /nfs/dbraw/zinc/33/40/35/631334035.db2.gz QEDLDNSSAWXOGQ-IRXDYDNUSA-N 2 0 287.451 2.894 20 10 CFCDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000841083572 631334087 /nfs/dbraw/zinc/33/40/87/631334087.db2.gz QEDLDNSSAWXOGQ-IAGOWNOFSA-N 2 0 287.451 2.894 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000841092230 631338140 /nfs/dbraw/zinc/33/81/40/631338140.db2.gz LNYUMXNAIHPZFP-UHFFFAOYSA-N 2 0 275.440 2.765 20 10 CFCDRP CSC1(C[NH2+]Cc2cccc(C)c2O)CC[NH+](C)CC1 ZINC000811513774 631575509 /nfs/dbraw/zinc/57/55/09/631575509.db2.gz PUEGEASMJBAPTL-UHFFFAOYSA-N 2 0 294.464 2.618 20 10 CFCDRP C[N@@H+]1C[C@@H](C[NH2+]Cc2ccccc2O)[C@H](c2ccccc2)C1 ZINC000842766517 631734428 /nfs/dbraw/zinc/73/44/28/631734428.db2.gz SYSWYLJRJVLBMX-MSOLQXFVSA-N 2 0 296.414 2.827 20 10 CFCDRP C[NH2+]C[C@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000843045409 631811552 /nfs/dbraw/zinc/81/15/52/631811552.db2.gz WQGHHEWAGVOCSD-XQDHMALISA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000843047058 631813184 /nfs/dbraw/zinc/81/31/84/631813184.db2.gz MRJYIXJJQNAKTL-SQHPWPPOSA-N 2 0 299.462 2.981 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCCC[C@H]2[C@H](C)[NH3+])cc1C ZINC000843046693 631814013 /nfs/dbraw/zinc/81/40/13/631814013.db2.gz ZEYKELVPJZMMDS-ZFWWWQNUSA-N 2 0 262.397 2.711 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1O ZINC000843046375 631814227 /nfs/dbraw/zinc/81/42/27/631814227.db2.gz SISLEDUUGKONLQ-MRXNPFEDSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(C)c(C)cc2O)CC[C@@H]1[NH3+] ZINC000843051322 631814758 /nfs/dbraw/zinc/81/47/58/631814758.db2.gz CXXFJWXYKLOHNU-ZFWWWQNUSA-N 2 0 262.397 2.568 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C2CCC([NH3+])CC2)cc1F ZINC000843055667 631819357 /nfs/dbraw/zinc/81/93/57/631819357.db2.gz KCFHHBZTEMOESC-UHFFFAOYSA-N 2 0 279.403 2.593 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000843057410 631820505 /nfs/dbraw/zinc/82/05/05/631820505.db2.gz KWDOQWJHGDGBIV-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP CCOc1ccc(C[NH+]2CCC(CC[NH2+]C)CC2)c(O)c1 ZINC000843057647 631820691 /nfs/dbraw/zinc/82/06/91/631820691.db2.gz PKWTYZHPNBSFMF-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000843060967 631823235 /nfs/dbraw/zinc/82/32/35/631823235.db2.gz UTCNZLWHCYDKIV-KRWDZBQOSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c(Cl)c1 ZINC000843113769 631838224 /nfs/dbraw/zinc/83/82/24/631838224.db2.gz CURSVEJEEWCEOY-AWEZNQCLSA-N 2 0 268.788 2.525 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1O ZINC000843116326 631840264 /nfs/dbraw/zinc/84/02/64/631840264.db2.gz KLDMYVNAUSHJHM-CQSZACIVSA-N 2 0 268.788 2.525 20 10 CFCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124764 631843886 /nfs/dbraw/zinc/84/38/86/631843886.db2.gz GKULBCZUJAZPPV-OLZOCXBDSA-N 2 0 294.826 2.867 20 10 CFCDRP [NH3+]CCC[N@@H+](Cc1ccccc1O)CC1CCCC1 ZINC000843123483 631844241 /nfs/dbraw/zinc/84/42/41/631844241.db2.gz KKJSCTGCBLCAES-UHFFFAOYSA-N 2 0 262.397 2.733 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c1O ZINC000843125887 631844776 /nfs/dbraw/zinc/84/47/76/631844776.db2.gz BRGJEPNIFRPBFJ-OAHLLOKOSA-N 2 0 274.408 2.522 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126308 631845645 /nfs/dbraw/zinc/84/56/45/631845645.db2.gz ISJYEKJJLHKBDN-KBPBESRZSA-N 2 0 292.398 2.743 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]Cc2ccc(C[NH3+])cc2)c1 ZINC000843129730 631849298 /nfs/dbraw/zinc/84/92/98/631849298.db2.gz ZFMIALYBUQQRCP-UHFFFAOYSA-N 2 0 286.375 2.539 20 10 CFCDRP CC[C@H]([NH2+]CCCCCC[NH3+])c1ccccc1O ZINC000843343361 631933037 /nfs/dbraw/zinc/93/30/37/631933037.db2.gz ZTKBMWLVYWYRAO-AWEZNQCLSA-N 2 0 250.386 2.952 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]Cc2ccc(C[NH3+])cc2F)c1 ZINC000844905405 632332003 /nfs/dbraw/zinc/33/20/03/632332003.db2.gz YYWJTOVEKPSHFA-UHFFFAOYSA-N 2 0 274.339 2.588 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000817413758 632625640 /nfs/dbraw/zinc/62/56/40/632625640.db2.gz GKKFYHCVXDIFBX-IYXRBSQSSA-N 2 0 292.423 2.924 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)c1O ZINC000846140896 632644322 /nfs/dbraw/zinc/64/43/22/632644322.db2.gz IHFIYYDYCLZNLU-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1O ZINC000846167724 632651934 /nfs/dbraw/zinc/65/19/34/632651934.db2.gz CCHAZSUWVXAEGJ-FUDCBSFHSA-N 2 0 290.407 2.677 20 10 CFCDRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817954393 632753572 /nfs/dbraw/zinc/75/35/72/632753572.db2.gz CJULBLZJCNZEFL-PBHICJAKSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2c1c(F)ccc2O ZINC000817954662 632754536 /nfs/dbraw/zinc/75/45/36/632754536.db2.gz GDNIRELRLHGZQW-WZRBSPASSA-N 2 0 278.371 2.669 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(O)c1C ZINC000817955088 632755111 /nfs/dbraw/zinc/75/51/11/632755111.db2.gz QCCYCGYILQJDLM-KGLIPLIRSA-N 2 0 262.397 2.659 20 10 CFCDRP Nc1ccc(CC[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000817956783 632755478 /nfs/dbraw/zinc/75/54/78/632755478.db2.gz CRTNLMASJCSFBG-SJORKVTESA-N 2 0 267.376 2.546 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c(O)c1C ZINC000817957642 632755713 /nfs/dbraw/zinc/75/57/13/632755713.db2.gz DLGZNSKITGEOEG-TZMCWYRMSA-N 2 0 250.386 2.643 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1 ZINC000817960679 632759157 /nfs/dbraw/zinc/75/91/57/632759157.db2.gz PKWVMBWGVUMOJG-SLEUVZQESA-N 2 0 278.396 2.569 20 10 CFCDRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccccc1O ZINC000817964666 632762775 /nfs/dbraw/zinc/76/27/75/632762775.db2.gz HUHNRSWSLHVVSF-AWEZNQCLSA-N 2 0 262.397 2.823 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2([NH3+])CCC2)cc1 ZINC000817965658 632764340 /nfs/dbraw/zinc/76/43/40/632764340.db2.gz YZFWZDDZSDGSKC-CYBMUJFWSA-N 2 0 261.413 2.675 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccccc1O ZINC000817966764 632766216 /nfs/dbraw/zinc/76/62/16/632766216.db2.gz VDHSRELNTHKTKQ-ZBFHGGJFSA-N 2 0 262.397 2.823 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817966983 632766539 /nfs/dbraw/zinc/76/65/39/632766539.db2.gz AZQIWXAUEKDAKW-MFKMUULPSA-N 2 0 276.355 2.589 20 10 CFCDRP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817969054 632767370 /nfs/dbraw/zinc/76/73/70/632767370.db2.gz QJQCJERQNHZJLE-NVXWUHKLSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000817970532 632769974 /nfs/dbraw/zinc/76/99/74/632769974.db2.gz ZHNWGHZNDOEQIM-MVWJERBFSA-N 2 0 268.788 2.966 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)c2c1c(F)ccc2O ZINC000817972652 632772335 /nfs/dbraw/zinc/77/23/35/632772335.db2.gz ZGPUXVHWJDTIFZ-SBFPOUOMSA-N 2 0 278.371 2.810 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)[C@H](C)[NH3+] ZINC000817977943 632775084 /nfs/dbraw/zinc/77/50/84/632775084.db2.gz RVBIUDJBNBOGOF-YIZRAAEISA-N 2 0 287.201 2.541 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817978668 632776351 /nfs/dbraw/zinc/77/63/51/632776351.db2.gz CXSBKNQCDWPKAD-BXUZGUMPSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccc1O ZINC000817980273 632777013 /nfs/dbraw/zinc/77/70/13/632777013.db2.gz KKICVXQGCVDEPJ-UKRRQHHQSA-N 2 0 262.397 2.965 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817981434 632777610 /nfs/dbraw/zinc/77/76/10/632777610.db2.gz JIDFYEYYPYCYCT-KMFMINBZSA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817980858 632777882 /nfs/dbraw/zinc/77/78/82/632777882.db2.gz XQGNXGNERXCHGS-WCBMZHEXSA-N 2 0 287.201 2.543 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c(O)c1 ZINC000817981885 632778614 /nfs/dbraw/zinc/77/86/14/632778614.db2.gz WPGRVKHEZNDKBO-ZIAGYGMSSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817982307 632779094 /nfs/dbraw/zinc/77/90/94/632779094.db2.gz RMKGEQGCBBBGKS-GUTXKFCHSA-N 2 0 261.413 2.531 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000817983405 632780068 /nfs/dbraw/zinc/78/00/68/632780068.db2.gz CHPHVVHRSQDQNF-AWEZNQCLSA-N 2 0 275.440 2.935 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(O)c1C ZINC000848558376 633288585 /nfs/dbraw/zinc/28/85/85/633288585.db2.gz OYNGMMPBDNIJCL-SOUVJXGZSA-N 2 0 276.424 3.000 20 10 CFCDRP CCc1cccc(C[NH+]2CC[C@H](C[N@@H+](C)CC)C2)c1O ZINC000848888818 633362608 /nfs/dbraw/zinc/36/26/08/633362608.db2.gz CJNOFVJPZRNSPC-CQSZACIVSA-N 2 0 276.424 2.728 20 10 CFCDRP CCc1cccc(C[N@H+](C)CCC[NH+]2CCCC2)c1O ZINC000848907923 633394454 /nfs/dbraw/zinc/39/44/54/633394454.db2.gz LBBLUSVQZSASKH-UHFFFAOYSA-N 2 0 276.424 2.872 20 10 CFCDRP Oc1ccccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850419895 633985718 /nfs/dbraw/zinc/98/57/18/633985718.db2.gz IPZVEHHWWQPRFM-UHFFFAOYSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1ccc([C@H](C)N[C@@H]2CC[C@H](C)[NH2+]C2)c(O)c1C ZINC000863547034 637693603 /nfs/dbraw/zinc/69/36/03/637693603.db2.gz OEKIZSXSWRYNLJ-FPMFFAJLSA-N 2 0 262.397 2.800 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2c(O)cccc2Cl)C1 ZINC000872251237 641718137 /nfs/dbraw/zinc/71/81/37/641718137.db2.gz IPEQPROVRUYILR-LLVKDONJSA-N 2 0 282.815 2.913 20 10 CFCDRP C[C@]12C[NH2+]C[C@H]1C[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000873228757 642079715 /nfs/dbraw/zinc/07/97/15/642079715.db2.gz VDXFCJSZKBENAW-PKOBYXMFSA-N 2 0 299.462 2.718 20 10 CFCDRP C[C@H](NC[C@@H]1CCC(C)(C)C[NH2+]1)c1ccccc1O ZINC000873234060 642086953 /nfs/dbraw/zinc/08/69/53/642086953.db2.gz BWRLIGYXDNNLNQ-STQMWFEESA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(F)ccc1O ZINC000873239824 642089685 /nfs/dbraw/zinc/08/96/85/642089685.db2.gz DIYNURZRJCHEOI-GVXVVHGQSA-N 2 0 266.360 2.699 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000873239685 642089988 /nfs/dbraw/zinc/08/99/88/642089988.db2.gz AQTHRVRTCJJWTL-IHRRRGAJSA-N 2 0 262.397 2.869 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1O ZINC000873240378 642090832 /nfs/dbraw/zinc/09/08/32/642090832.db2.gz PQHLSIJCZGTZKB-UMVBOHGHSA-N 2 0 262.397 2.950 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000873255557 642101954 /nfs/dbraw/zinc/10/19/54/642101954.db2.gz HOTSCJNVIBIZJG-HUBLWGQQSA-N 2 0 274.408 2.659 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)C1CC[NH2+]CC1 ZINC000873264293 642108379 /nfs/dbraw/zinc/10/83/79/642108379.db2.gz CZKORHLMLSGMLW-UONOGXRCSA-N 2 0 275.440 2.791 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000876906777 643059776 /nfs/dbraw/zinc/05/97/76/643059776.db2.gz HSSNUOQKAMUONG-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000876924877 643066477 /nfs/dbraw/zinc/06/64/77/643066477.db2.gz RRPCDZRAIOSVHB-UHFFFAOYSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c(O)c1 ZINC000876973053 643088659 /nfs/dbraw/zinc/08/86/59/643088659.db2.gz WENRAFHTVPRPDJ-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(C)cc2O)CC1 ZINC000877019060 643106269 /nfs/dbraw/zinc/10/62/69/643106269.db2.gz FQTSGFKGFYVVTK-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c(O)c1 ZINC000877533180 643336835 /nfs/dbraw/zinc/33/68/35/643336835.db2.gz ZZCFBEYLABGWIT-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP C[N@H+](Cc1cc(Cl)ccc1O)C1CCC([NH3+])CC1 ZINC000091843905 650910117 /nfs/dbraw/zinc/91/01/17/650910117.db2.gz WXWNXTULKMIQEM-UHFFFAOYSA-N 2 0 268.788 2.747 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000128352559 644649489 /nfs/dbraw/zinc/64/94/89/644649489.db2.gz HSLDOIWVSGDFQA-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP CC(C)CC[NH+]1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000924901024 648068441 /nfs/dbraw/zinc/06/84/41/648068441.db2.gz GPKSQCMGGPLNLN-UHFFFAOYSA-N 2 0 276.424 2.992 20 10 CFCDRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000311065756 775790268 /nfs/dbraw/zinc/79/02/68/775790268.db2.gz UASVZJDACSDXKV-NSHDSACASA-N 2 0 268.788 2.606 20 10 CFCDRP Cc1cc(C)c(C[N@H+](C)CCC[NH+]2CCCC2)c(O)c1 ZINC001231844306 777346115 /nfs/dbraw/zinc/34/61/15/777346115.db2.gz IMUWBRPRMBXSGO-UHFFFAOYSA-N 2 0 276.424 2.927 20 10 CFCDRP Cc1cc(C)c(C[N@H+]2C[C@@H]3CCCN(C)[C@@H]3C2)c(O)c1 ZINC001231847978 777348541 /nfs/dbraw/zinc/34/85/41/777348541.db2.gz GOSKCBLFHMUZQN-GOEBONIOSA-N 2 0 274.408 2.535 20 10 CFCDRP Cc1cc(C)c(C[N@H+]2C[C@H]3CCCN(C)[C@@H]3C2)c(O)c1 ZINC001231847977 777348714 /nfs/dbraw/zinc/34/87/14/777348714.db2.gz GOSKCBLFHMUZQN-GDBMZVCRSA-N 2 0 274.408 2.535 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235030421 778360348 /nfs/dbraw/zinc/36/03/48/778360348.db2.gz APBDQOWXCRVPNH-SFHVURJKSA-N 2 0 288.435 2.875 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC001235186024 778405276 /nfs/dbraw/zinc/40/52/76/778405276.db2.gz XUDZFXPLBUPNSE-HIFRSBDPSA-N 2 0 288.435 2.731 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c(O)c1 ZINC001235267748 778440541 /nfs/dbraw/zinc/44/05/41/778440541.db2.gz IJCLXENVALDYKW-XJKSGUPXSA-N 2 0 288.435 2.874 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235424377 778485946 /nfs/dbraw/zinc/48/59/46/778485946.db2.gz HNOOKQIHZRSMQO-JKSUJKDBSA-N 2 0 288.435 2.912 20 10 CFCDRP C[N@H+](CCC[NH3+])Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001235435230 778489201 /nfs/dbraw/zinc/48/92/01/778489201.db2.gz DIOUOCJNNUWGQN-UHFFFAOYSA-N 2 0 288.366 2.979 20 10 CFCDRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC001236280175 778758850 /nfs/dbraw/zinc/75/88/50/778758850.db2.gz UPUHBICAEVAJIO-MRXNPFEDSA-N 2 0 289.467 2.964 20 10 CFCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(CC)cc3O)C[C@@H]2C1 ZINC001236788755 778936658 /nfs/dbraw/zinc/93/66/58/778936658.db2.gz QDCLHDBOXJZHRZ-CALCHBBNSA-N 2 0 288.435 2.728 20 10 CFCDRP CC[C@H]([NH3+])CN(C)Cc1cc(C(C)(C)C)ccc1O ZINC001236885205 778970796 /nfs/dbraw/zinc/97/07/96/778970796.db2.gz XMDSSENSFQNUEW-AWEZNQCLSA-N 2 0 264.413 2.859 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000700817579 780725992 /nfs/dbraw/zinc/72/59/92/780725992.db2.gz VVDCZPOSQFPYTJ-QWHCGFSZSA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1O ZINC000019913001 372208043 /nfs/dbraw/zinc/20/80/43/372208043.db2.gz XMMODOGKBNZCEV-AWEZNQCLSA-N 2 0 262.397 2.746 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c(O)c1 ZINC000020087883 372226219 /nfs/dbraw/zinc/22/62/19/372226219.db2.gz YGROXHUSFCGIGN-CYBMUJFWSA-N 2 0 264.413 2.939 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c1 ZINC000092253858 375097669 /nfs/dbraw/zinc/09/76/69/375097669.db2.gz VQRACAGHLZFGSW-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)ccc2O)C1 ZINC000093742391 375306059 /nfs/dbraw/zinc/30/60/59/375306059.db2.gz QDEVYKKVAUUSCI-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CCOc1cccc(C[N@H+](C)CC2CC[NH+](C)CC2)c1O ZINC000134009210 377974821 /nfs/dbraw/zinc/97/48/21/377974821.db2.gz ZTTQPDGAEMDQHA-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2O)CC1 ZINC000179580428 380561396 /nfs/dbraw/zinc/56/13/96/380561396.db2.gz XMWQESZXIKQMFM-UHFFFAOYSA-N 2 0 276.424 2.946 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cccc(C)c2O)C1 ZINC000180486377 380667687 /nfs/dbraw/zinc/66/76/87/380667687.db2.gz FZUIXMVVQRKPFB-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1O ZINC000183544907 381285100 /nfs/dbraw/zinc/28/51/00/381285100.db2.gz NACKIHOXALDXRF-IHRRRGAJSA-N 2 0 262.397 2.916 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@H]4[C@@H]3C2)cc1 ZINC000371403534 381616574 /nfs/dbraw/zinc/61/65/74/381616574.db2.gz SWRMTTUXGBAJAD-QRQLOZEOSA-N 2 0 299.462 2.669 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(O)c1C ZINC000273476690 385684017 /nfs/dbraw/zinc/68/40/17/385684017.db2.gz KXSMVOPJHWMTLG-AWEZNQCLSA-N 2 0 274.408 2.922 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185671381 286443167 /nfs/dbraw/zinc/44/31/67/286443167.db2.gz QMIMAGXBMQCRSX-HUUCEWRRSA-N 2 0 294.439 2.708 20 10 CFCDRP C[N@H+](Cc1ccccc1O)C1CCN(c2cc[nH+]cc2)CC1 ZINC000367690603 267109982 /nfs/dbraw/zinc/10/99/82/267109982.db2.gz UMKJJYKLPUXBCW-UHFFFAOYSA-N 2 0 297.402 2.888 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(N(C)C)cc1 ZINC000221783118 519617364 /nfs/dbraw/zinc/61/73/64/519617364.db2.gz ANMYTEBYZSWLIJ-UHFFFAOYSA-N 2 0 263.429 2.573 20 10 CFCDRP CCCOc1ccc(C[N@H+](C)C[C@H]2CC[NH+](C)C2)c(O)c1 ZINC000156021243 520345643 /nfs/dbraw/zinc/34/56/43/520345643.db2.gz SGWFKTFYWSURRC-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000020128687 522205594 /nfs/dbraw/zinc/20/55/94/522205594.db2.gz XMPPSNYCHGZJIH-UHFFFAOYSA-N 2 0 275.440 2.718 20 10 CFCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(O)cccc3Cl)CC[C@@H]21 ZINC000156094140 523834322 /nfs/dbraw/zinc/83/43/22/523834322.db2.gz CHXVLGSODXCNKG-DOMZBBRYSA-N 2 0 294.826 2.962 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1cc(F)ccc1O ZINC000094616605 525309692 /nfs/dbraw/zinc/30/96/92/525309692.db2.gz MIYATHRIBVTAGO-NSHDSACASA-N 2 0 268.376 2.770 20 10 CFCDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1O ZINC000278462062 525325280 /nfs/dbraw/zinc/32/52/80/525325280.db2.gz MTGZPRHKBNDZIQ-ZDUSSCGKSA-N 2 0 274.408 2.917 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276742872 525347546 /nfs/dbraw/zinc/34/75/46/525347546.db2.gz YJAZXBDZISLINX-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649182 525504164 /nfs/dbraw/zinc/50/41/64/525504164.db2.gz HLZGDGBDCXBCRA-CHWSQXEVSA-N 2 0 260.381 2.527 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(F)ccc1O ZINC000157373948 525620834 /nfs/dbraw/zinc/62/08/34/525620834.db2.gz RAWUUUKHGQBCSA-FPMFFAJLSA-N 2 0 278.371 2.809 20 10 CFCDRP C[NH+]1CCC(C[NH2+]CCCSc2nccs2)CC1 ZINC000893044596 618813591 /nfs/dbraw/zinc/81/35/91/618813591.db2.gz IGQIPCOLYGAJPP-UHFFFAOYSA-N 2 0 285.482 2.557 20 10 CFCDRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C12CCC2 ZINC000925542703 618902739 /nfs/dbraw/zinc/90/27/39/618902739.db2.gz IORRWGGJVAWGIZ-SJORKVTESA-N 2 0 285.435 2.646 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)c(O)c1 ZINC000895557724 619554905 /nfs/dbraw/zinc/55/49/05/619554905.db2.gz QRMDJPFTMZWXGV-HNNXBMFYSA-N 2 0 297.402 2.806 20 10 CFCDRP Cc1ccc(C[NH+]2CCC(C)([NH+]3CCC3)CC2)c(O)c1 ZINC000895670751 619582814 /nfs/dbraw/zinc/58/28/14/619582814.db2.gz DXHGRHYQUMLKSS-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000895670780 619582852 /nfs/dbraw/zinc/58/28/52/619582852.db2.gz FIXBLBLXCYGXJZ-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1C ZINC000841029563 620256732 /nfs/dbraw/zinc/25/67/32/620256732.db2.gz IFRBODCMUATJSF-ZFWWWQNUSA-N 2 0 262.397 2.616 20 10 CFCDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841030596 620257765 /nfs/dbraw/zinc/25/77/65/620257765.db2.gz YGPYKHWQBJWKEW-LLVKDONJSA-N 2 0 274.339 2.841 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]4CCC[C@H]43)cc2)CC1 ZINC000897955566 620310728 /nfs/dbraw/zinc/31/07/28/620310728.db2.gz WPZRMNUMMSWFKB-BHIYHBOVSA-N 2 0 299.462 2.717 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981004 620317801 /nfs/dbraw/zinc/31/78/01/620317801.db2.gz IDBZVWJXZPGNIL-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc(N)cc1 ZINC000841038844 620379621 /nfs/dbraw/zinc/37/96/21/620379621.db2.gz RKNSVVJVMXLRGW-RHSMWYFYSA-N 2 0 275.440 2.712 20 10 CFCDRP CCCC[C@H](COC)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000841041771 620398456 /nfs/dbraw/zinc/39/84/56/620398456.db2.gz BTYMGKRBMDZYFR-NVXWUHKLSA-N 2 0 293.455 2.547 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1F ZINC000841061987 620424471 /nfs/dbraw/zinc/42/44/71/620424471.db2.gz PLBIBUOWXXSJFO-ZFWWWQNUSA-N 2 0 293.430 2.902 20 10 CFCDRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000906518424 621996566 /nfs/dbraw/zinc/99/65/66/621996566.db2.gz YOBPELQLQIARBN-WKILWMFISA-N 2 0 298.386 2.551 20 10 CFCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@H]21 ZINC000228534974 623148126 /nfs/dbraw/zinc/14/81/26/623148126.db2.gz UYWMSGQARHWPOF-ZLKJLUDKSA-N 2 0 280.799 2.605 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2CC[NH3+])c1O ZINC000229103738 623183093 /nfs/dbraw/zinc/18/30/93/623183093.db2.gz ATUKJJWVTINZGS-ZDUSSCGKSA-N 2 0 298.814 2.758 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC000826538766 623808495 /nfs/dbraw/zinc/80/84/95/623808495.db2.gz JWRIVHLZYVSPPS-HKUYNNGSSA-N 2 0 299.462 2.813 20 10 CFCDRP Cc1cc(O)c(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc1C ZINC000092253575 624155587 /nfs/dbraw/zinc/15/55/87/624155587.db2.gz XHYWWSPYDCSWDI-HNNXBMFYSA-N 2 0 276.424 2.783 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2ccc(N(C)C)c(C)c2)CC[C@@H]1[NH3+] ZINC000923346473 626468383 /nfs/dbraw/zinc/46/83/83/626468383.db2.gz YSONQNWKNRLGDZ-HOTGVXAUSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1occc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771824012 627634365 /nfs/dbraw/zinc/63/43/65/627634365.db2.gz HXTJPMPGPOJLCT-UHFFFAOYSA-N 2 0 299.418 2.630 20 10 CFCDRP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771830420 627635056 /nfs/dbraw/zinc/63/50/56/627635056.db2.gz QVCNOKOTAUQEBD-YJBOKZPZSA-N 2 0 287.451 2.717 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)ccc2O)C[C@@H]1C ZINC000775715472 628058485 /nfs/dbraw/zinc/05/84/85/628058485.db2.gz FQQGBWOAPPOCPQ-ZFWWWQNUSA-N 2 0 292.423 2.705 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)ccc2O)C[C@H]1C ZINC000775715468 628058648 /nfs/dbraw/zinc/05/86/48/628058648.db2.gz FQQGBWOAPPOCPQ-HIFRSBDPSA-N 2 0 292.423 2.705 20 10 CFCDRP COc1ccc(C[NH2+]CCCC[N@H+](C)C2CC2)cc1C ZINC000835061400 629364422 /nfs/dbraw/zinc/36/44/22/629364422.db2.gz HMCQDTBYRYJNRF-UHFFFAOYSA-N 2 0 276.424 2.968 20 10 CFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000040621674 649985806 /nfs/dbraw/zinc/98/58/06/649985806.db2.gz KBKZSSFDZYGFPX-LBPRGKRZSA-N 2 0 282.815 2.866 20 10 CFCDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841030982 631311585 /nfs/dbraw/zinc/31/15/85/631311585.db2.gz QNYJTPOSAWJIEE-NVXWUHKLSA-N 2 0 273.424 2.504 20 10 CFCDRP C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCC[NH2+]C1 ZINC000841033285 631313393 /nfs/dbraw/zinc/31/33/93/631313393.db2.gz MMNZESGLCDLANK-UWVGGRQHSA-N 2 0 286.778 2.662 20 10 CFCDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841052459 631322052 /nfs/dbraw/zinc/32/20/52/631322052.db2.gz XVSYNCVYSXGVEH-AWEZNQCLSA-N 2 0 261.413 2.504 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1O ZINC000841058577 631326491 /nfs/dbraw/zinc/32/64/91/631326491.db2.gz YESQLIRMKUAADO-HNNXBMFYSA-N 2 0 298.814 2.534 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088888 631336833 /nfs/dbraw/zinc/33/68/33/631336833.db2.gz FHIIJIAQBDHUIR-CYBMUJFWSA-N 2 0 280.799 2.810 20 10 CFCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Cl)cc1O ZINC000841747969 631464046 /nfs/dbraw/zinc/46/40/46/631464046.db2.gz FZUQGTVBQQTKDI-LLVKDONJSA-N 2 0 280.799 2.958 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCCC[C@H]2[C@@H](C)[NH3+])cc1C ZINC000843046691 631813203 /nfs/dbraw/zinc/81/32/03/631813203.db2.gz ZEYKELVPJZMMDS-HIFRSBDPSA-N 2 0 262.397 2.711 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1O ZINC000843046374 631813218 /nfs/dbraw/zinc/81/32/18/631813218.db2.gz SISLEDUUGKONLQ-INIZCTEOSA-N 2 0 274.408 2.665 20 10 CFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1F ZINC000843047404 631814064 /nfs/dbraw/zinc/81/40/64/631814064.db2.gz NSMLOXCJFDEDTL-UHFFFAOYSA-N 2 0 293.430 2.843 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(C)c(C)cc2O)CC[C@@H]1[NH3+] ZINC000843051319 631814570 /nfs/dbraw/zinc/81/45/70/631814570.db2.gz CXXFJWXYKLOHNU-HIFRSBDPSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c1O ZINC000843051944 631816047 /nfs/dbraw/zinc/81/60/47/631816047.db2.gz NANOZDUCRREYRP-NEPJUHHUSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1O ZINC000843057558 631820564 /nfs/dbraw/zinc/82/05/64/631820564.db2.gz KAFBJFYPCZCXCD-WDEREUQCSA-N 2 0 268.788 2.523 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000843105636 631836878 /nfs/dbraw/zinc/83/68/78/631836878.db2.gz ZMUCNWIHBXEDED-ONEGZZNKSA-N 2 0 273.424 2.625 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000843113560 631838389 /nfs/dbraw/zinc/83/83/89/631838389.db2.gz XCEUIUASRQRJAP-OAHLLOKOSA-N 2 0 275.440 2.622 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC000843119672 631841361 /nfs/dbraw/zinc/84/13/61/631841361.db2.gz BGXBRKIILVNAAT-ARJAWSKDSA-N 2 0 299.462 2.841 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124608 631843483 /nfs/dbraw/zinc/84/34/83/631843483.db2.gz DBIJWJRUIDDPKW-STQMWFEESA-N 2 0 294.826 2.867 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1C ZINC000843124699 631843636 /nfs/dbraw/zinc/84/36/36/631843636.db2.gz FLRUHRKFHUTZJB-JKSUJKDBSA-N 2 0 288.435 2.831 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1C ZINC000843124697 631844265 /nfs/dbraw/zinc/84/42/65/631844265.db2.gz FLRUHRKFHUTZJB-HZPDHXFCSA-N 2 0 288.435 2.831 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1 ZINC000843128912 631847666 /nfs/dbraw/zinc/84/76/66/631847666.db2.gz ZEGRDULUJDOSMO-KRWDZBQOSA-N 2 0 287.451 2.574 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000843128276 631847698 /nfs/dbraw/zinc/84/76/98/631847698.db2.gz VMCCKYKTZCQLMU-FUHWJXTLSA-N 2 0 287.451 2.717 20 10 CFCDRP CCOc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)c(O)c1 ZINC000843127725 631848158 /nfs/dbraw/zinc/84/81/58/631848158.db2.gz HKPJMNOISWHIKX-UHFFFAOYSA-N 2 0 286.375 2.539 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000843128277 631848172 /nfs/dbraw/zinc/84/81/72/631848172.db2.gz VMCCKYKTZCQLMU-SJLPKXTDSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1C ZINC000843129743 631849247 /nfs/dbraw/zinc/84/92/47/631849247.db2.gz ZPCPLGHPTUOMPI-UHFFFAOYSA-N 2 0 270.376 2.758 20 10 CFCDRP Cc1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)ccc1N(C)C ZINC000815052891 632191939 /nfs/dbraw/zinc/19/19/39/632191939.db2.gz FXWZMFJCZGLJKP-QGZVFWFLSA-N 2 0 289.467 2.835 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(C)ccc1O ZINC000844905350 632331727 /nfs/dbraw/zinc/33/17/27/632331727.db2.gz XKQWNCWGWARFGY-UHFFFAOYSA-N 2 0 270.376 2.710 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CCC2(C[NH3+])CC2)c(O)c1 ZINC000844920852 632336337 /nfs/dbraw/zinc/33/63/37/632336337.db2.gz NOSYNQCGBCEXTN-ZDUSSCGKSA-N 2 0 262.397 2.789 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1O ZINC000846167725 632652468 /nfs/dbraw/zinc/65/24/68/632652468.db2.gz CCHAZSUWVXAEGJ-RLAWYHOSSA-N 2 0 290.407 2.677 20 10 CFCDRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817896384 632720845 /nfs/dbraw/zinc/72/08/45/632720845.db2.gz IACVITYYTSPTKY-HNAYVOBHSA-N 2 0 297.446 2.801 20 10 CFCDRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899742 632723775 /nfs/dbraw/zinc/72/37/75/632723775.db2.gz PDMCBIPADXSSOL-CRAIPNDOSA-N 2 0 287.451 2.765 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC[NH2+]CC2)c1O ZINC000817937592 632742649 /nfs/dbraw/zinc/74/26/49/632742649.db2.gz YCWHKSQVUPTYSG-SNVBAGLBSA-N 2 0 268.788 2.757 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817947796 632749597 /nfs/dbraw/zinc/74/95/97/632749597.db2.gz RHLCMFPDZQGEOI-GUTXKFCHSA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)ccc1O ZINC000817947439 632749671 /nfs/dbraw/zinc/74/96/71/632749671.db2.gz NJMAWZKWDKJYIW-GCVQQVDUSA-N 2 0 268.788 2.966 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[NH2+]C(C)C)c(O)c1 ZINC000817953551 632753925 /nfs/dbraw/zinc/75/39/25/632753925.db2.gz NXHVQVJOTDIRSQ-ZDUSSCGKSA-N 2 0 250.386 2.739 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(N(C)C)cc1 ZINC000817960381 632759254 /nfs/dbraw/zinc/75/92/54/632759254.db2.gz YMNSDVULONDWRC-HOTGVXAUSA-N 2 0 263.429 2.777 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)[NH3+])c1O ZINC000817960813 632759727 /nfs/dbraw/zinc/75/97/27/632759727.db2.gz QWYSINUFLBRAPS-SECBINFHSA-N 2 0 256.777 2.742 20 10 CFCDRP CC[C@@H]([NH2+]CC([NH3+])(CC)CC)c1ccccc1O ZINC000817961274 632760082 /nfs/dbraw/zinc/76/00/82/632760082.db2.gz ZWLFIEYGAATTNA-CYBMUJFWSA-N 2 0 250.386 2.950 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCC1)c1cc(Br)ccc1O ZINC000817964382 632763028 /nfs/dbraw/zinc/76/30/28/632763028.db2.gz AIVAKROAIMOEBJ-VIFPVBQESA-N 2 0 299.212 2.687 20 10 CFCDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817964460 632763192 /nfs/dbraw/zinc/76/31/92/632763192.db2.gz DMVVYEQWMDYTBZ-AWEZNQCLSA-N 2 0 275.440 2.793 20 10 CFCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000817964906 632763452 /nfs/dbraw/zinc/76/34/52/632763452.db2.gz JCOPWBLRTACKTE-GOSISDBHSA-N 2 0 296.414 2.875 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c1O ZINC000817967155 632766780 /nfs/dbraw/zinc/76/67/80/632766780.db2.gz DGMRCUPLKFNVRT-NSHDSACASA-N 2 0 280.799 2.924 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(O)c1 ZINC000817968490 632767163 /nfs/dbraw/zinc/76/71/63/632767163.db2.gz KEKZRAYEHMUYRH-ZIAGYGMSSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968195 632767179 /nfs/dbraw/zinc/76/71/79/632767179.db2.gz HJACYCNHRQREOI-ZYHUDNBSSA-N 2 0 268.788 2.838 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817969056 632767611 /nfs/dbraw/zinc/76/76/11/632767611.db2.gz QJQCJERQNHZJLE-WBVHZDCISA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)ccc1O ZINC000817971172 632770651 /nfs/dbraw/zinc/77/06/51/632770651.db2.gz JXXIAUDJIWHATI-CKYFFXLPSA-N 2 0 268.788 2.837 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c(O)c1C ZINC000817971704 632770709 /nfs/dbraw/zinc/77/07/09/632770709.db2.gz PEPTXOTXCWTYGP-UBHSHLNASA-N 2 0 262.397 2.800 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)ccc1O ZINC000817971175 632770733 /nfs/dbraw/zinc/77/07/33/632770733.db2.gz JXXIAUDJIWHATI-SCVCMEIPSA-N 2 0 268.788 2.837 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972371 632772272 /nfs/dbraw/zinc/77/22/72/632772272.db2.gz WBAHXHKKUMFHFN-UNEWFSDZSA-N 2 0 275.440 2.934 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000817974519 632773449 /nfs/dbraw/zinc/77/34/49/632773449.db2.gz BVRKKZLXJOFFIJ-YDHLFZDLSA-N 2 0 274.408 2.734 20 10 CFCDRP CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccccc1O ZINC000817976121 632774078 /nfs/dbraw/zinc/77/40/78/632774078.db2.gz GOBBMQUAUSAFNO-GXTWGEPZSA-N 2 0 250.386 2.950 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000817976534 632774375 /nfs/dbraw/zinc/77/43/75/632774375.db2.gz NDEQOKHXKJMTAC-CHWSQXEVSA-N 2 0 250.386 2.869 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)[C@H](C)[NH3+] ZINC000817977363 632775529 /nfs/dbraw/zinc/77/55/29/632775529.db2.gz ITXXJDBFRRQZFQ-TUAOUCFPSA-N 2 0 262.397 2.657 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c(O)c1 ZINC000817978208 632776058 /nfs/dbraw/zinc/77/60/58/632776058.db2.gz YLDZKKBZPCIJQH-STQMWFEESA-N 2 0 250.386 2.787 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000817980187 632776995 /nfs/dbraw/zinc/77/69/95/632776995.db2.gz JUDWWTFEAWUCIC-KBPBESRZSA-N 2 0 262.397 2.883 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000817980191 632777127 /nfs/dbraw/zinc/77/71/27/632777127.db2.gz JUDWWTFEAWUCIC-UONOGXRCSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2c1c(F)ccc2O ZINC000817982463 632778754 /nfs/dbraw/zinc/77/87/54/632778754.db2.gz SQKRFEJEPPUEER-DCQANWLSSA-N 2 0 278.371 2.797 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000817982160 632779024 /nfs/dbraw/zinc/77/90/24/632779024.db2.gz YOJKUQVEKHUVDK-STQMWFEESA-N 2 0 278.396 2.584 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(O)c1 ZINC000848558808 633289133 /nfs/dbraw/zinc/28/91/33/633289133.db2.gz SQUUGEGPHOAULC-SOUVJXGZSA-N 2 0 276.424 3.000 20 10 CFCDRP CCc1cccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000848916559 633400226 /nfs/dbraw/zinc/40/02/26/633400226.db2.gz IQAGREKQEZLDOR-CQSZACIVSA-N 2 0 276.424 2.776 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850421509 633985452 /nfs/dbraw/zinc/98/54/52/633985452.db2.gz YBKWSFLBPBBMOI-UHFFFAOYSA-N 2 0 288.435 2.912 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1 ZINC000858245153 636162922 /nfs/dbraw/zinc/16/29/22/636162922.db2.gz NZMGECUYLWPMEM-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1F ZINC000122763678 639403263 /nfs/dbraw/zinc/40/32/63/639403263.db2.gz AWMHWPMYTJFOJT-OAHLLOKOSA-N 2 0 293.430 2.665 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000872252112 641718119 /nfs/dbraw/zinc/71/81/19/641718119.db2.gz PTPLXHKWADIKRO-CYBMUJFWSA-N 2 0 282.815 2.913 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1C ZINC000872252759 641718654 /nfs/dbraw/zinc/71/86/54/641718654.db2.gz VKJQEGHIKFQWBP-OAHLLOKOSA-N 2 0 276.424 2.871 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1O ZINC000873254838 642100841 /nfs/dbraw/zinc/10/08/41/642100841.db2.gz ADARCEUJNAQTBM-CKYFFXLPSA-N 2 0 268.788 2.742 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000876759787 642998099 /nfs/dbraw/zinc/99/80/99/642998099.db2.gz QPVVEQBAOYKRLS-HNNXBMFYSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c(O)c1 ZINC000876813877 643022631 /nfs/dbraw/zinc/02/26/31/643022631.db2.gz YBIDGHCJUCYTHS-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000877596723 643389278 /nfs/dbraw/zinc/38/92/78/643389278.db2.gz WPRAXIFCNJSKCZ-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1O ZINC000877758148 643538395 /nfs/dbraw/zinc/53/83/95/643538395.db2.gz KUEUYKHNWONHDH-QWHCGFSZSA-N 2 0 262.397 2.916 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000246459546 650870070 /nfs/dbraw/zinc/87/00/70/650870070.db2.gz JDGKOANHJCWGMI-DOTOQJQBSA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)ccc1N(C)C ZINC000879579512 644335380 /nfs/dbraw/zinc/33/53/80/644335380.db2.gz MZDPHXHVOSHDBQ-FUHWJXTLSA-N 2 0 287.451 2.587 20 10 CFCDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000094617959 650960180 /nfs/dbraw/zinc/96/01/80/650960180.db2.gz NBJKQTXAKGXTHT-NSHDSACASA-N 2 0 266.360 2.524 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCCSc2nccs2)CC[N@@H+]1C ZINC000132157717 645884820 /nfs/dbraw/zinc/88/48/20/645884820.db2.gz IAMYZGZJMCFDPA-NWDGAFQWSA-N 2 0 285.482 2.698 20 10 CFCDRP C[C@@H]([NH2+]CCCSc1nccs1)C1CC[NH+](C)CC1 ZINC000132315041 645905519 /nfs/dbraw/zinc/90/55/19/645905519.db2.gz SHGLKRMWTMGKGQ-GFCCVEGCSA-N 2 0 299.509 2.945 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1c([O-])cccc1F ZINC000886641203 647083062 /nfs/dbraw/zinc/08/30/62/647083062.db2.gz CHTSVACWMJNVAQ-QWHCGFSZSA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])c2c1c(F)ccc2O ZINC000925737498 648304602 /nfs/dbraw/zinc/30/46/02/648304602.db2.gz JMUWERAKFZADPE-KOLCDFICSA-N 2 0 266.360 2.797 20 10 CFCDRP CCN(CC)c1ccc(CN2CC[NH2+][C@H](C)CC2)cc1 ZINC001210475055 770291569 /nfs/dbraw/zinc/29/15/69/770291569.db2.gz KTLDBLJKLSBPFS-OAHLLOKOSA-N 2 0 275.440 2.717 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000692873817 776468358 /nfs/dbraw/zinc/46/83/58/776468358.db2.gz RRHMRHRXGQVUGK-HNNXBMFYSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC001234979855 778344974 /nfs/dbraw/zinc/34/49/74/778344974.db2.gz SMMQMXUJOLJOKN-HDICACEKSA-N 2 0 295.430 2.745 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(C[N@H+](C)CCC[NH3+])cc1 ZINC001235435269 778489147 /nfs/dbraw/zinc/48/91/47/778489147.db2.gz GEWRDHHCDQGYJO-UHFFFAOYSA-N 2 0 271.408 2.875 20 10 CFCDRP Oc1cc2c(cc1C[NH+]1CCCCCCC1)C[NH2+]CCO2 ZINC001235840989 778575782 /nfs/dbraw/zinc/57/57/82/778575782.db2.gz UAMQUIIXHPHGBZ-UHFFFAOYSA-N 2 0 290.407 2.640 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235960082 778628797 /nfs/dbraw/zinc/62/87/97/778628797.db2.gz OKZPAKVOSAYPAZ-FVCICTRLSA-N 2 0 288.435 2.859 20 10 CFCDRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001236065552 778678178 /nfs/dbraw/zinc/67/81/78/778678178.db2.gz BEGGXHJDNBMXRU-OAHLLOKOSA-N 2 0 297.446 2.947 20 10 CFCDRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC001236280174 778759164 /nfs/dbraw/zinc/75/91/64/778759164.db2.gz UPUHBICAEVAJIO-INIZCTEOSA-N 2 0 289.467 2.964 20 10 CFCDRP CC(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)c1 ZINC001236320869 778777714 /nfs/dbraw/zinc/77/77/14/778777714.db2.gz KZVACODMEFGYCP-IYBDPMFKSA-N 2 0 288.435 2.947 20 10 CFCDRP Cc1ccc(C[N@@H+](CC(C)C)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001236477638 778843895 /nfs/dbraw/zinc/84/38/95/778843895.db2.gz ILVSPJLRZUJUQT-MRXNPFEDSA-N 2 0 276.424 2.911 20 10 CFCDRP Nc1ccc(C[N@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236572673 778879534 /nfs/dbraw/zinc/87/95/34/778879534.db2.gz QIRGZVQGJPMXCJ-JCNLHEQBSA-N 2 0 273.424 2.893 20 10 CFCDRP CCc1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(O)c1 ZINC001236599244 778889785 /nfs/dbraw/zinc/88/97/85/778889785.db2.gz AQADMXLLXZAYBP-OAHLLOKOSA-N 2 0 288.435 2.919 20 10 CFCDRP Oc1ccc(Cl)cc1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237383092 779087739 /nfs/dbraw/zinc/08/77/39/779087739.db2.gz OCZFZUAQWWFZGR-SMDDNHRTSA-N 2 0 280.799 2.620 20 10 CFCDRP CN1CCCc2cc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)ccc21 ZINC001237391293 779092954 /nfs/dbraw/zinc/09/29/54/779092954.db2.gz KRVRMILKNVXTQS-MSOLQXFVSA-N 2 0 299.462 2.643 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001237483720 779117759 /nfs/dbraw/zinc/11/77/59/779117759.db2.gz RMMZUGAOBCFTCI-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC001205053937 780647897 /nfs/dbraw/zinc/64/78/97/780647897.db2.gz WCRLXDAFYZIQBH-UHFFFAOYSA-N 2 0 276.424 2.860 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000093638546 375277498 /nfs/dbraw/zinc/27/74/98/375277498.db2.gz SSMFKHVUPDFOQM-QAPCUYQASA-N 2 0 289.467 2.915 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(OC)c2O)C1 ZINC000093742314 375304734 /nfs/dbraw/zinc/30/47/34/375304734.db2.gz UHLDSXCRLMGUEP-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCC[NH+](C)C)cc1 ZINC000151918374 378372650 /nfs/dbraw/zinc/37/26/50/378372650.db2.gz FDMJLILIJDUHBB-AWEZNQCLSA-N 2 0 263.429 2.745 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000151932521 378374504 /nfs/dbraw/zinc/37/45/04/378374504.db2.gz UKHAIXDBEBJHNG-INIZCTEOSA-N 2 0 263.429 2.745 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccccc2O)C1 ZINC000183440785 381271082 /nfs/dbraw/zinc/27/10/82/381271082.db2.gz LOPBFDOOJCRCFI-UONOGXRCSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1O ZINC000183544888 381286372 /nfs/dbraw/zinc/28/63/72/381286372.db2.gz NACKIHOXALDXRF-MCIONIFRSA-N 2 0 262.397 2.916 20 10 CFCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(F)ccc1O ZINC000296310973 381342552 /nfs/dbraw/zinc/34/25/52/381342552.db2.gz GJXKDIDLDNYWGJ-NDNKKMJESA-N 2 0 278.371 2.807 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CC2=CC[N@H+](C)CC2)c1O ZINC000271905609 385397155 /nfs/dbraw/zinc/39/71/55/385397155.db2.gz RCZZYAFASYMZMF-UHFFFAOYSA-N 2 0 280.799 2.706 20 10 CFCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(Cl)ccc1O ZINC000273514754 385686685 /nfs/dbraw/zinc/68/66/85/385686685.db2.gz SHXIWEPFUUKDKI-NSHDSACASA-N 2 0 280.799 2.958 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC[N@@H+]1C ZINC000122917807 393972900 /nfs/dbraw/zinc/97/29/00/393972900.db2.gz AYXCWQUETSEMEI-YOEHRIQHSA-N 2 0 287.451 2.641 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185671317 286198332 /nfs/dbraw/zinc/19/83/32/286198332.db2.gz QMIMAGXBMQCRSX-GJZGRUSLSA-N 2 0 294.439 2.708 20 10 CFCDRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccccc1O ZINC000020128763 171016133 /nfs/dbraw/zinc/01/61/33/171016133.db2.gz GEWLFISCAIJKTM-AWEZNQCLSA-N 2 0 262.397 2.919 20 10 CFCDRP c1cc(C[NH2+]CCC[NH+]2CCCCC2)cc2c1OCC2 ZINC000037362805 260094610 /nfs/dbraw/zinc/09/46/10/260094610.db2.gz ZGAKKGNUCUSPDW-UHFFFAOYSA-N 2 0 274.408 2.587 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@@H]1CC[NH2+]C1 ZINC000423088568 330169172 /nfs/dbraw/zinc/16/91/72/330169172.db2.gz SGJYWOIHYAJWCB-ZIAGYGMSSA-N 2 0 271.408 2.574 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000227329915 522204637 /nfs/dbraw/zinc/20/46/37/522204637.db2.gz BQMRHDYZGMDTAW-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP CC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccccc1O ZINC000045663166 522825373 /nfs/dbraw/zinc/82/53/73/522825373.db2.gz IPLKNPFVBPMWTD-CQSZACIVSA-N 2 0 250.386 2.775 20 10 CFCDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc(F)ccc1O ZINC000226582853 524103387 /nfs/dbraw/zinc/10/33/87/524103387.db2.gz HGRNQMWFANMWPZ-CYBMUJFWSA-N 2 0 280.387 2.885 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094617922 524167629 /nfs/dbraw/zinc/16/76/29/524167629.db2.gz WAGUPFMIBCMRKV-GHMZBOCLSA-N 2 0 254.349 2.522 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1O ZINC000158036051 524408412 /nfs/dbraw/zinc/40/84/12/524408412.db2.gz DNGLCSNTEOFYGO-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cc(F)ccc1O ZINC000094618021 525333798 /nfs/dbraw/zinc/33/37/98/525333798.db2.gz MWAVXIYMRXZHKX-NSHDSACASA-N 2 0 254.349 2.524 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(F)ccc1O ZINC000094617921 525596232 /nfs/dbraw/zinc/59/62/32/525596232.db2.gz WAGUPFMIBCMRKV-WDEREUQCSA-N 2 0 254.349 2.522 20 10 CFCDRP COc1cccc(C[NH2+]CCCCC[NH+]2CCCC2)c1O ZINC000292923192 526013948 /nfs/dbraw/zinc/01/39/48/526013948.db2.gz GIGWMIVFXSPGQC-UHFFFAOYSA-N 2 0 292.423 2.757 20 10 CFCDRP c1cc(C[NH2+]CCCCC[NH+]2CCCC2)cc2c1OCC2 ZINC000292887904 526426359 /nfs/dbraw/zinc/42/63/59/526426359.db2.gz CQHUOOWKRKHJSV-UHFFFAOYSA-N 2 0 288.435 2.977 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CN(C)C[C@@H]2C)cc1F ZINC000756117215 574075818 /nfs/dbraw/zinc/07/58/18/574075818.db2.gz JMMABSBPZXWNTG-XJKSGUPXSA-N 2 0 293.430 2.712 20 10 CFCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2c(O)ccc3ccncc32)C1 ZINC000743398350 574362277 /nfs/dbraw/zinc/36/22/77/574362277.db2.gz DGFDWFOUUTXZKY-CQSZACIVSA-N 2 0 299.418 2.714 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC[NH+](C)CC1 ZINC000891436502 618200038 /nfs/dbraw/zinc/20/00/38/618200038.db2.gz OHMFIBCKCVQXJQ-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925796897 619119156 /nfs/dbraw/zinc/11/91/56/619119156.db2.gz MGQYOMFZLKQTHA-BYNQJWBRSA-N 2 0 292.398 2.915 20 10 CFCDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccccc1O ZINC000925847062 619179623 /nfs/dbraw/zinc/17/96/23/619179623.db2.gz RWYPIPQHITVBDM-DAXOMENPSA-N 2 0 260.381 2.575 20 10 CFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(C)cc(OC)c2O)C1 ZINC000894212254 619265757 /nfs/dbraw/zinc/26/57/57/619265757.db2.gz XWBDBALYLOALNX-AWEZNQCLSA-N 2 0 292.423 2.531 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000895555981 619554225 /nfs/dbraw/zinc/55/42/25/619554225.db2.gz DDJDTEHTWIQNNW-OAHLLOKOSA-N 2 0 297.402 2.806 20 10 CFCDRP Cc1ccc(C[N@@H+](C)CC(C)(C)C[NH+](C)C)c(O)c1 ZINC000898306890 620369789 /nfs/dbraw/zinc/36/97/89/620369789.db2.gz QCFYDTIDGAZVBA-UHFFFAOYSA-N 2 0 264.413 2.720 20 10 CFCDRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000902485239 621110738 /nfs/dbraw/zinc/11/07/38/621110738.db2.gz JUETYLVEIVVOTK-GAFUQQFSSA-N 2 0 268.788 2.824 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000903959952 621480696 /nfs/dbraw/zinc/48/06/96/621480696.db2.gz SRVNATYJZZTGQG-SFHVURJKSA-N 2 0 287.451 2.718 20 10 CFCDRP [NH3+]Cc1ccc(CN2CCCc3cc(C[NH3+])ccc32)cc1 ZINC000904301225 621568916 /nfs/dbraw/zinc/56/89/16/621568916.db2.gz JEIIZWPFPOOAGE-UHFFFAOYSA-N 2 0 281.403 2.557 20 10 CFCDRP CCCC[N@@H+](Cc1ccccc1O)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904341555 621578315 /nfs/dbraw/zinc/57/83/15/621578315.db2.gz PEIARRKNGHHLLX-OTVXOJSOSA-N 2 0 262.397 2.732 20 10 CFCDRP CCOc1ccc(C[NH2+][C@@H]2Cc3ccccc3[C@H]2N)c(O)c1 ZINC000904462311 621597164 /nfs/dbraw/zinc/59/71/64/621597164.db2.gz UQBRFUAAGXDOCD-SJLPKXTDSA-N 2 0 298.386 2.505 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1 ZINC000071409534 625515366 /nfs/dbraw/zinc/51/53/66/625515366.db2.gz DXHXXKCZQRCVEH-INIZCTEOSA-N 2 0 274.408 2.665 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000044516074 622918315 /nfs/dbraw/zinc/91/83/15/622918315.db2.gz PINRLDGRXPGFOD-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1O ZINC000044515486 622918332 /nfs/dbraw/zinc/91/83/32/622918332.db2.gz PVVQHXJUNIDXIR-OAHLLOKOSA-N 2 0 262.397 2.775 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC[NH2+]C1 ZINC000226437308 623075061 /nfs/dbraw/zinc/07/50/61/623075061.db2.gz SWIGALFZQSOAMV-CQSZACIVSA-N 2 0 262.397 2.604 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c1O ZINC000229103800 623183259 /nfs/dbraw/zinc/18/32/59/623183259.db2.gz XLIZZQFCPXFWOK-LLVKDONJSA-N 2 0 298.814 2.615 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CCCN1C)c1ccc(N(C)C)cc1 ZINC000154578579 624396441 /nfs/dbraw/zinc/39/64/41/624396441.db2.gz NFZWZTVKJYAHDU-IAGOWNOFSA-N 2 0 275.440 2.888 20 10 CFCDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070169791 625278672 /nfs/dbraw/zinc/27/86/72/625278672.db2.gz MGQYVAGNFUYJMT-LLVKDONJSA-N 2 0 268.788 2.606 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c1O ZINC000817958934 625964249 /nfs/dbraw/zinc/96/42/49/625964249.db2.gz MZZPPRMWKKPEJQ-ZWNOBZJWSA-N 2 0 270.804 2.988 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c(O)c1 ZINC000817959131 625964854 /nfs/dbraw/zinc/96/48/54/625964854.db2.gz PLIMIACKFIYONX-STQMWFEESA-N 2 0 250.386 2.643 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c(O)c1C ZINC000817977409 625973285 /nfs/dbraw/zinc/97/32/85/625973285.db2.gz JQLYPYWQWNUFPJ-WCQYABFASA-N 2 0 250.386 2.787 20 10 CFCDRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)ccc1N(C)C ZINC000923368985 626468721 /nfs/dbraw/zinc/46/87/21/626468721.db2.gz IHDQAVMTBZKUTB-MRXNPFEDSA-N 2 0 275.440 2.539 20 10 CFCDRP CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N)cc1 ZINC000923400233 626470819 /nfs/dbraw/zinc/47/08/19/626470819.db2.gz LAHDXCHQYROJRL-LQDVMPOASA-N 2 0 259.397 2.626 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1F ZINC000839183147 626529842 /nfs/dbraw/zinc/52/98/42/626529842.db2.gz URTCNFANNYXUMH-CQSZACIVSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)cc1C ZINC000843052751 626548316 /nfs/dbraw/zinc/54/83/16/626548316.db2.gz WANFKSAXZIHCAV-ZIAGYGMSSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000766030602 627172721 /nfs/dbraw/zinc/17/27/21/627172721.db2.gz UPSCXPISSSSZSQ-GOEBONIOSA-N 2 0 275.440 2.633 20 10 CFCDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768446733 627344138 /nfs/dbraw/zinc/34/41/38/627344138.db2.gz ODJUOBXUCFAXMC-AWEZNQCLSA-N 2 0 288.435 2.655 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000771834878 627635801 /nfs/dbraw/zinc/63/58/01/627635801.db2.gz FRGSOLZBAHTEFH-HNNXBMFYSA-N 2 0 289.467 2.963 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)c1 ZINC000775368766 628016828 /nfs/dbraw/zinc/01/68/28/628016828.db2.gz FBSYIOGEEWDBPA-UONOGXRCSA-N 2 0 292.423 2.926 20 10 CFCDRP CCCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775639339 628048633 /nfs/dbraw/zinc/04/86/33/628048633.db2.gz ULABQWMSTDYAQY-UHFFFAOYSA-N 2 0 275.440 2.670 20 10 CFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000775644285 628049492 /nfs/dbraw/zinc/04/94/92/628049492.db2.gz DSBQTALLZBNYKL-UHFFFAOYSA-N 2 0 287.451 2.813 20 10 CFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000775648401 628049599 /nfs/dbraw/zinc/04/95/99/628049599.db2.gz TTXYRCXAJCYHGU-UHFFFAOYSA-N 2 0 275.440 2.669 20 10 CFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000775736227 628060891 /nfs/dbraw/zinc/06/08/91/628060891.db2.gz AFZMBUUUNPUJMA-HOTGVXAUSA-N 2 0 287.451 2.669 20 10 CFCDRP COc1ccc(C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1C ZINC000841032749 631314017 /nfs/dbraw/zinc/31/40/17/631314017.db2.gz WNCNSWMOJIJVAA-UHFFFAOYSA-N 2 0 284.403 2.795 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]CC2([NH3+])CCCCC2)c1 ZINC000841039171 631316640 /nfs/dbraw/zinc/31/66/40/631316640.db2.gz DPXNYCNNASGQEB-UHFFFAOYSA-N 2 0 278.396 2.542 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000841057912 631325777 /nfs/dbraw/zinc/32/57/77/631325777.db2.gz SBQSLWUGFZFSDG-QGZVFWFLSA-N 2 0 275.440 2.540 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1O ZINC000841062249 631327777 /nfs/dbraw/zinc/32/77/77/631327777.db2.gz UQJODMPGLOYHJV-MFKMUULPSA-N 2 0 268.788 2.584 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000841080162 631332714 /nfs/dbraw/zinc/33/27/14/631332714.db2.gz OJNDNQAZYLGEMP-AWEZNQCLSA-N 2 0 263.429 2.750 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000841079270 631332850 /nfs/dbraw/zinc/33/28/50/631332850.db2.gz KQQZIMNVBGJTFF-GOSISDBHSA-N 2 0 299.462 2.909 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)CCCC[NH3+])cc1C ZINC000841079365 631333454 /nfs/dbraw/zinc/33/34/54/631333454.db2.gz KUFHBVFMBYZWPU-CYBMUJFWSA-N 2 0 250.386 2.616 20 10 CFCDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000841083579 631334489 /nfs/dbraw/zinc/33/44/89/631334489.db2.gz QEDLDNSSAWXOGQ-SJORKVTESA-N 2 0 287.451 2.894 20 10 CFCDRP Oc1cccc(Cl)c1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000841090106 631337509 /nfs/dbraw/zinc/33/75/09/631337509.db2.gz VYTMNYBICALURN-LLVKDONJSA-N 2 0 280.799 2.810 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c(Cl)c1 ZINC000841099666 631340023 /nfs/dbraw/zinc/34/00/23/631340023.db2.gz NCZMUEWWVZQDGE-NEPJUHHUSA-N 2 0 282.815 2.771 20 10 CFCDRP C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000842211892 631566777 /nfs/dbraw/zinc/56/67/77/631566777.db2.gz ZOPYMTHANWGWNJ-LFAOLKIESA-N 2 0 275.440 2.553 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000843044118 631811855 /nfs/dbraw/zinc/81/18/55/631811855.db2.gz TYNHIVCMAWOZLY-UHFFFAOYSA-N 2 0 280.799 2.762 20 10 CFCDRP C[C@H]([NH3+])C1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000843048826 631815345 /nfs/dbraw/zinc/81/53/45/631815345.db2.gz ZNMDMWNQOWOYTL-RGDDUWESSA-N 2 0 287.451 2.825 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000843052868 631815813 /nfs/dbraw/zinc/81/58/13/631815813.db2.gz WVPSDHHCFJVEIC-ZBFHGGJFSA-N 2 0 275.440 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000843057000 631820842 /nfs/dbraw/zinc/82/08/42/631820842.db2.gz FBIANZYVTWPAPP-HOCLYGCPSA-N 2 0 275.440 2.702 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1O ZINC000843057795 631820872 /nfs/dbraw/zinc/82/08/72/631820872.db2.gz LCHCZVMGLASKRH-QWRGUYRKSA-N 2 0 268.788 2.523 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000843059410 631821547 /nfs/dbraw/zinc/82/15/47/631821547.db2.gz LGVFLEBTCKDJTN-RYQLBKOJSA-N 2 0 287.451 2.702 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000843060230 631823790 /nfs/dbraw/zinc/82/37/90/631823790.db2.gz YLITUSGMFGAFPG-PMSLMXJFSA-N 2 0 299.462 2.825 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1 ZINC000843113638 631838199 /nfs/dbraw/zinc/83/81/99/631838199.db2.gz ZUJMDUYJXRFWBI-RCFWFJCLSA-N 2 0 287.451 2.827 20 10 CFCDRP COc1ccc(O)c(C[N@H+](CCC[NH3+])CC2CCCC2)c1 ZINC000843123921 631842609 /nfs/dbraw/zinc/84/26/09/631842609.db2.gz RRZSYYHVLDEQQI-UHFFFAOYSA-N 2 0 292.423 2.742 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2CC[NH3+])cc1C ZINC000843123665 631843516 /nfs/dbraw/zinc/84/35/16/631843516.db2.gz MUQQLLITSGTVCK-HNNXBMFYSA-N 2 0 262.397 2.712 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2CC[NH3+])cc1 ZINC000843123918 631843962 /nfs/dbraw/zinc/84/39/62/631843962.db2.gz RRGKJDYWKMAZHQ-OOFWQKGWSA-N 2 0 287.451 2.969 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1C ZINC000843126318 631845376 /nfs/dbraw/zinc/84/53/76/631845376.db2.gz JBKZFQKFBJOYFK-INIZCTEOSA-N 2 0 288.435 2.831 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843126762 631846955 /nfs/dbraw/zinc/84/69/55/631846955.db2.gz MRAQHEGMOJGERP-HZPDHXFCSA-N 2 0 288.435 2.912 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(F)ccc1O ZINC000843344260 631933746 /nfs/dbraw/zinc/93/37/46/631933746.db2.gz SFKJKXHNTXQVCC-NSHDSACASA-N 2 0 274.339 2.841 20 10 CFCDRP CCC[N@H+](CCC1CC[NH2+]CC1)Cc1ccccc1O ZINC000843358258 631936472 /nfs/dbraw/zinc/93/64/72/631936472.db2.gz JERCUNNDSLBLAH-UHFFFAOYSA-N 2 0 276.424 2.994 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)cc1 ZINC000813877076 631971649 /nfs/dbraw/zinc/97/16/49/631971649.db2.gz JYVUTBUPYSTYBP-HUUCEWRRSA-N 2 0 277.456 2.991 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1 ZINC000815628125 632301546 /nfs/dbraw/zinc/30/15/46/632301546.db2.gz RSLLMVDAKIVUAG-TZMCWYRMSA-N 2 0 264.413 2.857 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c(O)c1 ZINC000844903062 632331717 /nfs/dbraw/zinc/33/17/17/632331717.db2.gz ZJTIJMBESWIBFG-CZUORRHYSA-N 2 0 292.423 2.740 20 10 CFCDRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c(F)c1 ZINC000844924188 632338442 /nfs/dbraw/zinc/33/84/42/632338442.db2.gz NLYANBPDSIXJFG-OAHLLOKOSA-N 2 0 286.350 2.767 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@H](C)C2)c1O ZINC000846148274 632647363 /nfs/dbraw/zinc/64/73/63/632647363.db2.gz POEUTBWVQKHUOX-FRRDWIJNSA-N 2 0 278.396 2.534 20 10 CFCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C[NH3+] ZINC000817865072 632714545 /nfs/dbraw/zinc/71/45/45/632714545.db2.gz GDBXZSGDYUKIRL-IPYPFGDCSA-N 2 0 293.430 2.697 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817940124 632743770 /nfs/dbraw/zinc/74/37/70/632743770.db2.gz FKEZBASTUGNHKZ-GXFFZTMASA-N 2 0 278.371 2.669 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH2+]C)c1cc(Cl)ccc1O ZINC000817939592 632743833 /nfs/dbraw/zinc/74/38/33/632743833.db2.gz FLROAXKRYDOHCG-LBPRGKRZSA-N 2 0 256.777 2.696 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817942750 632746775 /nfs/dbraw/zinc/74/67/75/632746775.db2.gz DFXHXWQYHPVPQF-PWSUYJOCSA-N 2 0 266.360 2.669 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817945566 632747557 /nfs/dbraw/zinc/74/75/57/632747557.db2.gz GILADDOINPJGNX-WDEREUQCSA-N 2 0 268.788 2.696 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817946821 632748036 /nfs/dbraw/zinc/74/80/36/632748036.db2.gz FNHNFXGVZIHLFE-SDDRHHMPSA-N 2 0 266.360 2.570 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)c(O)c1C ZINC000817948277 632749188 /nfs/dbraw/zinc/74/91/88/632749188.db2.gz WKXGLEICSPXRAA-IYXRBSQSSA-N 2 0 262.397 2.930 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC[NH2+]C(C)C)c1 ZINC000817952526 632752420 /nfs/dbraw/zinc/75/24/20/632752420.db2.gz FSBQXOFTAUABRA-ZDUSSCGKSA-N 2 0 250.386 2.739 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000817955510 632754975 /nfs/dbraw/zinc/75/49/75/632754975.db2.gz XRGSMTNUEWCOJK-LSDHHAIUSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817962385 632762241 /nfs/dbraw/zinc/76/22/41/632762241.db2.gz KXIUMXFZAFVEKV-GJZGRUSLSA-N 2 0 275.440 2.922 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]([NH3+])C2CC2)c1O ZINC000817966031 632763811 /nfs/dbraw/zinc/76/38/11/632763811.db2.gz ZLRLTYLTLGTFKU-RNCFNFMXSA-N 2 0 268.788 2.742 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc(Br)ccc1O ZINC000817965117 632763832 /nfs/dbraw/zinc/76/38/32/632763832.db2.gz LYFYGKPJOPEVMG-PELKAZGASA-N 2 0 299.212 2.543 20 10 CFCDRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817966060 632763870 /nfs/dbraw/zinc/76/38/70/632763870.db2.gz ZYTJSRYYDDVVOM-CQSZACIVSA-N 2 0 273.424 2.547 20 10 CFCDRP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc(Br)ccc1O ZINC000817965121 632763967 /nfs/dbraw/zinc/76/39/67/632763967.db2.gz LYFYGKPJOPEVMG-UFBFGSQYSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c(O)c1 ZINC000817966853 632766151 /nfs/dbraw/zinc/76/61/51/632766151.db2.gz XAQKDFLXECYISC-CZUORRHYSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817967851 632766703 /nfs/dbraw/zinc/76/67/03/632766703.db2.gz MMGPNKXZZOHZAO-QGZVFWFLSA-N 2 0 273.424 2.713 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817968877 632767668 /nfs/dbraw/zinc/76/76/68/632767668.db2.gz OMQOVXDTMZQKJG-HIFRSBDPSA-N 2 0 261.413 2.545 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(C)cc1O ZINC000817970782 632769573 /nfs/dbraw/zinc/76/95/73/632769573.db2.gz FCZUWSMHPMPJFU-GUTXKFCHSA-N 2 0 262.397 2.882 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)c2c1c(F)ccc2O ZINC000817970453 632769591 /nfs/dbraw/zinc/76/95/91/632769591.db2.gz VZMJJIJNLUPTGH-BLFANLJRSA-N 2 0 278.371 2.939 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c2c1c(F)ccc2O ZINC000817970831 632769618 /nfs/dbraw/zinc/76/96/18/632769618.db2.gz FTZLZTZYPWMHGD-DNIRFERGSA-N 2 0 278.371 2.667 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c(O)c1C ZINC000817971627 632771448 /nfs/dbraw/zinc/77/14/48/632771448.db2.gz OMCMBZYEFYNWAX-OSAQELSMSA-N 2 0 262.397 2.658 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)c2c1c(F)ccc2O ZINC000817972653 632771683 /nfs/dbraw/zinc/77/16/83/632771683.db2.gz ZGPUXVHWJDTIFZ-UZWSLXQKSA-N 2 0 278.371 2.810 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000817976228 632774053 /nfs/dbraw/zinc/77/40/53/632774053.db2.gz ILHDKGFVNMFOBI-MNOVXSKESA-N 2 0 254.349 2.699 20 10 CFCDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817977362 632775044 /nfs/dbraw/zinc/77/50/44/632775044.db2.gz ITXXJDBFRRQZFQ-SRVKXCTJSA-N 2 0 262.397 2.657 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000817977603 632775119 /nfs/dbraw/zinc/77/51/19/632775119.db2.gz LHWVTDVFXVPUCQ-HOSYDEDBSA-N 2 0 266.360 2.797 20 10 CFCDRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817977365 632775229 /nfs/dbraw/zinc/77/52/29/632775229.db2.gz ITXXJDBFRRQZFQ-WOPDTQHZSA-N 2 0 262.397 2.657 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000817978213 632776249 /nfs/dbraw/zinc/77/62/49/632776249.db2.gz YMUHJBLZEKHTHZ-NXEZZACHSA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000817982223 632778608 /nfs/dbraw/zinc/77/86/08/632778608.db2.gz PQDFLXIIGUYQQC-HOSYDEDBSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817982310 632778898 /nfs/dbraw/zinc/77/88/98/632778898.db2.gz RMKGEQGCBBBGKS-YDHLFZDLSA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000817986590 632781691 /nfs/dbraw/zinc/78/16/91/632781691.db2.gz RXKNNHPLOZAVGF-ZDUSSCGKSA-N 2 0 260.381 2.661 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1O ZINC000817985617 632781966 /nfs/dbraw/zinc/78/19/66/632781966.db2.gz MHKREQMJOSXXJF-OLZOCXBDSA-N 2 0 260.381 2.718 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(F)cc1[O-] ZINC000848557450 633288509 /nfs/dbraw/zinc/28/85/09/633288509.db2.gz IDLZNGMLHUFELP-OSAQELSMSA-N 2 0 280.387 2.912 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c1O ZINC000848910820 633394866 /nfs/dbraw/zinc/39/48/66/633394866.db2.gz ACGBRZBTBDWUPM-NVXWUHKLSA-N 2 0 288.435 2.871 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1O ZINC000848923324 633406182 /nfs/dbraw/zinc/40/61/82/633406182.db2.gz JDRPPDMLWZXGCM-VDISTLRHSA-N 2 0 282.815 2.784 20 10 CFCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000850382355 633969175 /nfs/dbraw/zinc/96/91/75/633969175.db2.gz STGOWAZCWJXFOX-SFHVURJKSA-N 2 0 287.451 2.717 20 10 CFCDRP CCN(CC)c1ccc(CNCC23CC(C2)C[NH2+]3)cc1F ZINC000853246983 634950124 /nfs/dbraw/zinc/95/01/24/634950124.db2.gz YEEZVHVEHWTOCS-UHFFFAOYSA-N 2 0 291.414 2.514 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c(O)c1 ZINC000854230568 635266443 /nfs/dbraw/zinc/26/64/43/635266443.db2.gz URVLLXWUIQOIMI-GXTWGEPZSA-N 2 0 250.386 2.725 20 10 CFCDRP C[C@H]([NH2+]CCOCCC[NH3+])c1ccc2ccccc2c1O ZINC000863544880 637692006 /nfs/dbraw/zinc/69/20/06/637692006.db2.gz DLURBTFMUYXEPV-ZDUSSCGKSA-N 2 0 288.391 2.561 20 10 CFCDRP C[C@H]([NH2+]Cc1cc(Cl)ccc1O)C1CC[NH2+]CC1 ZINC000873222496 642075909 /nfs/dbraw/zinc/07/59/09/642075909.db2.gz WNEBAGFCAUWDTP-JTQLQIEISA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000873252656 642098868 /nfs/dbraw/zinc/09/88/68/642098868.db2.gz USUNGDOUESJJOV-KKZNHRDASA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c(O)c1 ZINC000877074033 643136185 /nfs/dbraw/zinc/13/61/85/643136185.db2.gz YBBKBJFKVNAYMC-LSDHHAIUSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c(O)c1 ZINC000877074030 643136316 /nfs/dbraw/zinc/13/63/16/643136316.db2.gz YBBKBJFKVNAYMC-CABCVRRESA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)c(O)c1 ZINC000877479575 643296735 /nfs/dbraw/zinc/29/67/35/643296735.db2.gz WGUZSILIPLPQBW-HNNXBMFYSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1ccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c(O)c1 ZINC000877533181 643336111 /nfs/dbraw/zinc/33/61/11/643336111.db2.gz ZZCFBEYLABGWIT-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c(O)c1 ZINC000877533186 643336368 /nfs/dbraw/zinc/33/63/68/643336368.db2.gz ZZCFBEYLABGWIT-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c1O ZINC000252855364 651027649 /nfs/dbraw/zinc/02/76/49/651027649.db2.gz LIMHSQYLKMTMOT-QWRGUYRKSA-N 2 0 298.814 2.613 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCCSc2nccs2)CC[N@@H+]1C ZINC000132158156 645884928 /nfs/dbraw/zinc/88/49/28/645884928.db2.gz IAMYZGZJMCFDPA-RYUDHWBXSA-N 2 0 285.482 2.698 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000133377173 646079324 /nfs/dbraw/zinc/07/93/24/646079324.db2.gz GNCSUOUPOMHSRM-MRXNPFEDSA-N 2 0 263.429 2.558 20 10 CFCDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000925559440 648216586 /nfs/dbraw/zinc/21/65/86/648216586.db2.gz UIQZQJNDXOZTPZ-GJZGRUSLSA-N 2 0 274.408 2.617 20 10 CFCDRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Cl)ccc1O ZINC000925737127 648304321 /nfs/dbraw/zinc/30/43/21/648304321.db2.gz FYPKIBOFBVAHEO-VIFPVBQESA-N 2 0 256.777 2.824 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(C)cc1O ZINC000925776528 648318980 /nfs/dbraw/zinc/31/89/80/648318980.db2.gz LARQDQFSVDRNII-TZMCWYRMSA-N 2 0 298.377 2.986 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925802147 648328436 /nfs/dbraw/zinc/32/84/36/648328436.db2.gz FHLOLNRKMQNQAW-QLFBSQMISA-N 2 0 276.424 2.905 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@]13CCC[C@H]1[NH2+]CC3)CC2 ZINC000925840457 648341205 /nfs/dbraw/zinc/34/12/05/648341205.db2.gz LVOXNUAILYKAGQ-YSVLISHTSA-N 2 0 272.392 2.501 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]C[C@]13CCC[C@H]1[NH2+]CC3)CC2 ZINC000925840455 648341362 /nfs/dbraw/zinc/34/13/62/648341362.db2.gz LVOXNUAILYKAGQ-FRFSOERESA-N 2 0 272.392 2.501 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CC2 ZINC000313193781 776235946 /nfs/dbraw/zinc/23/59/46/776235946.db2.gz MRUKYGANZKTCEU-QLFBSQMISA-N 2 0 272.392 2.596 20 10 CFCDRP CCN(CC)c1ccc(CN2CCC[C@@](C)([NH3+])C2)cc1 ZINC001204938099 776974153 /nfs/dbraw/zinc/97/41/53/776974153.db2.gz IMAQUVRELNLZEU-QGZVFWFLSA-N 2 0 275.440 2.846 20 10 CFCDRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC001231881887 777365046 /nfs/dbraw/zinc/36/50/46/777365046.db2.gz CACVONVUYCMMNX-VQIMIIECSA-N 2 0 296.414 2.929 20 10 CFCDRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1ccccc1O ZINC001232015693 777414624 /nfs/dbraw/zinc/41/46/24/777414624.db2.gz LCPIKIVPMQYRBB-UHFFFAOYSA-N 2 0 267.332 2.901 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC3(C[NH2+]C3)C2)c2ccccc21 ZINC001235024056 778357223 /nfs/dbraw/zinc/35/72/23/778357223.db2.gz KHQCZNYEPVURGR-UHFFFAOYSA-N 2 0 295.430 2.701 20 10 CFCDRP Cc1cc(C)c(C[NH2+]C2CCC([NH+](C)C)CC2)c(O)c1 ZINC001168305153 778419586 /nfs/dbraw/zinc/41/95/86/778419586.db2.gz JOLQNRQSSAVWEW-UHFFFAOYSA-N 2 0 276.424 2.971 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001235224755 778420455 /nfs/dbraw/zinc/42/04/55/778420455.db2.gz OEOKACXUOQFJAY-ZWKOTPCHSA-N 2 0 299.462 2.718 20 10 CFCDRP CCN(CC)c1ccc(CN2C[C@H]3CCC[C@@]3([NH3+])C2)cc1 ZINC001235238890 778427155 /nfs/dbraw/zinc/42/71/55/778427155.db2.gz CLJGTFVSOBOBBU-SJLPKXTDSA-N 2 0 287.451 2.846 20 10 CFCDRP C[C@H]1CC[C@H]([NH3+])CN1Cc1ccc(N2CCCCC2)cc1 ZINC001235893116 778593647 /nfs/dbraw/zinc/59/36/47/778593647.db2.gz VCSCEJBRXWOYLT-RDJZCZTQSA-N 2 0 287.451 2.989 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+](CC(C)C)[C@@H]2CCC[NH2+]C2)c1 ZINC001236477504 778843928 /nfs/dbraw/zinc/84/39/28/778843928.db2.gz GDFXUXGYMPZFHG-MRXNPFEDSA-N 2 0 276.424 2.911 20 10 CFCDRP CCOc1ccc(C[N@H+](CC)CCn2ccnc2)c(O)c1 ZINC001237045261 778997857 /nfs/dbraw/zinc/99/78/57/778997857.db2.gz GEGOSPJQKMZNNR-UHFFFAOYSA-N 2 0 289.379 2.510 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237385026 779088685 /nfs/dbraw/zinc/08/86/85/779088685.db2.gz ZGPNUFDWJNAAHM-MJGOQNOKSA-N 2 0 299.462 2.861 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000278129490 283308603 /nfs/dbraw/zinc/30/86/03/283308603.db2.gz BWNDKGCUXWMNOQ-ZWKOTPCHSA-N 2 0 287.451 2.989 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)ccc2O)[C@H](C)C1 ZINC000093639520 375278043 /nfs/dbraw/zinc/27/80/43/375278043.db2.gz ATWSRSQQUSQXQL-ZBFHGGJFSA-N 2 0 276.424 2.863 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000574629999 335034809 /nfs/dbraw/zinc/03/48/09/335034809.db2.gz NAEQMCCQGQFXGJ-HUUCEWRRSA-N 2 0 285.435 2.964 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)ccc21 ZINC000378896140 781971031 /nfs/dbraw/zinc/97/10/31/781971031.db2.gz UWDODAWJYKNAFC-MSOLQXFVSA-N 2 0 299.462 2.785 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000185650815 381693840 /nfs/dbraw/zinc/69/38/40/381693840.db2.gz BFFZSTGRCCMCMX-MJBXVCDLSA-N 2 0 292.423 2.924 20 10 CFCDRP C[NH+](C)C[C@@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295230723 382594483 /nfs/dbraw/zinc/59/44/83/382594483.db2.gz CUXSZCSLAAOZBL-JTQLQIEISA-N 2 0 286.778 2.568 20 10 CFCDRP CC[N@H+](CCC[NH+](C)C)Cc1ccc(N(C)C)cc1 ZINC000265291163 383887516 /nfs/dbraw/zinc/88/75/16/383887516.db2.gz ZIPJNJDXBPYPHB-UHFFFAOYSA-N 2 0 263.429 2.526 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2CCN(C)CC2)cc1F ZINC000266113996 384082119 /nfs/dbraw/zinc/08/21/19/384082119.db2.gz NNJZLRJNWXXGSE-UHFFFAOYSA-N 2 0 293.430 2.856 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c(O)c1C ZINC000273562986 385688082 /nfs/dbraw/zinc/68/80/82/385688082.db2.gz IRANUBBEIBKAAB-GXTWGEPZSA-N 2 0 264.413 3.000 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC[N@@H+]1C ZINC000122917231 393973148 /nfs/dbraw/zinc/97/31/48/393973148.db2.gz AYXCWQUETSEMEI-RHSMWYFYSA-N 2 0 287.451 2.641 20 10 CFCDRP [O-]c1c(Cl)cccc1C[NH2+]Cc1cnc2n1CCCC2 ZINC000368487892 267177892 /nfs/dbraw/zinc/17/78/92/267177892.db2.gz MBADGLZGEZPIMU-UHFFFAOYSA-N 2 0 291.782 2.868 20 10 CFCDRP CCOc1cccc(C[NH2+]CCC[NH+](CC)CC)c1O ZINC000019942950 276380475 /nfs/dbraw/zinc/38/04/75/276380475.db2.gz WTAHEOLAQZFBFL-UHFFFAOYSA-N 2 0 280.412 2.612 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185671340 276484973 /nfs/dbraw/zinc/48/49/73/276484973.db2.gz QMIMAGXBMQCRSX-LSDHHAIUSA-N 2 0 294.439 2.708 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1 ZINC000277595494 521143893 /nfs/dbraw/zinc/14/38/93/521143893.db2.gz VHKIFCWVIKNOOA-HNNXBMFYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000277521498 521338565 /nfs/dbraw/zinc/33/85/65/521338565.db2.gz PIAIJZPLYGGVPV-OAHLLOKOSA-N 2 0 292.423 2.707 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000094617601 521717815 /nfs/dbraw/zinc/71/78/15/521717815.db2.gz YKSOLVQLMLLCKU-NWDGAFQWSA-N 2 0 266.360 2.524 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000088163894 524749324 /nfs/dbraw/zinc/74/93/24/524749324.db2.gz SGBFSAZTGUVPBJ-GOOCMWNKSA-N 2 0 290.407 2.506 20 10 CFCDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000168758853 525329334 /nfs/dbraw/zinc/32/93/34/525329334.db2.gz BIUHLVOJGIPWNN-LBPRGKRZSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000156092633 525345666 /nfs/dbraw/zinc/34/56/66/525345666.db2.gz UFSRLXYMYSFJBE-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c1 ZINC000049553875 525365817 /nfs/dbraw/zinc/36/58/17/525365817.db2.gz GKQBPAZUCDEVNY-STQMWFEESA-N 2 0 250.386 2.691 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(F)ccc1O ZINC000094617610 525483681 /nfs/dbraw/zinc/48/36/81/525483681.db2.gz ABRPQGHDDUTMEP-NEPJUHHUSA-N 2 0 278.371 2.666 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCC[NH+](C)C)c2c1c(F)ccc2O ZINC000756342544 574227028 /nfs/dbraw/zinc/22/70/28/574227028.db2.gz KOXPZVASGJFXGB-JQWIXIFHSA-N 2 0 266.360 2.621 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000725849442 574330186 /nfs/dbraw/zinc/33/01/86/574330186.db2.gz NMEKFXLOMUREJD-CQSZACIVSA-N 2 0 292.423 2.611 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1C ZINC000090721600 618171914 /nfs/dbraw/zinc/17/19/14/618171914.db2.gz XPWOTPJIPXZJTA-HIFRSBDPSA-N 2 0 262.397 2.576 20 10 CFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1 ZINC000066057121 618439753 /nfs/dbraw/zinc/43/97/53/618439753.db2.gz SYSANUKHJLNVQP-UHFFFAOYSA-N 2 0 275.440 2.704 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1c(O)cccc1Cl ZINC000853247055 618806477 /nfs/dbraw/zinc/80/64/77/618806477.db2.gz ATRRKNCKQYWDAC-GFCCVEGCSA-N 2 0 256.777 2.509 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1 ZINC000925691923 618936773 /nfs/dbraw/zinc/93/67/73/618936773.db2.gz KVOODOUIPLHFQC-QZTJIDSGSA-N 2 0 287.451 2.569 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000840933143 619075457 /nfs/dbraw/zinc/07/54/57/619075457.db2.gz XXTKHHHBHCUSBE-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1C ZINC000841028533 620255992 /nfs/dbraw/zinc/25/59/92/620255992.db2.gz AVZCNGXBZVIKBT-LSDHHAIUSA-N 2 0 262.397 2.611 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000156560986 620522133 /nfs/dbraw/zinc/52/21/33/620522133.db2.gz CAWVCLUPJYUNII-OFQRWUPVSA-N 2 0 275.440 2.886 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(Br)ccc1O ZINC000902485127 621110894 /nfs/dbraw/zinc/11/08/94/621110894.db2.gz HYJCPZHXBYFOEW-QXEWZRGKSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)cc1C ZINC000903959349 621479981 /nfs/dbraw/zinc/47/99/81/621479981.db2.gz GIRYQXNRKYWQBI-SFHVURJKSA-N 2 0 288.435 2.975 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)c(Cl)c1 ZINC000904412030 621593380 /nfs/dbraw/zinc/59/33/80/621593380.db2.gz ZTWHAHXQPCFMLS-VXGBXAGGSA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000071409440 625515287 /nfs/dbraw/zinc/51/52/87/625515287.db2.gz MIIKDVOIOSDGDZ-ZBFHGGJFSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921492025 624899831 /nfs/dbraw/zinc/89/98/31/624899831.db2.gz BJXMBAYVXXPYAD-UHFFFAOYSA-N 2 0 274.408 2.586 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000921546490 625981811 /nfs/dbraw/zinc/98/18/11/625981811.db2.gz DYYJPFDZKBVRGU-DLBZAZTESA-N 2 0 286.419 2.728 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921687143 626081357 /nfs/dbraw/zinc/08/13/57/626081357.db2.gz XVJATYAVUZPJCX-UHFFFAOYSA-N 2 0 288.435 2.833 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C)CC1 ZINC000771819448 627633852 /nfs/dbraw/zinc/63/38/52/627633852.db2.gz PKYHRDWZZDXXLO-OAHLLOKOSA-N 2 0 287.451 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C4CC4)C3)cc2)CC1 ZINC000775725688 628059559 /nfs/dbraw/zinc/05/95/59/628059559.db2.gz LMYGZWQVMDUDDX-GOSISDBHSA-N 2 0 299.462 2.670 20 10 CFCDRP CC[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775737201 628060948 /nfs/dbraw/zinc/06/09/48/628060948.db2.gz KCLXQJQDFCMRRP-INIZCTEOSA-N 2 0 287.451 2.670 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000835039678 629333379 /nfs/dbraw/zinc/33/33/79/629333379.db2.gz KBKSUEGQCJUQCX-UKINESCASA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000835053591 629354036 /nfs/dbraw/zinc/35/40/36/629354036.db2.gz DTLUOAPHBIWRHX-VXVWRJFESA-N 2 0 299.462 2.981 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840935882 631268484 /nfs/dbraw/zinc/26/84/84/631268484.db2.gz DIXXNUYVVOKXKE-UHFFFAOYSA-N 2 0 277.456 2.883 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000841007979 631303901 /nfs/dbraw/zinc/30/39/01/631303901.db2.gz VZYGNYILEDGKPF-GJZGRUSLSA-N 2 0 276.424 2.992 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841033486 631313704 /nfs/dbraw/zinc/31/37/04/631313704.db2.gz OYFGAEOYLNOKAG-UHFFFAOYSA-N 2 0 297.446 2.852 20 10 CFCDRP CC1(C[NH2+]Cc2c(O)cccc2Cl)CC[NH2+]CC1 ZINC000841056032 631324835 /nfs/dbraw/zinc/32/48/35/631324835.db2.gz ANKFJURSGLGFQA-UHFFFAOYSA-N 2 0 268.788 2.525 20 10 CFCDRP C[C@@H]1CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@@H]1C[NH3+] ZINC000841099796 631340161 /nfs/dbraw/zinc/34/01/61/631340161.db2.gz PCRHSDIYKVHZNE-BUZJKLBMSA-N 2 0 287.451 2.683 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCCCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000843045058 631812043 /nfs/dbraw/zinc/81/20/43/631812043.db2.gz HFVUKXHGESDZJO-UHCGQYCJSA-N 2 0 287.451 2.968 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c(Cl)c1 ZINC000843051749 631817000 /nfs/dbraw/zinc/81/70/00/631817000.db2.gz KYXWOAGJQFFOIB-RYUDHWBXSA-N 2 0 282.815 2.913 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000843057149 631820454 /nfs/dbraw/zinc/82/04/54/631820454.db2.gz DSNODNMDJNLCKW-UHFFFAOYSA-N 2 0 276.424 2.831 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000843059409 631821643 /nfs/dbraw/zinc/82/16/43/631821643.db2.gz LGVFLEBTCKDJTN-JQHSSLGASA-N 2 0 287.451 2.702 20 10 CFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000843105200 631836301 /nfs/dbraw/zinc/83/63/01/631836301.db2.gz QFGUOVROFAPZLJ-UHFFFAOYSA-N 2 0 275.440 2.846 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000843116883 631840426 /nfs/dbraw/zinc/84/04/26/631840426.db2.gz NBBYWEVQDLBPBO-QGZVFWFLSA-N 2 0 275.440 2.704 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1C ZINC000843124695 631842534 /nfs/dbraw/zinc/84/25/34/631842534.db2.gz FLRUHRKFHUTZJB-HOTGVXAUSA-N 2 0 288.435 2.831 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843124420 631843243 /nfs/dbraw/zinc/84/32/43/631843243.db2.gz ASFCNJXSUDLWPX-GJZGRUSLSA-N 2 0 274.408 2.522 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c(Cl)c1 ZINC000843125849 631845515 /nfs/dbraw/zinc/84/55/15/631845515.db2.gz AXEDUOBFJPAZRS-BETUJISGSA-N 2 0 294.826 2.785 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000843341397 631931394 /nfs/dbraw/zinc/93/13/94/631931394.db2.gz DOFOJUCFXKTMCO-FGTMMUONSA-N 2 0 299.462 2.765 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(F)ccc1O ZINC000843344259 631933464 /nfs/dbraw/zinc/93/34/64/631933464.db2.gz SFKJKXHNTXQVCC-LLVKDONJSA-N 2 0 274.339 2.841 20 10 CFCDRP [NH3+]Cc1ccc2c(c1)CCCN2CCCC1CC[NH2+]CC1 ZINC000843350931 631934366 /nfs/dbraw/zinc/93/43/66/631934366.db2.gz XPHTWTXYTUNGHI-UHFFFAOYSA-N 2 0 287.451 2.678 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)ccc1N(C)C ZINC000815121248 632207101 /nfs/dbraw/zinc/20/71/01/632207101.db2.gz UCDXNLHXAWELLC-GOSISDBHSA-N 2 0 287.451 2.589 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1 ZINC000844901982 632330848 /nfs/dbraw/zinc/33/08/48/632330848.db2.gz LRBKEKLMKDVXTR-CJNGLKHVSA-N 2 0 292.423 2.740 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(F)ccc1O ZINC000844905232 632331832 /nfs/dbraw/zinc/33/18/32/632331832.db2.gz WKHXBJXNJABLKP-UHFFFAOYSA-N 2 0 274.339 2.541 20 10 CFCDRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)c(F)c1 ZINC000844924187 632338993 /nfs/dbraw/zinc/33/89/93/632338993.db2.gz NLYANBPDSIXJFG-HNNXBMFYSA-N 2 0 286.350 2.767 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1O ZINC000846172391 632654135 /nfs/dbraw/zinc/65/41/35/632654135.db2.gz LUNNYFCNAHYSIC-HSBZDZAISA-N 2 0 292.423 2.924 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1 ZINC000817865154 632714524 /nfs/dbraw/zinc/71/45/24/632714524.db2.gz JJUWSTVTQFPSDA-NFAWXSAZSA-N 2 0 292.423 2.596 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000817865748 632715325 /nfs/dbraw/zinc/71/53/25/632715325.db2.gz XYLOYCVKNPTNKO-UNEWFSDZSA-N 2 0 289.467 2.866 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000817865744 632715673 /nfs/dbraw/zinc/71/56/73/632715673.db2.gz XYLOYCVKNPTNKO-QRTARXTBSA-N 2 0 289.467 2.866 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CCCCC[C@H]3[NH3+])ccc21 ZINC000817901970 632725071 /nfs/dbraw/zinc/72/50/71/632725071.db2.gz ZZRMYXYUUSLVEB-SJORKVTESA-N 2 0 287.451 2.819 20 10 CFCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Br)cc1O ZINC000817936426 632741940 /nfs/dbraw/zinc/74/19/40/632741940.db2.gz OMSDMZNRNSOBBJ-SECBINFHSA-N 2 0 299.212 2.557 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000817935756 632742098 /nfs/dbraw/zinc/74/20/98/632742098.db2.gz ZQRMEFCBCUFNRR-KFWWJZLASA-N 2 0 277.456 2.707 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)c(O)c1C ZINC000817940764 632743912 /nfs/dbraw/zinc/74/39/12/632743912.db2.gz KOQHVZKCVSETLZ-ZDUSSCGKSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC000817946637 632748077 /nfs/dbraw/zinc/74/80/77/632748077.db2.gz BZLJGOPPPSVIRI-RDBSUJKOSA-N 2 0 262.397 2.739 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCC[NH2+]C1 ZINC000817947805 632749284 /nfs/dbraw/zinc/74/92/84/632749284.db2.gz RPESSGDBNMBFIF-SQWLQELKSA-N 2 0 275.440 2.791 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C2CCC([NH3+])CC2)c(O)c1 ZINC000817947748 632749429 /nfs/dbraw/zinc/74/94/29/632749429.db2.gz PXHZXZHOZVBHSV-IYXRBSQSSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)c2c1c(F)ccc2O ZINC000817947095 632749472 /nfs/dbraw/zinc/74/94/72/632749472.db2.gz JYCPKQMXVQHVMG-HHISKICNSA-N 2 0 278.371 2.939 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[NH2+]C(C)C)c(O)c1 ZINC000817953550 632753248 /nfs/dbraw/zinc/75/32/48/632753248.db2.gz NXHVQVJOTDIRSQ-CYBMUJFWSA-N 2 0 250.386 2.739 20 10 CFCDRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(C)cc1O ZINC000817954427 632753748 /nfs/dbraw/zinc/75/37/48/632753748.db2.gz CWJXZGNBNBBOEO-HIFRSBDPSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817954709 632755128 /nfs/dbraw/zinc/75/51/28/632755128.db2.gz HHVVEXVUVZBUSU-WDEREUQCSA-N 2 0 268.788 2.696 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000817965050 632763178 /nfs/dbraw/zinc/76/31/78/632763178.db2.gz OBYBLLNJGOYZSJ-ZDUSSCGKSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc2c(cc1O)CCCC2 ZINC000817965894 632763817 /nfs/dbraw/zinc/76/38/17/632763817.db2.gz WTMMFCRYCDTZDP-BDJLRTHQSA-N 2 0 274.408 2.659 20 10 CFCDRP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc2c(cc1O)CCCC2 ZINC000817965898 632764395 /nfs/dbraw/zinc/76/43/95/632764395.db2.gz WTMMFCRYCDTZDP-ZBEGNZNMSA-N 2 0 274.408 2.659 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000817967670 632766231 /nfs/dbraw/zinc/76/62/31/632766231.db2.gz AKGJXTCEEDDSFJ-MRXNPFEDSA-N 2 0 280.371 2.773 20 10 CFCDRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(C)cc1O ZINC000817967413 632766402 /nfs/dbraw/zinc/76/64/02/632766402.db2.gz HQZTXXNUYGFDBR-HNNXBMFYSA-N 2 0 260.381 2.661 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817969055 632767740 /nfs/dbraw/zinc/76/77/40/632767740.db2.gz QJQCJERQNHZJLE-RDJZCZTQSA-N 2 0 275.440 2.935 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(C)cc1O ZINC000817970785 632769358 /nfs/dbraw/zinc/76/93/58/632769358.db2.gz FCZUWSMHPMPJFU-YDHLFZDLSA-N 2 0 262.397 2.882 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)ccc1O ZINC000817971174 632771234 /nfs/dbraw/zinc/77/12/34/632771234.db2.gz JXXIAUDJIWHATI-JFGNBEQYSA-N 2 0 268.788 2.837 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000817972647 632771861 /nfs/dbraw/zinc/77/18/61/632771861.db2.gz ZGFOHJTYSXDXKS-COXVUDFISA-N 2 0 275.440 2.791 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000817972295 632772287 /nfs/dbraw/zinc/77/22/87/632772287.db2.gz VXPYIEKGKFERCJ-YCPHGPKFSA-N 2 0 275.440 2.934 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972467 632772504 /nfs/dbraw/zinc/77/25/04/632772504.db2.gz XUMDGJPQVIEHTK-VNHYZAJKSA-N 2 0 261.413 2.544 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000817975691 632773013 /nfs/dbraw/zinc/77/30/13/632773013.db2.gz PVSYBOCWHDQDKZ-MGPQQGTHSA-N 2 0 292.423 2.817 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C)cc1O ZINC000817976757 632774255 /nfs/dbraw/zinc/77/42/55/632774255.db2.gz SVHLPXJMEHDMNE-HOCLYGCPSA-N 2 0 274.408 2.883 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817978669 632776111 /nfs/dbraw/zinc/77/61/11/632776111.db2.gz CXSBKNQCDWPKAD-FZMZJTMJSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000817980189 632776677 /nfs/dbraw/zinc/77/66/77/632776677.db2.gz JUDWWTFEAWUCIC-KGLIPLIRSA-N 2 0 262.397 2.883 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CC2 ZINC000817980014 632776895 /nfs/dbraw/zinc/77/68/95/632776895.db2.gz HHYLDIDVHSGINR-KGLIPLIRSA-N 2 0 260.381 2.501 20 10 CFCDRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000846698423 632777266 /nfs/dbraw/zinc/77/72/66/632777266.db2.gz GYWQLBUPYXWEGD-NVXWUHKLSA-N 2 0 287.451 2.989 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000817980709 632777982 /nfs/dbraw/zinc/77/79/82/632777982.db2.gz WPBWYNLPBVRQAT-ZYHUDNBSSA-N 2 0 256.777 2.824 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817980854 632778181 /nfs/dbraw/zinc/77/81/81/632778181.db2.gz XQGNXGNERXCHGS-PSASIEDQSA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCC[NH2+]C2CC2)c2c1c(F)ccc2O ZINC000817983853 632779577 /nfs/dbraw/zinc/77/95/77/632779577.db2.gz JXPQYJHTUMKFGO-ZWNOBZJWSA-N 2 0 278.371 2.811 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(F)ccc1O ZINC000817984929 632781105 /nfs/dbraw/zinc/78/11/05/632781105.db2.gz CNKRZUPEZOLAHA-WCQYABFASA-N 2 0 278.371 2.857 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1O ZINC000848559510 633289121 /nfs/dbraw/zinc/28/91/21/633289121.db2.gz XSKRVVLMEDRKRX-VNHYZAJKSA-N 2 0 262.397 2.773 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000848905272 633392844 /nfs/dbraw/zinc/39/28/44/633392844.db2.gz FWEBVOGVMZVRPZ-INIZCTEOSA-N 2 0 276.424 2.871 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000853247407 634950722 /nfs/dbraw/zinc/95/07/22/634950722.db2.gz OOXIEAHFNJNZLG-GFCCVEGCSA-N 2 0 274.767 2.648 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1F ZINC000858246029 636162820 /nfs/dbraw/zinc/16/28/20/636162820.db2.gz RNAWQLBIUYCTFR-OAHLLOKOSA-N 2 0 293.430 2.713 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872250770 641718000 /nfs/dbraw/zinc/71/80/00/641718000.db2.gz AWAQRSLGJAMXEG-HNNXBMFYSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1ccc(O)c(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000872250780 641718140 /nfs/dbraw/zinc/71/81/40/641718140.db2.gz BLJZAYDTTKCFDR-AWEZNQCLSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCCC[C@H]([NH3+])C2)cc1C ZINC000873214802 642071875 /nfs/dbraw/zinc/07/18/75/642071875.db2.gz JGEPUADZIGIQED-HNNXBMFYSA-N 2 0 262.397 2.712 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c(O)c1 ZINC000873241451 642090656 /nfs/dbraw/zinc/09/06/56/642090656.db2.gz XBSCHRXOGUZLJO-IHRRRGAJSA-N 2 0 262.397 2.869 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000876759789 642998122 /nfs/dbraw/zinc/99/81/22/642998122.db2.gz QPVVEQBAOYKRLS-OAHLLOKOSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000876812359 643021291 /nfs/dbraw/zinc/02/12/91/643021291.db2.gz LISHYJNQJLFFRF-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000876946646 643075549 /nfs/dbraw/zinc/07/55/49/643075549.db2.gz UKFZJKJBZNZYDM-ZDUSSCGKSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c(O)c1 ZINC000877019847 643106249 /nfs/dbraw/zinc/10/62/49/643106249.db2.gz FPTQKJQLCWNVCF-HNNXBMFYSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c(O)c1 ZINC000877654093 643435382 /nfs/dbraw/zinc/43/53/82/643435382.db2.gz VHZGYVDTSYYVNE-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC000877740620 643508124 /nfs/dbraw/zinc/50/81/24/643508124.db2.gz KMQQNYABTNXXAQ-WMZOPIPTSA-N 2 0 287.451 2.587 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@@H](C)C1 ZINC000248150218 650924807 /nfs/dbraw/zinc/92/48/07/650924807.db2.gz QQVJSKACPYJWDR-STQMWFEESA-N 2 0 299.509 2.945 20 10 CFCDRP C[C@H]([NH3+])C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000128328361 644639325 /nfs/dbraw/zinc/63/93/25/644639325.db2.gz YUOOKPXLBCKRAT-JTQLQIEISA-N 2 0 268.788 2.605 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000131483425 645735117 /nfs/dbraw/zinc/73/51/17/645735117.db2.gz WABZSKKAGYFEKY-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(C)cc1O ZINC000925776526 648319142 /nfs/dbraw/zinc/31/91/42/648319142.db2.gz LARQDQFSVDRNII-JSGCOSHPSA-N 2 0 298.377 2.986 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c1 ZINC000925784448 648322411 /nfs/dbraw/zinc/32/24/11/648322411.db2.gz RPOSVDKVXMTZBB-NEPJUHHUSA-N 2 0 284.350 2.596 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c1 ZINC000925784450 648323498 /nfs/dbraw/zinc/32/34/98/648323498.db2.gz RPOSVDKVXMTZBB-RYUDHWBXSA-N 2 0 284.350 2.596 20 10 CFCDRP CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2c(c1)C[NH2+]C2 ZINC001167625328 773196049 /nfs/dbraw/zinc/19/60/49/773196049.db2.gz PZOGGRUZQCYWTQ-UHFFFAOYSA-N 2 0 273.424 2.775 20 10 CFCDRP Cc1cc(C)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)c(O)c1 ZINC001231849633 777350306 /nfs/dbraw/zinc/35/03/06/777350306.db2.gz TVEVKZJEVYOOGM-UHFFFAOYSA-N 2 0 274.408 2.537 20 10 CFCDRP Cc1c(CN2CCC[C@]23CC[NH2+]C3)c2ccccc2n1C ZINC001235110685 778383658 /nfs/dbraw/zinc/38/36/58/778383658.db2.gz LOTMXYGBISFHLC-GOSISDBHSA-N 2 0 283.419 2.815 20 10 CFCDRP CC1(C)CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235691415 778538490 /nfs/dbraw/zinc/53/84/90/778538490.db2.gz QREPLKDLMYZGFY-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP Cc1cc(C[N@H+](C)CCC2CC[NH2+]CC2)ccc1N(C)C ZINC001235717363 778546586 /nfs/dbraw/zinc/54/65/86/778546586.db2.gz RWZUAKIORQWNFZ-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC001235750686 778552505 /nfs/dbraw/zinc/55/25/05/778552505.db2.gz RTEKIFXGCJXFMB-KRWDZBQOSA-N 2 0 283.419 2.875 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c(O)c1 ZINC001235939969 778619482 /nfs/dbraw/zinc/61/94/82/778619482.db2.gz RRKCBWZWJBAUQW-DZGCQCFKSA-N 2 0 288.435 2.731 20 10 CFCDRP CCc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236218366 778742946 /nfs/dbraw/zinc/74/29/46/778742946.db2.gz SOCCERXYVLTZNJ-HUUCEWRRSA-N 2 0 262.397 2.656 20 10 CFCDRP Oc1cccc2c1C[N@@H+](C1CC[NH+](CC3CC3)CC1)CC2 ZINC001168389929 778770883 /nfs/dbraw/zinc/77/08/83/778770883.db2.gz XQKKHCXCAGFNMK-UHFFFAOYSA-N 2 0 286.419 2.625 20 10 CFCDRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1O ZINC001237395593 779095270 /nfs/dbraw/zinc/09/52/70/779095270.db2.gz YBLMZDDCDUJCQT-GDBMZVCRSA-N 2 0 274.408 2.583 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCN(c2cc[nH+]cc2C)CC1 ZINC001237495601 779120573 /nfs/dbraw/zinc/12/05/73/779120573.db2.gz SUEXJRXXDYBMMQ-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP Cc1cc(F)cc(C[N@H+](C)CC2CC[NH+](C)CC2)c1O ZINC001238062460 779243174 /nfs/dbraw/zinc/24/31/74/779243174.db2.gz QDYDHWAHOLXGMR-UHFFFAOYSA-N 2 0 280.387 2.613 20 10 CFCDRP CC(C)c1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c(O)c1 ZINC001205151368 779353590 /nfs/dbraw/zinc/35/35/90/779353590.db2.gz TZAYRMSQJVCKQJ-SWLSCSKDSA-N 2 0 262.397 2.542 20 10 CFCDRP CCCN(CC1CC[NH+](C)CC1)c1ccc(C[NH3+])cc1 ZINC000691321070 779884022 /nfs/dbraw/zinc/88/40/22/779884022.db2.gz BHBOZFDMIFFWTD-UHFFFAOYSA-N 2 0 275.440 2.704 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000700817577 780726728 /nfs/dbraw/zinc/72/67/28/780726728.db2.gz VVDCZPOSQFPYTJ-CHWSQXEVSA-N 2 0 280.387 2.914 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1C ZINC000037408383 372664947 /nfs/dbraw/zinc/66/49/47/372664947.db2.gz ZTEVBWZUKHTHIF-OAHLLOKOSA-N 2 0 274.408 2.578 20 10 CFCDRP CC[NH+]1CCC([NH2+]Cc2ccc(OC)c(C)c2)CC1 ZINC000037979522 372745897 /nfs/dbraw/zinc/74/58/97/372745897.db2.gz PXAAVGGZSQOKHH-UHFFFAOYSA-N 2 0 262.397 2.578 20 10 CFCDRP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccccc1O ZINC000128447503 377336829 /nfs/dbraw/zinc/33/68/29/377336829.db2.gz BIWOVCCBULHPCG-OAHLLOKOSA-N 2 0 262.397 2.698 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)ccc21 ZINC000378896148 781970923 /nfs/dbraw/zinc/97/09/23/781970923.db2.gz UWDODAWJYKNAFC-ZWKOTPCHSA-N 2 0 299.462 2.785 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000179580308 380560399 /nfs/dbraw/zinc/56/03/99/380560399.db2.gz YWOZKPHBRISNET-HNNXBMFYSA-N 2 0 274.408 2.700 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC000179580856 380560559 /nfs/dbraw/zinc/56/05/59/380560559.db2.gz PDHHGBQJXGSTPV-CQSZACIVSA-N 2 0 262.397 2.556 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CCN(Cc2cc(F)ccc2O)C1 ZINC000180215318 380634830 /nfs/dbraw/zinc/63/48/30/380634830.db2.gz PCAYMTRDJSYXFE-CYBMUJFWSA-N 2 0 280.387 2.695 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2O)C1 ZINC000183440806 381271702 /nfs/dbraw/zinc/27/17/02/381271702.db2.gz LOPBFDOOJCRCFI-KBPBESRZSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000296369693 381366129 /nfs/dbraw/zinc/36/61/29/381366129.db2.gz JEAUQVFTDSOMBX-FFHGMXDLSA-N 2 0 274.408 2.976 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185671592 381699709 /nfs/dbraw/zinc/69/97/09/381699709.db2.gz PJUKELASXVXKSM-GXTWGEPZSA-N 2 0 298.402 2.539 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 ZINC000185672512 381700190 /nfs/dbraw/zinc/70/01/90/381700190.db2.gz CYJZYHSHYBENRF-IHRRRGAJSA-N 2 0 274.408 2.976 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3nccn3C)C2)cc1 ZINC000376045102 382117282 /nfs/dbraw/zinc/11/72/82/382117282.db2.gz VILSOEGDPWFJJN-MRXNPFEDSA-N 2 0 298.434 2.866 20 10 CFCDRP C[N@H+](Cc1ccccc1O)C1CCN(c2ccccn2)CC1 ZINC000378372233 382449549 /nfs/dbraw/zinc/44/95/49/382449549.db2.gz AIGWIVMJRISALR-UHFFFAOYSA-N 2 0 297.402 2.888 20 10 CFCDRP COc1ccc(O)c([C@H](C)[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC000367316994 382564202 /nfs/dbraw/zinc/56/42/02/382564202.db2.gz GTHOSEVVDZIEBN-UONOGXRCSA-N 2 0 292.423 2.878 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1O ZINC000251579066 383391296 /nfs/dbraw/zinc/39/12/96/383391296.db2.gz VTXBHWDOLNNYHU-IHRRRGAJSA-N 2 0 260.381 2.670 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@H]4[C@@H]3C2)c1 ZINC000367472958 267092315 /nfs/dbraw/zinc/09/23/15/267092315.db2.gz ZMSJWIIGEUWNSA-ZACQAIPSSA-N 2 0 286.419 2.617 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000037648828 278354867 /nfs/dbraw/zinc/35/48/67/278354867.db2.gz MOASRXMIFMCJEC-HUUCEWRRSA-N 2 0 287.451 2.888 20 10 CFCDRP CC[C@H](c1ccccc1O)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000312704259 281025169 /nfs/dbraw/zinc/02/51/69/281025169.db2.gz OIFPIWUPZYYZIK-WBVHZDCISA-N 2 0 274.408 2.871 20 10 CFCDRP CCOc1cccc(C[N@H+](CC)CCC[NH+](C)C)c1O ZINC000230744827 521332822 /nfs/dbraw/zinc/33/28/22/521332822.db2.gz ILTFDILMAJRIOQ-UHFFFAOYSA-N 2 0 280.412 2.565 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH+](C)C)c1ccc(C)cc1O ZINC000279975629 522826687 /nfs/dbraw/zinc/82/66/87/522826687.db2.gz DFXASEJZPDJRMV-CQSZACIVSA-N 2 0 250.386 2.693 20 10 CFCDRP CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccccc1O ZINC000049553310 522932351 /nfs/dbraw/zinc/93/23/51/522932351.db2.gz MUPSZENNNWUWFW-TZMCWYRMSA-N 2 0 250.386 2.773 20 10 CFCDRP Cc1cccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1O ZINC000290525291 524393498 /nfs/dbraw/zinc/39/34/98/524393498.db2.gz QFYFCRCDMVHHOZ-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1O ZINC000158135982 524429900 /nfs/dbraw/zinc/42/99/00/524429900.db2.gz VOTLQIGAVFHODV-MQVJKMGUSA-N 2 0 274.408 2.806 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1O ZINC000158112244 524433331 /nfs/dbraw/zinc/43/33/31/524433331.db2.gz GQUKWUAMIZVYBL-AWEZNQCLSA-N 2 0 276.424 2.912 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1 ZINC000062077820 524761911 /nfs/dbraw/zinc/76/19/11/524761911.db2.gz WCSMEJYHCCYKHA-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000037648826 525482121 /nfs/dbraw/zinc/48/21/21/525482121.db2.gz MOASRXMIFMCJEC-CABCVRRESA-N 2 0 287.451 2.888 20 10 CFCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1cc(F)ccc1O ZINC000094618159 525491206 /nfs/dbraw/zinc/49/12/06/525491206.db2.gz KDZAVGGWSCHLIU-QWHCGFSZSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1C ZINC000293266351 525732206 /nfs/dbraw/zinc/73/22/06/525732206.db2.gz CFDXFAPKNSZTIK-SMDDNHRTSA-N 2 0 264.413 2.857 20 10 CFCDRP CCOc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c(O)c1 ZINC000725848942 574329058 /nfs/dbraw/zinc/32/90/58/574329058.db2.gz DIYGYMAIMHEFRW-AWEZNQCLSA-N 2 0 292.423 2.611 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)c(O)c1 ZINC000044515910 618027218 /nfs/dbraw/zinc/02/72/18/618027218.db2.gz GNLLHQAMTVRABU-CYBMUJFWSA-N 2 0 262.397 2.693 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1C ZINC000090721598 618171817 /nfs/dbraw/zinc/17/18/17/618171817.db2.gz XPWOTPJIPXZJTA-UKRRQHHQSA-N 2 0 262.397 2.576 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])c(O)c1C ZINC000925736482 619046188 /nfs/dbraw/zinc/04/61/88/619046188.db2.gz AHTXSQIHCZPAQE-LBPRGKRZSA-N 2 0 250.386 2.787 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1C ZINC000925798294 619120270 /nfs/dbraw/zinc/12/02/70/619120270.db2.gz QOECLYWWDNVSHP-BPLDGKMQSA-N 2 0 276.424 2.905 20 10 CFCDRP C[C@H]([NH2+]CCCCCC[NH3+])c1cc(F)ccc1O ZINC000843340639 619210807 /nfs/dbraw/zinc/21/08/07/619210807.db2.gz CVXUBKCRYYSGOF-NSHDSACASA-N 2 0 254.349 2.701 20 10 CFCDRP COc1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1C ZINC000035052756 620070008 /nfs/dbraw/zinc/07/00/08/620070008.db2.gz WEXDZNGBSWMUEA-UHFFFAOYSA-N 2 0 276.424 2.969 20 10 CFCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc(N)cc1 ZINC000841038843 620379535 /nfs/dbraw/zinc/37/95/35/620379535.db2.gz RKNSVVJVMXLRGW-PBHICJAKSA-N 2 0 275.440 2.712 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000841062047 620424215 /nfs/dbraw/zinc/42/42/15/620424215.db2.gz RNPCSRWYOBWPRJ-HOCLYGCPSA-N 2 0 275.440 2.763 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000841062046 620424403 /nfs/dbraw/zinc/42/44/03/620424403.db2.gz RNPCSRWYOBWPRJ-GOEBONIOSA-N 2 0 275.440 2.763 20 10 CFCDRP COc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1C ZINC000057994471 623025511 /nfs/dbraw/zinc/02/55/11/623025511.db2.gz GTSMKANNEGAHEP-CQSZACIVSA-N 2 0 276.424 2.825 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000157746209 623056926 /nfs/dbraw/zinc/05/69/26/623056926.db2.gz KOYRMRYHPVKKAY-AVGNSLFASA-N 2 0 278.396 2.534 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccccc1O ZINC000157817633 623060983 /nfs/dbraw/zinc/06/09/83/623060983.db2.gz JPRVOMIVLCMHQA-IPYPFGDCSA-N 2 0 262.397 2.916 20 10 CFCDRP Cc1cccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1O ZINC000827845516 624109966 /nfs/dbraw/zinc/10/99/66/624109966.db2.gz VZCHGFPIIMKOCA-UHFFFAOYSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)ccc1N(C)C ZINC000923331323 626465807 /nfs/dbraw/zinc/46/58/07/626465807.db2.gz FXHFBINCHNIQBS-BBWFWOEESA-N 2 0 287.451 2.620 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2c(O)cc(C)cc2Cl)CC[C@@H]1[NH3+] ZINC000843050379 626547661 /nfs/dbraw/zinc/54/76/61/626547661.db2.gz FDIMQEKKKLSCJC-RISCZKNCSA-N 2 0 282.815 2.913 20 10 CFCDRP CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771824959 627634237 /nfs/dbraw/zinc/63/42/37/627634237.db2.gz UFQPJBXLHOWMHF-HOTGVXAUSA-N 2 0 289.467 2.963 20 10 CFCDRP C[N@H+](CCC1CC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775739292 628061346 /nfs/dbraw/zinc/06/13/46/628061346.db2.gz OUNYKXASOGVINJ-UHFFFAOYSA-N 2 0 287.451 2.670 20 10 CFCDRP CCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775803051 628070579 /nfs/dbraw/zinc/07/05/79/628070579.db2.gz BWPNNDKWYFQKGB-OAHLLOKOSA-N 2 0 275.440 2.717 20 10 CFCDRP CCOc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)c(O)c1 ZINC000779987457 628425218 /nfs/dbraw/zinc/42/52/18/628425218.db2.gz XZVGAGOYRYQCLW-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000835035849 629328462 /nfs/dbraw/zinc/32/84/62/629328462.db2.gz MFVGSPCJJMPZEE-GVKBTVHKSA-N 2 0 299.462 2.982 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835035836 629330208 /nfs/dbraw/zinc/33/02/08/629330208.db2.gz MFLPELNTDZZRBI-RTRPANQVSA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000835043455 629340989 /nfs/dbraw/zinc/34/09/89/629340989.db2.gz UMUKJBQRISRXAJ-FNORWQNLSA-N 2 0 287.451 2.841 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC3(C)C)cc2)CC1 ZINC000808421673 630989309 /nfs/dbraw/zinc/98/93/09/630989309.db2.gz PLXJXNBBAHUCPS-QGZVFWFLSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000840808610 631228466 /nfs/dbraw/zinc/22/84/66/631228466.db2.gz NASNRKSNCDVLEZ-KGLIPLIRSA-N 2 0 262.397 2.775 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000841029479 631310348 /nfs/dbraw/zinc/31/03/48/631310348.db2.gz HQPMZNCLXABYCQ-WBVHZDCISA-N 2 0 275.440 2.750 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031014 631312251 /nfs/dbraw/zinc/31/22/51/631312251.db2.gz QTTQJDBQHNCAJN-ZWNOBZJWSA-N 2 0 298.814 2.661 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000841032415 631312667 /nfs/dbraw/zinc/31/26/67/631312667.db2.gz BVRVIXJOYAXIIH-NVXWUHKLSA-N 2 0 287.451 2.765 20 10 CFCDRP CCN(CC)c1ccc(CNC[C@@H]2CCCC[NH2+]2)cc1 ZINC000841032938 631313856 /nfs/dbraw/zinc/31/38/56/631313856.db2.gz KFYOGUNIYVENDE-INIZCTEOSA-N 2 0 275.440 2.765 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000841057669 631323591 /nfs/dbraw/zinc/32/35/91/631323591.db2.gz KYYOKZFNXHJQJU-INIZCTEOSA-N 2 0 273.424 2.519 20 10 CFCDRP C[C@@]1(C[NH2+]Cc2cc(Cl)ccc2O)CCC[NH2+]C1 ZINC000841056633 631324526 /nfs/dbraw/zinc/32/45/26/631324526.db2.gz HIXSIGAFSQUBIM-CQSZACIVSA-N 2 0 268.788 2.525 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000841057910 631326066 /nfs/dbraw/zinc/32/60/66/631326066.db2.gz SBQSLWUGFZFSDG-KRWDZBQOSA-N 2 0 275.440 2.540 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000841073154 631330407 /nfs/dbraw/zinc/33/04/07/631330407.db2.gz RCMGPPIHUOOVBD-MRXNPFEDSA-N 2 0 275.440 2.539 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000841072573 631330604 /nfs/dbraw/zinc/33/06/04/631330604.db2.gz KVTNFSBUSLOLAT-INIZCTEOSA-N 2 0 275.440 2.683 20 10 CFCDRP COc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1C ZINC000841078268 631331705 /nfs/dbraw/zinc/33/17/05/631331705.db2.gz DPCVXOGPXXGHRY-ZDUSSCGKSA-N 2 0 250.386 2.611 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)CCCC[NH3+])c(Cl)c1 ZINC000841079860 631332671 /nfs/dbraw/zinc/33/26/71/631332671.db2.gz NKHRNBRMMDEONB-LLVKDONJSA-N 2 0 270.804 2.961 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)CCC[NH3+])c(Cl)c1 ZINC000841080170 631333291 /nfs/dbraw/zinc/33/32/91/631333291.db2.gz OMAUTWPXSNONKY-JTQLQIEISA-N 2 0 256.777 2.571 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000841083149 631334482 /nfs/dbraw/zinc/33/44/82/631334482.db2.gz OXTFVQXEZJUDQN-WKILWMFISA-N 2 0 289.467 2.916 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000841091400 631338362 /nfs/dbraw/zinc/33/83/62/631338362.db2.gz WYCXHFKOYFQIQW-MRXNPFEDSA-N 2 0 287.451 2.825 20 10 CFCDRP [NH3+][C@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843043773 631811899 /nfs/dbraw/zinc/81/18/99/631811899.db2.gz GZVOJLSFALSCRV-INIZCTEOSA-N 2 0 273.424 2.600 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1F ZINC000843046886 631813893 /nfs/dbraw/zinc/81/38/93/631813893.db2.gz HPZAMPWNMIGXRG-YIONKMFJSA-N 2 0 291.414 2.607 20 10 CFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1[NH3+] ZINC000843051941 631817145 /nfs/dbraw/zinc/81/71/45/631817145.db2.gz MYUGFGNSRWFQJA-MAUKXSAKSA-N 2 0 287.451 2.846 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(OCC)cc2O)CC1 ZINC000843056359 631820280 /nfs/dbraw/zinc/82/02/80/631820280.db2.gz ZEXIBIJSJHCFQZ-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000843057434 631820696 /nfs/dbraw/zinc/82/06/96/631820696.db2.gz LZBPXVGFPNQNPW-UHFFFAOYSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C2CCC([NH3+])CC2)c(Cl)c1 ZINC000843106542 631837737 /nfs/dbraw/zinc/83/77/37/631837737.db2.gz BJIIEMUFHZGAII-UHFFFAOYSA-N 2 0 268.788 2.714 20 10 CFCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843120165 631841691 /nfs/dbraw/zinc/84/16/91/631841691.db2.gz GKZDZQOAEYVPNR-UHFFFAOYSA-N 2 0 280.799 2.621 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124606 631842553 /nfs/dbraw/zinc/84/25/53/631842553.db2.gz DBIJWJRUIDDPKW-OLZOCXBDSA-N 2 0 294.826 2.867 20 10 CFCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124763 631843861 /nfs/dbraw/zinc/84/38/61/631843861.db2.gz GKULBCZUJAZPPV-CHWSQXEVSA-N 2 0 294.826 2.867 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843126761 631846781 /nfs/dbraw/zinc/84/67/81/631846781.db2.gz MRAQHEGMOJGERP-HOTGVXAUSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CCCCCC[NH3+])c1O ZINC000843126874 631847053 /nfs/dbraw/zinc/84/70/53/631847053.db2.gz KLSMRKRBTZEXKZ-UHFFFAOYSA-N 2 0 270.804 2.963 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000843128025 631848131 /nfs/dbraw/zinc/84/81/31/631848131.db2.gz VAAYYLJCXIWSFF-FEFURNDJSA-N 2 0 299.462 2.697 20 10 CFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000843431776 631957475 /nfs/dbraw/zinc/95/74/75/631957475.db2.gz ZIRZSPZMODJHCD-UHFFFAOYSA-N 2 0 275.440 2.669 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H](C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000813877521 631971373 /nfs/dbraw/zinc/97/13/73/631971373.db2.gz YNYQUSAXUOTKLR-PBHICJAKSA-N 2 0 277.456 2.991 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000844901641 632330650 /nfs/dbraw/zinc/33/06/50/632330650.db2.gz JMHFLTRFKGSIBJ-UHFFFAOYSA-N 2 0 275.440 2.751 20 10 CFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c(F)c2)[C@H]1CC[NH3+] ZINC000844900663 632330833 /nfs/dbraw/zinc/33/08/33/632330833.db2.gz CIODMKMWLINTNP-CJNGLKHVSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CCC2(C[NH3+])CC2)c1O ZINC000844903686 632331898 /nfs/dbraw/zinc/33/18/98/632331898.db2.gz KKKIINPXDUOTSO-UHFFFAOYSA-N 2 0 268.788 2.573 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c(O)c1 ZINC000844903060 632332129 /nfs/dbraw/zinc/33/21/29/632332129.db2.gz ZJTIJMBESWIBFG-CJNGLKHVSA-N 2 0 292.423 2.740 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC(CC[NH3+])CC2)cc1 ZINC000844913031 632334407 /nfs/dbraw/zinc/33/44/07/632334407.db2.gz XMSPZDDWIAYDRW-ONEGZZNKSA-N 2 0 287.451 2.827 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)c(O)c1 ZINC000844922569 632338163 /nfs/dbraw/zinc/33/81/63/632338163.db2.gz ASWOVLHGDSGGQM-CYBMUJFWSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccccc1O ZINC000844926931 632339635 /nfs/dbraw/zinc/33/96/35/632339635.db2.gz WSGVEIBLIXWMKA-HNNXBMFYSA-N 2 0 262.397 2.823 20 10 CFCDRP CCOc1cccc(C[N@H+](C)CC[C@H]([NH3+])C(C)C)c1O ZINC000156694902 650063218 /nfs/dbraw/zinc/06/32/18/650063218.db2.gz BYGRVPMKRSYGBH-AWEZNQCLSA-N 2 0 280.412 2.596 20 10 CFCDRP C[N@H+]1CC=C(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816560008 632484548 /nfs/dbraw/zinc/48/45/48/632484548.db2.gz BRAVZBFKDIGKTR-UHFFFAOYSA-N 2 0 282.387 2.897 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1O ZINC000846141792 632645024 /nfs/dbraw/zinc/64/50/24/632645024.db2.gz SYZJKYIOWOHYAH-BFHYXJOUSA-N 2 0 290.407 2.678 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(OC)c2O)C1 ZINC000846145899 632646579 /nfs/dbraw/zinc/64/65/79/632646579.db2.gz QQCGEMCYKSEQDJ-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCN(C)[C@H](C)C2)c1O ZINC000846148272 632646893 /nfs/dbraw/zinc/64/68/93/632646893.db2.gz POEUTBWVQKHUOX-AGIUHOORSA-N 2 0 278.396 2.534 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(OC)c2O)C1 ZINC000846145905 632647295 /nfs/dbraw/zinc/64/72/95/632647295.db2.gz QQCGEMCYKSEQDJ-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000846162870 632650810 /nfs/dbraw/zinc/65/08/10/632650810.db2.gz JJFQUUCDZYLHOM-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000817896994 632721099 /nfs/dbraw/zinc/72/10/99/632721099.db2.gz BBBLMARVXDHCMJ-LSDHHAIUSA-N 2 0 275.440 2.892 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC2([NH3+])CCCCC2)c1 ZINC000817938011 632742725 /nfs/dbraw/zinc/74/27/25/632742725.db2.gz BHUXZDDZWVBJLI-LBPRGKRZSA-N 2 0 278.396 2.713 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000817942859 632746442 /nfs/dbraw/zinc/74/64/42/632746442.db2.gz FZOAWBHYFKTNNQ-INIZCTEOSA-N 2 0 263.429 2.793 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817945455 632747173 /nfs/dbraw/zinc/74/71/73/632747173.db2.gz DDKDSCISMXIGOZ-DZGCQCFKSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817945563 632747432 /nfs/dbraw/zinc/74/74/32/632747432.db2.gz GILADDOINPJGNX-GHMZBOCLSA-N 2 0 268.788 2.696 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817946822 632748222 /nfs/dbraw/zinc/74/82/22/632748222.db2.gz FNHNFXGVZIHLFE-SRVKXCTJSA-N 2 0 266.360 2.570 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(O)c1C ZINC000817946177 632748279 /nfs/dbraw/zinc/74/82/79/632748279.db2.gz TYWDYWQCGMKWDC-KGLIPLIRSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817947797 632749208 /nfs/dbraw/zinc/74/92/08/632749208.db2.gz RHLCMFPDZQGEOI-IPYPFGDCSA-N 2 0 262.397 2.821 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000817957857 632756480 /nfs/dbraw/zinc/75/64/80/632756480.db2.gz PZDHXBKYXJAVDN-KGLIPLIRSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000817957861 632756611 /nfs/dbraw/zinc/75/66/11/632756611.db2.gz PZDHXBKYXJAVDN-ZIAGYGMSSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccccc1O ZINC000817959478 632757719 /nfs/dbraw/zinc/75/77/19/632757719.db2.gz GIAGYMVPTJKZNI-VHDGCEQUSA-N 2 0 262.397 2.950 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000817959908 632758103 /nfs/dbraw/zinc/75/81/03/632758103.db2.gz HBZNPSHHLOGHOH-NSHDSACASA-N 2 0 266.385 2.569 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000817960282 632758889 /nfs/dbraw/zinc/75/88/89/632758889.db2.gz LPBJFZHVTCIXBA-SNVBAGLBSA-N 2 0 254.349 2.699 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCC2)c2c1c(F)ccc2O ZINC000817965054 632763309 /nfs/dbraw/zinc/76/33/09/632763309.db2.gz ODXMKZITXVHQHJ-KOLCDFICSA-N 2 0 264.344 2.551 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968191 632767401 /nfs/dbraw/zinc/76/74/01/632767401.db2.gz HJACYCNHRQREOI-CMPLNLGQSA-N 2 0 268.788 2.838 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000817968897 632767644 /nfs/dbraw/zinc/76/76/44/632767644.db2.gz XQXSEBVFMQYJIS-AWEZNQCLSA-N 2 0 273.424 2.713 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817968495 632767690 /nfs/dbraw/zinc/76/76/90/632767690.db2.gz KFLJBRHJXIKWRF-NTZNESFSSA-N 2 0 278.371 2.811 20 10 CFCDRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817968685 632767777 /nfs/dbraw/zinc/76/77/77/632767777.db2.gz VUOSXCHUGZGEQK-ZDUSSCGKSA-N 2 0 286.419 2.841 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000817976537 632774201 /nfs/dbraw/zinc/77/42/01/632774201.db2.gz NDEQOKHXKJMTAC-STQMWFEESA-N 2 0 250.386 2.869 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976189 632774273 /nfs/dbraw/zinc/77/42/73/632774273.db2.gz HQTAOCIBAHRVJU-SJORKVTESA-N 2 0 287.451 2.935 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000817976533 632774327 /nfs/dbraw/zinc/77/43/27/632774327.db2.gz NCYKVUJSMLZOLF-VXGBXAGGSA-N 2 0 266.385 2.569 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000817976531 632774505 /nfs/dbraw/zinc/77/45/05/632774505.db2.gz NCYKVUJSMLZOLF-NWDGAFQWSA-N 2 0 266.385 2.569 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1O ZINC000817976196 632774639 /nfs/dbraw/zinc/77/46/39/632774639.db2.gz HSZJSOQTOBZVIY-ZFWWWQNUSA-N 2 0 260.381 2.575 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000817976438 632774647 /nfs/dbraw/zinc/77/46/47/632774647.db2.gz XWUVHWMLEXCOMN-KGLIPLIRSA-N 2 0 263.429 2.921 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CC2 ZINC000817980016 632777097 /nfs/dbraw/zinc/77/70/97/632777097.db2.gz HHYLDIDVHSGINR-ZIAGYGMSSA-N 2 0 260.381 2.501 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817980860 632777893 /nfs/dbraw/zinc/77/78/93/632777893.db2.gz XQGNXGNERXCHGS-WPRPVWTQSA-N 2 0 287.201 2.543 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(C)cc1O ZINC000817983913 632780274 /nfs/dbraw/zinc/78/02/74/632780274.db2.gz LLKHGCFTXXEYMO-HNNXBMFYSA-N 2 0 262.397 2.883 20 10 CFCDRP CCc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c1O ZINC000848889211 633363080 /nfs/dbraw/zinc/36/30/80/633363080.db2.gz GUSDTWDOHLWOAE-RDJZCZTQSA-N 2 0 288.435 2.871 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@]3(C)CC3(C)C)cc2)CC1 ZINC000850399978 633977752 /nfs/dbraw/zinc/97/77/52/633977752.db2.gz WPEDIZSBVZFQIP-SFHVURJKSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000854230697 635267120 /nfs/dbraw/zinc/26/71/20/635267120.db2.gz WYMHLNQMVJQRBH-GXTWGEPZSA-N 2 0 250.386 2.725 20 10 CFCDRP CC1CC(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000856810604 635866710 /nfs/dbraw/zinc/86/67/10/635866710.db2.gz QHBIHXWUQARFMG-UHFFFAOYSA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1C ZINC000872725579 641913383 /nfs/dbraw/zinc/91/33/83/641913383.db2.gz URFICMOMJJRURD-HOCLYGCPSA-N 2 0 274.408 2.535 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000873244814 642092967 /nfs/dbraw/zinc/09/29/67/642092967.db2.gz OFWIEXRHICUQOC-ZIAGYGMSSA-N 2 0 274.408 2.747 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1O ZINC000873248431 642094850 /nfs/dbraw/zinc/09/48/50/642094850.db2.gz ADARCEUJNAQTBM-FOGDFJRCSA-N 2 0 268.788 2.742 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(O)c1 ZINC000876813879 643022537 /nfs/dbraw/zinc/02/25/37/643022537.db2.gz YBIDGHCJUCYTHS-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH2+]C2CC[NH+](C(C)C)CC2)c(O)c1 ZINC000876907146 643060282 /nfs/dbraw/zinc/06/02/82/643060282.db2.gz OKHMSXLJKMQXFW-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(C)cc2O)C1 ZINC000876964026 643084417 /nfs/dbraw/zinc/08/44/17/643084417.db2.gz PGNGABIVGWMKNY-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000877020558 643107141 /nfs/dbraw/zinc/10/71/41/643107141.db2.gz XQVAUCQTTVJMLE-HNNXBMFYSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1cccc(O)c1C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000877528659 643332393 /nfs/dbraw/zinc/33/23/93/643332393.db2.gz HFKKIDKVPNWNGD-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000877528617 643333265 /nfs/dbraw/zinc/33/32/65/643333265.db2.gz FYQYVWTUINDVCF-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1O ZINC000877755665 643535069 /nfs/dbraw/zinc/53/50/69/643535069.db2.gz KUEUYKHNWONHDH-CHWSQXEVSA-N 2 0 262.397 2.916 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000093741877 650946240 /nfs/dbraw/zinc/94/62/40/650946240.db2.gz FYUVNEWRYQGQBL-KRWDZBQOSA-N 2 0 289.467 2.916 20 10 CFCDRP C[N@@H+](Cc1cc(Cl)ccc1O)CC1CC[NH+](C)CC1 ZINC000133999065 646262781 /nfs/dbraw/zinc/26/27/81/646262781.db2.gz PTOWPIJJJFKNCA-UHFFFAOYSA-N 2 0 282.815 2.819 20 10 CFCDRP CC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(C)cc1O ZINC000925737377 648304659 /nfs/dbraw/zinc/30/46/59/648304659.db2.gz HWRPBNWPVCWWAL-CYBMUJFWSA-N 2 0 250.386 2.869 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1O ZINC000925783137 648322296 /nfs/dbraw/zinc/32/22/96/648322296.db2.gz CQKJLQLPURNTOW-UTUOFQBUSA-N 2 0 282.815 2.860 20 10 CFCDRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231590648 777270352 /nfs/dbraw/zinc/27/03/52/777270352.db2.gz JSFAFUNWPWTLKN-DNVCBOLYSA-N 2 0 296.414 2.929 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c(O)c1 ZINC001235183714 778405625 /nfs/dbraw/zinc/40/56/25/778405625.db2.gz FORINDWBBXFXMH-HIFRSBDPSA-N 2 0 288.435 2.731 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001235224752 778420560 /nfs/dbraw/zinc/42/05/60/778420560.db2.gz OEOKACXUOQFJAY-ROUUACIJSA-N 2 0 299.462 2.718 20 10 CFCDRP Nc1ccc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235240335 778428095 /nfs/dbraw/zinc/42/80/95/778428095.db2.gz MDRSXZHMZPWOHW-QGZVFWFLSA-N 2 0 273.424 2.623 20 10 CFCDRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001235245436 778429284 /nfs/dbraw/zinc/42/92/84/778429284.db2.gz MKXJCADLQZCDME-RDTXWAMCSA-N 2 0 282.387 2.859 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235424374 778486127 /nfs/dbraw/zinc/48/61/27/778486127.db2.gz HNOOKQIHZRSMQO-HOTGVXAUSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1O ZINC001168366075 778548744 /nfs/dbraw/zinc/54/87/44/778548744.db2.gz JPVBEMVINVXWFW-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1cccc(C[N@@H+](CC(C)C)[C@@H]2CCC[NH2+]C2)c1O ZINC001236474674 778842033 /nfs/dbraw/zinc/84/20/33/778842033.db2.gz LMUDOENXUZPIMP-MRXNPFEDSA-N 2 0 276.424 2.911 20 10 CFCDRP CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)C[C@H]1CC[NH2+]C1 ZINC001236836195 778960984 /nfs/dbraw/zinc/96/09/84/778960984.db2.gz SSDADYNNNAAWON-KRWDZBQOSA-N 2 0 289.467 2.883 20 10 CFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CC1 ZINC001236933464 778982595 /nfs/dbraw/zinc/98/25/95/778982595.db2.gz YEZISNBGQSXONC-UHFFFAOYSA-N 2 0 291.414 2.562 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CCCCCC[NH3+])cc1 ZINC000710768581 781337913 /nfs/dbraw/zinc/33/79/13/781337913.db2.gz XBWXNPDJXWZKMG-UHFFFAOYSA-N 2 0 263.429 2.704 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+](C)C)cc1 ZINC000045598346 373023236 /nfs/dbraw/zinc/02/32/36/373023236.db2.gz AGPLMBQLFGACDC-UHFFFAOYSA-N 2 0 277.456 2.964 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000093693667 375300338 /nfs/dbraw/zinc/30/03/38/375300338.db2.gz YZUXODXVQCIOMX-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)ccc21 ZINC000378896146 781971240 /nfs/dbraw/zinc/97/12/40/781971240.db2.gz UWDODAWJYKNAFC-QZTJIDSGSA-N 2 0 299.462 2.785 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1O ZINC000183544922 381286122 /nfs/dbraw/zinc/28/61/22/381286122.db2.gz NACKIHOXALDXRF-RDBSUJKOSA-N 2 0 262.397 2.916 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@@H]4[C@H]3C2)cc1 ZINC000371403533 381616002 /nfs/dbraw/zinc/61/60/02/381616002.db2.gz SWRMTTUXGBAJAD-NZSAHSFTSA-N 2 0 299.462 2.669 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1cc(F)ccc1O ZINC000185672724 381699989 /nfs/dbraw/zinc/69/99/89/381699989.db2.gz SZWNYUYLTWINGZ-GVXVVHGQSA-N 2 0 278.371 2.807 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(C)ccc2O)C1 ZINC000249378530 383342555 /nfs/dbraw/zinc/34/25/55/383342555.db2.gz OCPRUPXQDXCWMO-KGLIPLIRSA-N 2 0 262.397 2.693 20 10 CFCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(Cl)ccc2O)C1 ZINC000367709618 267112347 /nfs/dbraw/zinc/11/23/47/267112347.db2.gz XFKLNTHCHSLZDN-DOMZBBRYSA-N 2 0 294.826 2.962 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423088945 330169129 /nfs/dbraw/zinc/16/91/29/330169129.db2.gz TXQWQDDFYTUEKP-CJNGLKHVSA-N 2 0 285.435 2.964 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000271843907 520904584 /nfs/dbraw/zinc/90/45/84/520904584.db2.gz RIOQXYDIRRDJEK-UHFFFAOYSA-N 2 0 287.451 2.884 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000277602786 522175613 /nfs/dbraw/zinc/17/56/13/522175613.db2.gz VUHDGKWWJOBARN-INIZCTEOSA-N 2 0 275.440 2.669 20 10 CFCDRP C[N@H+](CCC[NH+]1CCCCC1)Cc1ccccc1O ZINC000161430711 522750107 /nfs/dbraw/zinc/75/01/07/522750107.db2.gz VFBULEQNPJHFRQ-UHFFFAOYSA-N 2 0 262.397 2.700 20 10 CFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cc(F)ccc3O)C2)CC1 ZINC000290647516 523784403 /nfs/dbraw/zinc/78/44/03/523784403.db2.gz YYGZWDKAZMGMNP-CQSZACIVSA-N 2 0 292.398 2.695 20 10 CFCDRP Cc1cccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1O ZINC000290525285 524396662 /nfs/dbraw/zinc/39/66/62/524396662.db2.gz QFYFCRCDMVHHOZ-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP C[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000293734421 524500947 /nfs/dbraw/zinc/50/09/47/524500947.db2.gz QIIJEGWWDAHAHE-ZIAGYGMSSA-N 2 0 263.429 2.601 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000156092551 525344935 /nfs/dbraw/zinc/34/49/35/525344935.db2.gz UFSRLXYMYSFJBE-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000045663885 525359999 /nfs/dbraw/zinc/35/99/99/525359999.db2.gz DTVJVABQLXYNER-CYBMUJFWSA-N 2 0 250.386 2.693 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c1 ZINC000049553874 525361416 /nfs/dbraw/zinc/36/14/16/525361416.db2.gz GKQBPAZUCDEVNY-QWHCGFSZSA-N 2 0 250.386 2.691 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649021 525363050 /nfs/dbraw/zinc/36/30/50/525363050.db2.gz UQVBBUDVRYXAIR-ZIAGYGMSSA-N 2 0 274.408 2.836 20 10 CFCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccccc1O ZINC000062077559 525491312 /nfs/dbraw/zinc/49/13/12/525491312.db2.gz DOPAMAJBKGHAMK-UONOGXRCSA-N 2 0 262.397 2.775 20 10 CFCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(O)ccc3ccncc32)C1 ZINC000743398348 574362746 /nfs/dbraw/zinc/36/27/46/574362746.db2.gz DGFDWFOUUTXZKY-AWEZNQCLSA-N 2 0 299.418 2.714 20 10 CFCDRP [NH3+]C1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000051694179 618049415 /nfs/dbraw/zinc/04/94/15/618049415.db2.gz AALRJANPVVSPAR-UHFFFAOYSA-N 2 0 273.424 2.646 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c1O ZINC000894193389 618435473 /nfs/dbraw/zinc/43/54/73/618435473.db2.gz PYKGBRJPZSPKJL-AWEZNQCLSA-N 2 0 292.423 2.531 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000066057125 618439840 /nfs/dbraw/zinc/43/98/40/618439840.db2.gz FEYOTYWAXLRUNT-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC[C@@H](C)[NH+](C)C)cc1Cl ZINC000895292270 618514883 /nfs/dbraw/zinc/51/48/83/618514883.db2.gz OVGOYLDXKUIBQK-LLVKDONJSA-N 2 0 270.804 2.784 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)cc1 ZINC000925511884 618850812 /nfs/dbraw/zinc/85/08/12/618850812.db2.gz WCPXIWDAEPQTKY-HUUCEWRRSA-N 2 0 275.440 2.748 20 10 CFCDRP CCC1([NH3+])CC[NH+]([C@@H](C)c2ccc(C)cc2O)CC1 ZINC000925757508 619067185 /nfs/dbraw/zinc/06/71/85/619067185.db2.gz HVZKUWUVVYBIPE-ZDUSSCGKSA-N 2 0 262.397 2.965 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC[NH2+]CC1 ZINC000094011574 619072133 /nfs/dbraw/zinc/07/21/33/619072133.db2.gz KEROYRZSVCLUQI-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1C ZINC000925784304 619108937 /nfs/dbraw/zinc/10/89/37/619108937.db2.gz QOECSJCAZVDMIL-STQMWFEESA-N 2 0 298.377 2.904 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925796931 619119173 /nfs/dbraw/zinc/11/91/73/619119173.db2.gz MGQYOMFZLKQTHA-SFTQSGBHSA-N 2 0 292.398 2.915 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925796927 619119205 /nfs/dbraw/zinc/11/92/05/619119205.db2.gz MGQYOMFZLKQTHA-HKUMRIAESA-N 2 0 292.398 2.915 20 10 CFCDRP CC[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccccc1O ZINC000925845608 619177453 /nfs/dbraw/zinc/17/74/53/619177453.db2.gz MOHUQAFKCMTVDS-DJIMGWMZSA-N 2 0 274.408 2.965 20 10 CFCDRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c1O ZINC000894315015 619329614 /nfs/dbraw/zinc/32/96/14/619329614.db2.gz ANZRDQGJDZEMFY-HUUCEWRRSA-N 2 0 292.423 2.672 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)c1 ZINC000895557425 619554834 /nfs/dbraw/zinc/55/48/34/619554834.db2.gz PRJSYSSDOZWNHJ-HNNXBMFYSA-N 2 0 297.402 2.806 20 10 CFCDRP CCN1CCC[C@@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC000035052656 620070085 /nfs/dbraw/zinc/07/00/85/620070085.db2.gz MJNJNHZDFBRUJG-OAHLLOKOSA-N 2 0 262.397 2.578 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+]Cc1cc(Cl)ccc1O ZINC000841029808 620257213 /nfs/dbraw/zinc/25/72/13/620257213.db2.gz AWBPQJVXXLPJJH-UHFFFAOYSA-N 2 0 256.777 2.653 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H](N)c2ccc(N(C)C)cc2)cc1 ZINC000841041886 620399512 /nfs/dbraw/zinc/39/95/12/620399512.db2.gz FYVLBCXKJBIJIS-SFHVURJKSA-N 2 0 299.418 2.551 20 10 CFCDRP Cc1cccc(C[N@H+](C)CCCCCC[NH3+])c1O ZINC000873231602 620437133 /nfs/dbraw/zinc/43/71/33/620437133.db2.gz RJLVAXMYVUDORU-UHFFFAOYSA-N 2 0 250.386 2.652 20 10 CFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@]1(C)CCC[NH2+]C1 ZINC000904302071 621569065 /nfs/dbraw/zinc/56/90/65/621569065.db2.gz QQZLQFKJKMVOSQ-SFHVURJKSA-N 2 0 289.467 2.964 20 10 CFCDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904409848 621591182 /nfs/dbraw/zinc/59/11/82/621591182.db2.gz KCDQFCXBNUHBOE-QGZVFWFLSA-N 2 0 287.451 2.848 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)c(Cl)c1 ZINC000904412029 621593398 /nfs/dbraw/zinc/59/33/98/621593398.db2.gz ZTWHAHXQPCFMLS-RYUDHWBXSA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2CC[NH+](C(C)C)CC2)c1 ZINC000071406735 625512741 /nfs/dbraw/zinc/51/27/41/625512741.db2.gz FYLPRVSWFVPOBW-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000044534193 622918425 /nfs/dbraw/zinc/91/84/25/622918425.db2.gz YSAMYUWTTOGDLH-ZIAGYGMSSA-N 2 0 262.397 2.693 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000044533405 622918577 /nfs/dbraw/zinc/91/85/77/622918577.db2.gz LSKKBZANAMIRDA-UONOGXRCSA-N 2 0 262.397 2.693 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000044517538 622918639 /nfs/dbraw/zinc/91/86/39/622918639.db2.gz FUSICJRPWMVAKH-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCCC[NH+](C)C)cc1Cl ZINC000825167699 623642841 /nfs/dbraw/zinc/64/28/41/623642841.db2.gz PDFVZTPLHWHTIX-UHFFFAOYSA-N 2 0 270.804 2.785 20 10 CFCDRP Cc1cc(O)c(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC000825986710 623778908 /nfs/dbraw/zinc/77/89/08/623778908.db2.gz NCRSPMSDMZCQJP-MRXNPFEDSA-N 2 0 294.826 2.882 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c(O)c1C ZINC000817977407 625972874 /nfs/dbraw/zinc/97/28/74/625972874.db2.gz JQLYPYWQWNUFPJ-AAEUAGOBSA-N 2 0 250.386 2.787 20 10 CFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921620386 625998542 /nfs/dbraw/zinc/99/85/42/625998542.db2.gz TVUJVPBOVDMNMG-INIZCTEOSA-N 2 0 288.435 2.832 20 10 CFCDRP C[NH+](C)C1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000922192878 626236941 /nfs/dbraw/zinc/23/69/41/626236941.db2.gz ZDIMMSZEMKGBDU-UHFFFAOYSA-N 2 0 288.435 2.974 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000923328371 626465894 /nfs/dbraw/zinc/46/58/94/626465894.db2.gz SMKFPERSENIPLT-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000839180397 626529832 /nfs/dbraw/zinc/52/98/32/626529832.db2.gz CTCCDBADQUQYAS-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000839183297 626529973 /nfs/dbraw/zinc/52/99/73/626529973.db2.gz VYJVJFKNXITKIG-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C)CC1 ZINC000771819447 627633967 /nfs/dbraw/zinc/63/39/67/627633967.db2.gz PKYHRDWZZDXXLO-HNNXBMFYSA-N 2 0 287.451 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4[C@H](C3)C4(C)C)cc2)CC1 ZINC000775718006 628058108 /nfs/dbraw/zinc/05/81/08/628058108.db2.gz KTELEDQWDUTOCK-HDICACEKSA-N 2 0 299.462 2.526 20 10 CFCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775715803 628058374 /nfs/dbraw/zinc/05/83/74/628058374.db2.gz LORMGGQJBLPHIL-CVEARBPZSA-N 2 0 287.451 2.669 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000835043245 629336900 /nfs/dbraw/zinc/33/69/00/629336900.db2.gz RIFWPRNOXOUVSR-SNAWJCMRSA-N 2 0 285.435 2.617 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]3C3CC3)cc2)CC1 ZINC000797905873 630121812 /nfs/dbraw/zinc/12/18/12/630121812.db2.gz RGFHDKRJTWCOGI-RTBURBONSA-N 2 0 299.462 2.717 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000840911219 631261181 /nfs/dbraw/zinc/26/11/81/631261181.db2.gz XSMAYMWVCMJACG-UHFFFAOYSA-N 2 0 289.467 2.835 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000840910079 631261234 /nfs/dbraw/zinc/26/12/34/631261234.db2.gz KQFITPRGCLMEFI-INIZCTEOSA-N 2 0 289.467 2.835 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000841027997 631308851 /nfs/dbraw/zinc/30/88/51/631308851.db2.gz IURSXYIEHZFKTH-YOEHRIQHSA-N 2 0 275.440 2.668 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2CC[NH2+]CC2)cc1F ZINC000841026890 631308905 /nfs/dbraw/zinc/30/89/05/631308905.db2.gz UYFKPUNXSRNLTM-UHFFFAOYSA-N 2 0 279.403 2.514 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000841027994 631309041 /nfs/dbraw/zinc/30/90/41/631309041.db2.gz IURSXYIEHZFKTH-PBHICJAKSA-N 2 0 275.440 2.668 20 10 CFCDRP c1cc(N2CCCCC2)ccc1CNC[C@H]1CCCC[NH2+]1 ZINC000841033417 631313442 /nfs/dbraw/zinc/31/34/42/631313442.db2.gz UIUBJGDYNYMCTI-QGZVFWFLSA-N 2 0 287.451 2.909 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000841064071 631327497 /nfs/dbraw/zinc/32/74/97/631327497.db2.gz OWFLLHSXWWZJDQ-PBHICJAKSA-N 2 0 275.440 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1F ZINC000841066272 631329731 /nfs/dbraw/zinc/32/97/31/631329731.db2.gz YZCWLMNUYJNXQR-UHFFFAOYSA-N 2 0 293.430 2.904 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1C ZINC000841073105 631330161 /nfs/dbraw/zinc/33/01/61/631330161.db2.gz QCQPVKXATZJEKO-OAHLLOKOSA-N 2 0 262.397 2.631 20 10 CFCDRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841073963 631330756 /nfs/dbraw/zinc/33/07/56/631330756.db2.gz KNMKHMQOFPZSAI-GIOYIUAESA-N 2 0 299.462 2.892 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@H]2CC[NH2+]CC2(C)C)cc1 ZINC000841072983 631331228 /nfs/dbraw/zinc/33/12/28/631331228.db2.gz OLQUOQGYTICOEJ-OSJSJHBBSA-N 2 0 287.451 2.744 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1O ZINC000841085218 631334548 /nfs/dbraw/zinc/33/45/48/631334548.db2.gz XBFPUDYCUBPQMR-GXFFZTMASA-N 2 0 268.788 2.571 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1C ZINC000841086763 631336032 /nfs/dbraw/zinc/33/60/32/631336032.db2.gz LLVCDEGIHNYLMD-WBVHZDCISA-N 2 0 288.435 2.973 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1C ZINC000841089946 631337523 /nfs/dbraw/zinc/33/75/23/631337523.db2.gz RWYKTAFLQQYLSZ-HNNXBMFYSA-N 2 0 274.408 2.768 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CCC[NH2+]C2CC2)c1O ZINC000841091821 631338812 /nfs/dbraw/zinc/33/88/12/631338812.db2.gz HBTVLZPVOFSGEV-UHFFFAOYSA-N 2 0 268.788 2.586 20 10 CFCDRP CSC1(C[NH2+][C@H](C)c2ccccc2O)CC[NH+](C)CC1 ZINC000810252675 631350077 /nfs/dbraw/zinc/35/00/77/631350077.db2.gz SHOQCTOPTVBOIC-CYBMUJFWSA-N 2 0 294.464 2.870 20 10 CFCDRP C[C@@H]([NH3+])C1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000843048825 631815631 /nfs/dbraw/zinc/81/56/31/631815631.db2.gz ZNMDMWNQOWOYTL-MBVDDHJVSA-N 2 0 287.451 2.825 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CC[C@H]1[NH3+] ZINC000843053133 631818057 /nfs/dbraw/zinc/81/80/57/631818057.db2.gz XQPIYTGNMKBFTE-GXFFZTMASA-N 2 0 268.788 2.605 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(OCC)ccc2O)CC1 ZINC000843055372 631819007 /nfs/dbraw/zinc/81/90/07/631819007.db2.gz INNUDOUCIGMTBK-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CCOc1ccc(O)c(C[NH+]2CCC(CC[NH2+]C)CC2)c1 ZINC000843057460 631820214 /nfs/dbraw/zinc/82/02/14/631820214.db2.gz MXOOCBSLZMHIED-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000843056348 631820736 /nfs/dbraw/zinc/82/07/36/631820736.db2.gz YPQCJXLLKVMMFD-UHFFFAOYSA-N 2 0 276.424 2.831 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1O ZINC000843057557 631820741 /nfs/dbraw/zinc/82/07/41/631820741.db2.gz KAFBJFYPCZCXCD-QWRGUYRKSA-N 2 0 268.788 2.523 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000843118704 631840221 /nfs/dbraw/zinc/84/02/21/631840221.db2.gz MZQQEOUEIYILFD-UABKOXTMSA-N 2 0 299.462 2.841 20 10 CFCDRP CCCC[N@H+](Cc1ccccc1O)CC(C)(C)[NH3+] ZINC000843119101 631840393 /nfs/dbraw/zinc/84/03/93/631840393.db2.gz BRMFFELWOXUYRF-UHFFFAOYSA-N 2 0 250.386 2.732 20 10 CFCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CC([NH3+])C1 ZINC000843125451 631845319 /nfs/dbraw/zinc/84/53/19/631845319.db2.gz WXFCIAPAUZPHAH-UHFFFAOYSA-N 2 0 273.424 2.598 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCCCCC[NH3+] ZINC000843127651 631846520 /nfs/dbraw/zinc/84/65/20/631846520.db2.gz FUACGHZGAFWBBE-UHFFFAOYSA-N 2 0 263.429 2.670 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000843128279 631847970 /nfs/dbraw/zinc/84/79/70/631847970.db2.gz VMFJOQGIWORFOM-CYBMUJFWSA-N 2 0 294.826 2.867 20 10 CFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1F ZINC000843129036 631849409 /nfs/dbraw/zinc/84/94/09/631849409.db2.gz PLRZUUWAQBOKKA-UHFFFAOYSA-N 2 0 287.382 2.640 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000843341398 631931291 /nfs/dbraw/zinc/93/12/91/631931291.db2.gz DOFOJUCFXKTMCO-KZNAEPCWSA-N 2 0 299.462 2.765 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCCCCC[NH3+])c1 ZINC000843342283 631932367 /nfs/dbraw/zinc/93/23/67/631932367.db2.gz PNNLISJTNDBCNQ-GFCCVEGCSA-N 2 0 266.385 2.571 20 10 CFCDRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000813877524 631971116 /nfs/dbraw/zinc/97/11/16/631971116.db2.gz YNYQUSAXUOTKLR-YOEHRIQHSA-N 2 0 277.456 2.991 20 10 CFCDRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000844923478 632337576 /nfs/dbraw/zinc/33/75/76/632337576.db2.gz SENOULQNOYLWQY-ZDUSSCGKSA-N 2 0 261.413 2.532 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)ccc1O ZINC000844924758 632338468 /nfs/dbraw/zinc/33/84/68/632338468.db2.gz QGZKFCMUNPPZHO-SNVBAGLBSA-N 2 0 292.329 2.980 20 10 CFCDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816509878 632475941 /nfs/dbraw/zinc/47/59/41/632475941.db2.gz FPTCBCUZBMNVHE-CQSZACIVSA-N 2 0 284.403 2.929 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000846141793 632644331 /nfs/dbraw/zinc/64/43/31/632644331.db2.gz SYZJKYIOWOHYAH-IHRRRGAJSA-N 2 0 290.407 2.678 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000846168276 632652041 /nfs/dbraw/zinc/65/20/41/632652041.db2.gz JAKCENNMEIJHAS-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP C[N@H+](Cc1ccc2c(c1)C[NH2+]CC2)Cc1ccccc1O ZINC000846218755 632664642 /nfs/dbraw/zinc/66/46/42/632664642.db2.gz UMLDPOIADLYNBH-UHFFFAOYSA-N 2 0 282.387 2.670 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1 ZINC000817865152 632714836 /nfs/dbraw/zinc/71/48/36/632714836.db2.gz JJUWSTVTQFPSDA-GUTXKFCHSA-N 2 0 292.423 2.596 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000817894371 632719698 /nfs/dbraw/zinc/71/96/98/632719698.db2.gz MGXZOJOLZXKJRI-DLBZAZTESA-N 2 0 275.440 2.811 20 10 CFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000817896992 632720640 /nfs/dbraw/zinc/72/06/40/632720640.db2.gz BBBLMARVXDHCMJ-GJZGRUSLSA-N 2 0 275.440 2.892 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901500 632725953 /nfs/dbraw/zinc/72/59/53/632725953.db2.gz WMHMCRJVSVTCIE-CQSZACIVSA-N 2 0 275.440 2.676 20 10 CFCDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc2ccccc2c1O ZINC000817936951 632741719 /nfs/dbraw/zinc/74/17/19/632741719.db2.gz SMYIXLBWUIBVFO-GFCCVEGCSA-N 2 0 270.376 2.948 20 10 CFCDRP [NH3+]C1(C[NH2+][C@H]2CCc3cccc(O)c32)CCCCC1 ZINC000817938218 632742698 /nfs/dbraw/zinc/74/26/98/632742698.db2.gz GXNPZRXJZFVZSI-ZDUSSCGKSA-N 2 0 260.381 2.631 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH3+])c1ccc(C(F)(F)F)cc1O ZINC000817938044 632742945 /nfs/dbraw/zinc/74/29/45/632742945.db2.gz CIYTUSDYJLYYIV-LLVKDONJSA-N 2 0 276.302 2.801 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000817942748 632746206 /nfs/dbraw/zinc/74/62/06/632746206.db2.gz DFXHXWQYHPVPQF-JQWIXIFHSA-N 2 0 266.360 2.669 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000817943963 632746617 /nfs/dbraw/zinc/74/66/17/632746617.db2.gz TXFLFFJRPJJBNU-SNVBAGLBSA-N 2 0 256.777 2.696 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC000817946635 632748737 /nfs/dbraw/zinc/74/87/37/632748737.db2.gz BZLJGOPPPSVIRI-IHRRRGAJSA-N 2 0 262.397 2.739 20 10 CFCDRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817951088 632751423 /nfs/dbraw/zinc/75/14/23/632751423.db2.gz AYOVIQCNUCQJDX-RYUDHWBXSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(C)cc1O ZINC000817954432 632754080 /nfs/dbraw/zinc/75/40/80/632754080.db2.gz CWJXZGNBNBBOEO-ZFWWWQNUSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817955011 632755119 /nfs/dbraw/zinc/75/51/19/632755119.db2.gz OODUWQRFYDCQTI-KBPBESRZSA-N 2 0 288.435 2.921 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000817956780 632755702 /nfs/dbraw/zinc/75/57/02/632755702.db2.gz CRTNLMASJCSFBG-DLBZAZTESA-N 2 0 267.376 2.546 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2([NH3+])CCC2)cc1 ZINC000817965661 632763851 /nfs/dbraw/zinc/76/38/51/632763851.db2.gz YZFWZDDZSDGSKC-ZDUSSCGKSA-N 2 0 261.413 2.675 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817965722 632764318 /nfs/dbraw/zinc/76/43/18/632764318.db2.gz UMXWUEYGWCFZQP-HZPDHXFCSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc2ccccc2c1O ZINC000817966011 632764425 /nfs/dbraw/zinc/76/44/25/632764425.db2.gz ZBJJOGOXHVLYCF-MEDUHNTESA-N 2 0 270.376 2.933 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]([NH3+])C2CC2)c1O ZINC000817966033 632764517 /nfs/dbraw/zinc/76/45/17/632764517.db2.gz ZLRLTYLTLGTFKU-ZANVPECISA-N 2 0 268.788 2.742 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000817966123 632765402 /nfs/dbraw/zinc/76/54/02/632765402.db2.gz GVVOCNDZRSXXBE-CZUORRHYSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c(O)c1 ZINC000817967015 632766132 /nfs/dbraw/zinc/76/61/32/632766132.db2.gz CGVDQNZWIGQAGJ-CYBMUJFWSA-N 2 0 260.381 2.579 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c1O ZINC000817967154 632766370 /nfs/dbraw/zinc/76/63/70/632766370.db2.gz DGMRCUPLKFNVRT-LLVKDONJSA-N 2 0 280.799 2.924 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968194 632767616 /nfs/dbraw/zinc/76/76/16/632767616.db2.gz HJACYCNHRQREOI-PWSUYJOCSA-N 2 0 268.788 2.838 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000817970830 632770261 /nfs/dbraw/zinc/77/02/61/632770261.db2.gz FTZLZTZYPWMHGD-AAXDQBDMSA-N 2 0 278.371 2.667 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000817972616 632771632 /nfs/dbraw/zinc/77/16/32/632771632.db2.gz YNAUFPXAWSZPGC-ZQIUZPCESA-N 2 0 275.440 2.791 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000817972291 632772411 /nfs/dbraw/zinc/77/24/11/632772411.db2.gz VXPYIEKGKFERCJ-IJEWVQPXSA-N 2 0 275.440 2.934 20 10 CFCDRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccccc1O ZINC000817976194 632774185 /nfs/dbraw/zinc/77/41/85/632774185.db2.gz HSZJSOQTOBZVIY-UKRRQHHQSA-N 2 0 260.381 2.575 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccccc1O ZINC000817976122 632774291 /nfs/dbraw/zinc/77/42/91/632774291.db2.gz GOBBMQUAUSAFNO-JSGCOSHPSA-N 2 0 250.386 2.950 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000817976713 632774441 /nfs/dbraw/zinc/77/44/41/632774441.db2.gz SCHZJUYAJZIENZ-OSMZGAPFSA-N 2 0 290.382 2.811 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000817978999 632776215 /nfs/dbraw/zinc/77/62/15/632776215.db2.gz GHJJQXXGHYVDDQ-MWLCHTKSSA-N 2 0 256.777 2.742 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c(O)c1 ZINC000817981944 632778761 /nfs/dbraw/zinc/77/87/61/632778761.db2.gz OSXZRVOLFLRNRN-BFHYXJOUSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817983897 632779938 /nfs/dbraw/zinc/77/99/38/632779938.db2.gz KZOROGVXJQRXHV-AWEZNQCLSA-N 2 0 273.424 2.713 20 10 CFCDRP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N(C)C)cc1 ZINC000817983591 632780050 /nfs/dbraw/zinc/78/00/50/632780050.db2.gz GURLGTDTLZOYGL-ZDUSSCGKSA-N 2 0 261.413 2.545 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817984977 632781382 /nfs/dbraw/zinc/78/13/82/632781382.db2.gz DJWSLGNCFSUGEK-FZMZJTMJSA-N 2 0 290.382 2.979 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(F)ccc1O ZINC000817985153 632781940 /nfs/dbraw/zinc/78/19/40/632781940.db2.gz BDNQDCNYQHBZOC-KZVDOYCCSA-N 2 0 278.371 2.570 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000848562641 633290047 /nfs/dbraw/zinc/29/00/47/633290047.db2.gz KDTWXRYDFDNOJI-NEGGSPHPSA-N 2 0 287.451 2.696 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000848721412 633324105 /nfs/dbraw/zinc/32/41/05/633324105.db2.gz COOKPYBXJMGQJA-XIRDDKMYSA-N 2 0 289.467 2.852 20 10 CFCDRP COc1cc(C[NH2+]CCC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000850008435 633789578 /nfs/dbraw/zinc/78/95/78/633789578.db2.gz SNWQZHKGGHULBM-UHFFFAOYSA-N 2 0 294.439 2.740 20 10 CFCDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000865765940 638562447 /nfs/dbraw/zinc/56/24/47/638562447.db2.gz SXPJBULRNOYPJR-UHFFFAOYSA-N 2 0 288.435 2.974 20 10 CFCDRP Oc1ccccc1C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873233044 642086239 /nfs/dbraw/zinc/08/62/39/642086239.db2.gz XHMSCKBEUMAGMX-MRXNPFEDSA-N 2 0 274.408 2.794 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000873244811 642093565 /nfs/dbraw/zinc/09/35/65/642093565.db2.gz OFWIEXRHICUQOC-KBPBESRZSA-N 2 0 274.408 2.747 20 10 CFCDRP COc1cccc(C[NH2+]CCC[NH+]2CCC(C)CC2)c1O ZINC000020146285 642306419 /nfs/dbraw/zinc/30/64/19/642306419.db2.gz LGIWOLNPQIVEIZ-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP Cc1ccc(C[NH2+]CCC[N@@H+](C)C(C)C)c(O)c1 ZINC000876917621 643063965 /nfs/dbraw/zinc/06/39/65/643063965.db2.gz FFPOUKWEZHOXAX-UHFFFAOYSA-N 2 0 250.386 2.521 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c(O)c1 ZINC000877552109 643351994 /nfs/dbraw/zinc/35/19/94/643351994.db2.gz QNUITXFKDLIITH-KRWDZBQOSA-N 2 0 274.408 2.618 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000246076510 650851598 /nfs/dbraw/zinc/85/15/98/650851598.db2.gz FLCOYASYLRYODY-XJKSGUPXSA-N 2 0 293.430 2.712 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)cc1 ZINC000878865933 644055829 /nfs/dbraw/zinc/05/58/29/644055829.db2.gz FQTPUNGZHVGICA-UHFFFAOYSA-N 2 0 287.451 2.670 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccccc1O ZINC000879651642 644365268 /nfs/dbraw/zinc/36/52/68/644365268.db2.gz FFZRURXFBKSCDH-UONOGXRCSA-N 2 0 262.397 2.917 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CCC(C)(C)[NH3+])c(O)c1 ZINC000925737758 648304225 /nfs/dbraw/zinc/30/42/25/648304225.db2.gz KUWDBVZOYDUTNF-GFCCVEGCSA-N 2 0 250.386 2.787 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000692873820 776468053 /nfs/dbraw/zinc/46/80/53/776468053.db2.gz RRHMRHRXGQVUGK-OAHLLOKOSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1cccc(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c1O ZINC001231594892 777272908 /nfs/dbraw/zinc/27/29/08/777272908.db2.gz MQNGZJQLUFHIRS-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP Cc1cc(N2CC[NH+](Cc3cccc(C)c3O)CC2)cc[nH+]1 ZINC001231594490 777273867 /nfs/dbraw/zinc/27/38/67/777273867.db2.gz GMIIYYOTQVQVAG-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP Cc1cc(C)c(C[N@H+](C)CC2CC[NH+](C)CC2)c(O)c1 ZINC001231843840 777347518 /nfs/dbraw/zinc/34/75/18/777347518.db2.gz BRVQOQAJRWMIDM-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC001231883682 777365444 /nfs/dbraw/zinc/36/54/44/777365444.db2.gz NDAMANLPJULYAQ-CALCHBBNSA-N 2 0 296.414 2.929 20 10 CFCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]2C1 ZINC001233287148 777867887 /nfs/dbraw/zinc/86/78/87/777867887.db2.gz YNKOKGMGKDHEBH-GASCZTMLSA-N 2 0 288.435 2.683 20 10 CFCDRP Cc1c(C[N@H+](C)CC2CC[NH2+]CC2)c2ccccc2n1C ZINC001235433769 778487880 /nfs/dbraw/zinc/48/78/80/778487880.db2.gz PECDXKITEZEUBQ-UHFFFAOYSA-N 2 0 285.435 2.918 20 10 CFCDRP Cc1cc(C[N@H+](C)CCC[NH3+])c(C)n1-c1ccccc1 ZINC001235435556 778489455 /nfs/dbraw/zinc/48/94/55/778489455.db2.gz PABQVLKNHHTQTJ-UHFFFAOYSA-N 2 0 271.408 2.875 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001235893735 778594991 /nfs/dbraw/zinc/59/49/91/778594991.db2.gz RKEPWJZECQWEES-MJGOQNOKSA-N 2 0 299.462 2.861 20 10 CFCDRP CCc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)c(O)c1 ZINC001236790290 778936995 /nfs/dbraw/zinc/93/69/95/778936995.db2.gz VGMFVJDAHDXBJY-UHFFFAOYSA-N 2 0 276.424 2.728 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)ccc1N(C)C ZINC001237386795 779090982 /nfs/dbraw/zinc/09/09/82/779090982.db2.gz AHJGWQBPACCMMO-SJORKVTESA-N 2 0 287.451 2.635 20 10 CFCDRP Cc1cc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237404629 779097386 /nfs/dbraw/zinc/09/73/86/779097386.db2.gz ODLWUAHCDFQJEL-GOEBONIOSA-N 2 0 274.408 2.583 20 10 CFCDRP CC(C)c1ccc(C[NH+]2CCC(C[NH3+])CC2)c(O)c1 ZINC001205053961 780646896 /nfs/dbraw/zinc/64/68/96/780646896.db2.gz XLADZAXHVSFTDL-UHFFFAOYSA-N 2 0 262.397 2.686 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(F)ccc2O)[C@H](C)C1 ZINC000180194761 380631465 /nfs/dbraw/zinc/63/14/65/380631465.db2.gz QDLGQPDIELSQJY-DOMZBBRYSA-N 2 0 280.387 2.693 20 10 CFCDRP C[NH+](C)CCC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000179970220 380602887 /nfs/dbraw/zinc/60/28/87/380602887.db2.gz QUROCHIHHNLRPK-UHFFFAOYSA-N 2 0 280.387 2.695 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185671610 381699367 /nfs/dbraw/zinc/69/93/67/381699367.db2.gz PJUKELASXVXKSM-OCCSQVGLSA-N 2 0 298.402 2.539 20 10 CFCDRP Cc1cccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)c1O ZINC000366283113 382497493 /nfs/dbraw/zinc/49/74/93/382497493.db2.gz MOLDSQLCHRZRBF-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[NH+](C)C)c(O)c1C ZINC000273369935 385679709 /nfs/dbraw/zinc/67/97/09/385679709.db2.gz FVSUSPKOVJZAKX-ZDUSSCGKSA-N 2 0 250.386 2.611 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000179587012 285398309 /nfs/dbraw/zinc/39/83/09/285398309.db2.gz DCSMWMGYDVSDDP-RHSMWYFYSA-N 2 0 286.419 2.841 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000157503530 292166066 /nfs/dbraw/zinc/16/60/66/292166066.db2.gz GYWCQFKSRNUHLK-SOUVJXGZSA-N 2 0 274.408 2.978 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000020189516 171056215 /nfs/dbraw/zinc/05/62/15/171056215.db2.gz UNQJPXXICSSPKS-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000278129482 521697379 /nfs/dbraw/zinc/69/73/79/521697379.db2.gz BWNDKGCUXWMNOQ-QZTJIDSGSA-N 2 0 287.451 2.989 20 10 CFCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]2C1 ZINC000194540335 524017704 /nfs/dbraw/zinc/01/77/04/524017704.db2.gz YHTLEHQEPRMTKX-HDICACEKSA-N 2 0 299.462 2.670 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1O ZINC000224492570 524407001 /nfs/dbraw/zinc/40/70/01/524407001.db2.gz DNGLCSNTEOFYGO-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000037786570 524750848 /nfs/dbraw/zinc/75/08/48/524750848.db2.gz PJJPDKHGBMDSSJ-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000290421432 525342433 /nfs/dbraw/zinc/34/24/33/525342433.db2.gz KRRKHXFLXUUZRM-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1nccn1CCC[NH2+][C@H](C)c1cc(F)cc(F)c1[O-] ZINC000756432128 574236405 /nfs/dbraw/zinc/23/64/05/574236405.db2.gz HQJBULRWZCHNEZ-SNVBAGLBSA-N 2 0 295.333 2.916 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1O ZINC000902484574 621111032 /nfs/dbraw/zinc/11/10/32/621111032.db2.gz GHRPUKWWWLXIAI-CKYFFXLPSA-N 2 0 268.788 2.742 20 10 CFCDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000903979137 621494082 /nfs/dbraw/zinc/49/40/82/621494082.db2.gz WMALEASPMBGWJX-GWOVIKRFSA-N 2 0 287.451 2.601 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)cc1 ZINC000904444515 621598931 /nfs/dbraw/zinc/59/89/31/621598931.db2.gz QOKARHCWPNRTSI-UHFFFAOYSA-N 2 0 289.467 2.950 20 10 CFCDRP COc1ccc(O)c(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)c1 ZINC000904443453 621598994 /nfs/dbraw/zinc/59/89/94/621598994.db2.gz KRGLBPYUPUDVOR-UHFFFAOYSA-N 2 0 292.423 2.598 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c1O ZINC000841101602 623052004 /nfs/dbraw/zinc/05/20/04/623052004.db2.gz WKHSIZFNKNBNHL-GXFFZTMASA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c1O ZINC000841101604 623052827 /nfs/dbraw/zinc/05/28/27/623052827.db2.gz WKHSIZFNKNBNHL-ZWNOBZJWSA-N 2 0 282.815 2.771 20 10 CFCDRP COc1cc(Cl)cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c1O ZINC000229103552 623183124 /nfs/dbraw/zinc/18/31/24/623183124.db2.gz BZCMHHQOAMCSRB-JTQLQIEISA-N 2 0 298.814 2.613 20 10 CFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000083552285 625977489 /nfs/dbraw/zinc/97/74/89/625977489.db2.gz IEEUATMPWLNJST-GFCCVEGCSA-N 2 0 282.815 2.866 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000921546497 625981848 /nfs/dbraw/zinc/98/18/48/625981848.db2.gz DYYJPFDZKBVRGU-IRXDYDNUSA-N 2 0 286.419 2.728 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000839183486 626529945 /nfs/dbraw/zinc/52/99/45/626529945.db2.gz WXVHHUGBQYCSCR-MRXNPFEDSA-N 2 0 275.440 2.574 20 10 CFCDRP CCOc1cccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000839182904 626530012 /nfs/dbraw/zinc/53/00/12/626530012.db2.gz RIKBBZVJQCIPRF-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP CCC[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CC[NH2+]CC1 ZINC000843044992 626547074 /nfs/dbraw/zinc/54/70/74/626547074.db2.gz PBMBPBNYKWEMEC-UHFFFAOYSA-N 2 0 293.430 2.856 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)C1CCC([NH3+])CC1 ZINC000843055318 626549562 /nfs/dbraw/zinc/54/95/62/626549562.db2.gz YBYQARVACSWNMQ-UHFFFAOYSA-N 2 0 275.440 2.763 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000757674029 626557558 /nfs/dbraw/zinc/55/75/58/626557558.db2.gz OERKCHMRELRENG-OAHLLOKOSA-N 2 0 294.439 2.710 20 10 CFCDRP CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771824962 627634450 /nfs/dbraw/zinc/63/44/50/627634450.db2.gz UFQPJBXLHOWMHF-JKSUJKDBSA-N 2 0 289.467 2.963 20 10 CFCDRP CC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775638529 628048495 /nfs/dbraw/zinc/04/84/95/628048495.db2.gz JSOJOMGMFKIQBO-UHFFFAOYSA-N 2 0 287.451 2.670 20 10 CFCDRP CC(C)CC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775650000 628050254 /nfs/dbraw/zinc/05/02/54/628050254.db2.gz WGVYOQVVJLDNJP-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP C[C@@H]1CC[C@@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737528 628061310 /nfs/dbraw/zinc/06/13/10/628061310.db2.gz OGROOFYMKKRCTP-HZPDHXFCSA-N 2 0 287.451 2.811 20 10 CFCDRP CC(C)[C@H]1CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775766378 628064062 /nfs/dbraw/zinc/06/40/62/628064062.db2.gz XGJHIPHRQKQOLY-GOSISDBHSA-N 2 0 287.451 2.669 20 10 CFCDRP CCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775803050 628070806 /nfs/dbraw/zinc/07/08/06/628070806.db2.gz BWPNNDKWYFQKGB-HNNXBMFYSA-N 2 0 275.440 2.717 20 10 CFCDRP C[C@H](CC1CC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000776174467 628111347 /nfs/dbraw/zinc/11/13/47/628111347.db2.gz ATJIDZSGKTYGPH-OAHLLOKOSA-N 2 0 287.451 2.717 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000835038422 629333091 /nfs/dbraw/zinc/33/30/91/629333091.db2.gz RTHPYFJOGQOPFD-SNAWJCMRSA-N 2 0 287.451 2.697 20 10 CFCDRP CCOc1cccc(C[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000835061546 629364449 /nfs/dbraw/zinc/36/44/49/629364449.db2.gz IADKBLPDEUUGBL-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000796673388 629948793 /nfs/dbraw/zinc/94/87/93/629948793.db2.gz CIOMAUFTALAOBT-KZNAEPCWSA-N 2 0 287.451 2.715 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840881614 631249938 /nfs/dbraw/zinc/24/99/38/631249938.db2.gz OWRBKIZFKKGEEH-GFCCVEGCSA-N 2 0 282.815 2.785 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000841032413 631312086 /nfs/dbraw/zinc/31/20/86/631312086.db2.gz BVRVIXJOYAXIIH-DOTOQJQBSA-N 2 0 287.451 2.765 20 10 CFCDRP c1cc(N2CCCCC2)ccc1CNC[C@@H]1CCCC[NH2+]1 ZINC000841033416 631314009 /nfs/dbraw/zinc/31/40/09/631314009.db2.gz UIUBJGDYNYMCTI-KRWDZBQOSA-N 2 0 287.451 2.909 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000841034306 631314577 /nfs/dbraw/zinc/31/45/77/631314577.db2.gz CHODSDXOOGKYKB-INIZCTEOSA-N 2 0 275.440 2.622 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1F ZINC000841061986 631327658 /nfs/dbraw/zinc/32/76/58/631327658.db2.gz PLBIBUOWXXSJFO-UKRRQHHQSA-N 2 0 293.430 2.902 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1O ZINC000841062250 631327676 /nfs/dbraw/zinc/32/76/76/631327676.db2.gz UQJODMPGLOYHJV-ZWNOBZJWSA-N 2 0 268.788 2.584 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000841077659 631331715 /nfs/dbraw/zinc/33/17/15/631331715.db2.gz AHTMEKYBZJOBJB-DDJMYBDESA-N 2 0 275.440 2.873 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c(Cl)c1 ZINC000841078134 631331952 /nfs/dbraw/zinc/33/19/52/631331952.db2.gz DLPSYHGQTYKMAU-CQSZACIVSA-N 2 0 280.799 2.586 20 10 CFCDRP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c(O)c1 ZINC000841089960 631337389 /nfs/dbraw/zinc/33/73/89/631337389.db2.gz RZULCWTXXAQVMC-CQSZACIVSA-N 2 0 290.407 2.555 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841088457 631337688 /nfs/dbraw/zinc/33/76/88/631337688.db2.gz WTOIHSSESMPRSD-WMZOPIPTSA-N 2 0 287.451 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4C[C@@H]4C3)cc2)CC1 ZINC000842775206 631736781 /nfs/dbraw/zinc/73/67/81/631736781.db2.gz CILMJULHXXGKHK-KZNAEPCWSA-N 2 0 299.462 2.717 20 10 CFCDRP CCC[N@H+](Cc1cccc(OCC)c1O)C1CC[NH2+]CC1 ZINC000843044568 631812106 /nfs/dbraw/zinc/81/21/06/631812106.db2.gz JILUGHVHNBVMFK-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP CCOc1ccc(C[N@H+](C2CC2)C2CC[NH2+]CC2)c(O)c1 ZINC000843043838 631812205 /nfs/dbraw/zinc/81/22/05/631812205.db2.gz KGWDIYBAFRCQJU-UHFFFAOYSA-N 2 0 290.407 2.507 20 10 CFCDRP Cc1cc(O)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1C ZINC000843046899 631813143 /nfs/dbraw/zinc/81/31/43/631813143.db2.gz HYCNCIYPTBQROZ-XYPWUTKMSA-N 2 0 274.408 2.724 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c(Cl)c1 ZINC000843048758 631814663 /nfs/dbraw/zinc/81/46/63/631814663.db2.gz WFAPKBRUOBHLQW-LLVKDONJSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1O ZINC000843057555 631820139 /nfs/dbraw/zinc/82/01/39/631820139.db2.gz KAFBJFYPCZCXCD-GHMZBOCLSA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c(Cl)c1 ZINC000843059695 631823214 /nfs/dbraw/zinc/82/32/14/631823214.db2.gz PXDMPRQEZGDSRR-YWPYICTPSA-N 2 0 294.826 2.913 20 10 CFCDRP CC(C)([NH3+])C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000843062710 631824958 /nfs/dbraw/zinc/82/49/58/631824958.db2.gz MEPGFJWLWIQUGY-UHFFFAOYSA-N 2 0 262.397 2.874 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c(Cl)c1 ZINC000843112624 631839007 /nfs/dbraw/zinc/83/90/07/631839007.db2.gz JKLXTWAOJABFAV-LBPRGKRZSA-N 2 0 282.815 2.915 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000843118702 631839693 /nfs/dbraw/zinc/83/96/93/631839693.db2.gz MZQQEOUEIYILFD-MEDHRJKHSA-N 2 0 299.462 2.841 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1 ZINC000843124566 631842834 /nfs/dbraw/zinc/84/28/34/631842834.db2.gz CDBDRGYMGJQGRL-GJZGRUSLSA-N 2 0 274.408 2.522 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)ccc21 ZINC000843342871 631932507 /nfs/dbraw/zinc/93/25/07/631932507.db2.gz QVJBSWQKYXDCJI-FGTMMUONSA-N 2 0 299.462 2.547 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000844904378 632331790 /nfs/dbraw/zinc/33/17/90/632331790.db2.gz JWHILSBETATADI-UHFFFAOYSA-N 2 0 282.387 2.631 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CCC(CC[NH3+])CC2)c1O ZINC000844911492 632333925 /nfs/dbraw/zinc/33/39/25/632333925.db2.gz MRNJXXNJMNDTAG-UHFFFAOYSA-N 2 0 282.815 2.915 20 10 CFCDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(F)ccc1O ZINC000844926975 632339740 /nfs/dbraw/zinc/33/97/40/632339740.db2.gz XTDHTUQXMRTLOG-LLVKDONJSA-N 2 0 266.360 2.572 20 10 CFCDRP CCOc1cccc(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)c1O ZINC000156695024 650067074 /nfs/dbraw/zinc/06/70/74/650067074.db2.gz BYGRVPMKRSYGBH-CQSZACIVSA-N 2 0 280.412 2.596 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000846135322 632642364 /nfs/dbraw/zinc/64/23/64/632642364.db2.gz CLSDCSNPVKPGQY-AWEZNQCLSA-N 2 0 292.423 2.927 20 10 CFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000817901279 632725674 /nfs/dbraw/zinc/72/56/74/632725674.db2.gz ANKSNLHMBWUOBQ-LBPRGKRZSA-N 2 0 297.402 2.634 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CCCCC[C@@H]3[NH3+])ccc21 ZINC000817901968 632725909 /nfs/dbraw/zinc/72/59/09/632725909.db2.gz ZZRMYXYUUSLVEB-IRXDYDNUSA-N 2 0 287.451 2.819 20 10 CFCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc2ccccc2c1O ZINC000817936955 632741799 /nfs/dbraw/zinc/74/17/99/632741799.db2.gz SMYIXLBWUIBVFO-LBPRGKRZSA-N 2 0 270.376 2.948 20 10 CFCDRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817937667 632743151 /nfs/dbraw/zinc/74/31/51/632743151.db2.gz ZKOGGUICJFXASI-INIZCTEOSA-N 2 0 261.413 2.545 20 10 CFCDRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817940539 632744233 /nfs/dbraw/zinc/74/42/33/632744233.db2.gz IYLIVCCPMHOXBU-ZDUSSCGKSA-N 2 0 288.435 2.921 20 10 CFCDRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817942436 632745709 /nfs/dbraw/zinc/74/57/09/632745709.db2.gz YOKRAZSKXRUSIX-KRWDZBQOSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000817943480 632746151 /nfs/dbraw/zinc/74/61/51/632746151.db2.gz OLVCDEDAUBZNDY-AWEZNQCLSA-N 2 0 263.429 2.793 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817945981 632748615 /nfs/dbraw/zinc/74/86/15/632748615.db2.gz PDKKBTZHIBLONH-UONOGXRCSA-N 2 0 288.435 2.921 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000817946555 632748841 /nfs/dbraw/zinc/74/88/41/632748841.db2.gz ZBCGOYIHMVRCRH-LSDHHAIUSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc(Cl)ccc1O ZINC000817954310 632753349 /nfs/dbraw/zinc/75/33/49/632753349.db2.gz YKIAXLJIVHVLBD-JOYOIKCWSA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817955014 632754451 /nfs/dbraw/zinc/75/44/51/632754451.db2.gz OODUWQRFYDCQTI-ZIAGYGMSSA-N 2 0 288.435 2.921 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2c1c(F)ccc2O ZINC000817954659 632754853 /nfs/dbraw/zinc/75/48/53/632754853.db2.gz GDNIRELRLHGZQW-MDZLAQPJSA-N 2 0 278.371 2.669 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccc(N(C)C)cc1 ZINC000817959031 632756329 /nfs/dbraw/zinc/75/63/29/632756329.db2.gz ANYFZPNDXSUDMN-LXZKKBNFSA-N 2 0 275.440 2.921 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817959710 632758359 /nfs/dbraw/zinc/75/83/59/632758359.db2.gz UFRGYOTYQKWZDF-MLGOLLRUSA-N 2 0 276.424 2.905 20 10 CFCDRP CC[C@H]([NH2+]CC([NH3+])(CC)CC)c1ccccc1O ZINC000817961275 632760798 /nfs/dbraw/zinc/76/07/98/632760798.db2.gz ZWLFIEYGAATTNA-ZDUSSCGKSA-N 2 0 250.386 2.950 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(O)c1C ZINC000817967705 632766838 /nfs/dbraw/zinc/76/68/38/632766838.db2.gz BFXSEXHKEFWADB-KBPBESRZSA-N 2 0 262.397 2.802 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c(O)c1 ZINC000817970281 632768692 /nfs/dbraw/zinc/76/86/92/632768692.db2.gz QMNBDHCDUDQSLO-MELADBBJSA-N 2 0 262.397 2.658 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)ccc1O ZINC000817971173 632771275 /nfs/dbraw/zinc/77/12/75/632771275.db2.gz JXXIAUDJIWHATI-FOGDFJRCSA-N 2 0 268.788 2.837 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000817972210 632772170 /nfs/dbraw/zinc/77/21/70/632772170.db2.gz VFAMPBNZRXEXGC-GBIKHYSHSA-N 2 0 268.788 2.694 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(N(C)C)cc1 ZINC000817977272 632774971 /nfs/dbraw/zinc/77/49/71/632774971.db2.gz FZBSWOVBEWQXKA-BBRMVZONSA-N 2 0 263.429 2.921 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000817977032 632775287 /nfs/dbraw/zinc/77/52/87/632775287.db2.gz ZMFNYAAVIHVEEE-WMLDXEAASA-N 2 0 287.451 2.935 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c(O)c1 ZINC000817978207 632776162 /nfs/dbraw/zinc/77/61/62/632776162.db2.gz YLDZKKBZPCIJQH-QWHCGFSZSA-N 2 0 250.386 2.787 20 10 CFCDRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccc1O ZINC000817980269 632776771 /nfs/dbraw/zinc/77/67/71/632776771.db2.gz KKICVXQGCVDEPJ-DZGCQCFKSA-N 2 0 262.397 2.965 20 10 CFCDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(F)ccc1O ZINC000817979794 632776923 /nfs/dbraw/zinc/77/69/23/632776923.db2.gz FJTGEEQQVAKXQX-AAEUAGOBSA-N 2 0 266.360 2.714 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCC[NH2+]C2CC2)c2c1c(F)ccc2O ZINC000817983851 632780315 /nfs/dbraw/zinc/78/03/15/632780315.db2.gz JXPQYJHTUMKFGO-GXFFZTMASA-N 2 0 278.371 2.811 20 10 CFCDRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccc1O ZINC000817984916 632780871 /nfs/dbraw/zinc/78/08/71/632780871.db2.gz CAIIOQLEDRCNBM-HNNXBMFYSA-N 2 0 260.381 2.743 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(C)cc1O ZINC000817983914 632781286 /nfs/dbraw/zinc/78/12/86/632781286.db2.gz LLKHGCFTXXEYMO-OAHLLOKOSA-N 2 0 262.397 2.883 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c(O)c1 ZINC000817985102 632782049 /nfs/dbraw/zinc/78/20/49/632782049.db2.gz AHIVDBSISZMXHZ-BYNSBNAKSA-N 2 0 274.408 2.739 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cc(Cl)ccc1O ZINC000818614798 632879807 /nfs/dbraw/zinc/87/98/07/632879807.db2.gz GMXFSQXNTADVQA-OASPWFOLSA-N 2 0 268.788 2.966 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c(O)c1 ZINC000854230569 635267005 /nfs/dbraw/zinc/26/70/05/635267005.db2.gz URVLLXWUIQOIMI-TZMCWYRMSA-N 2 0 250.386 2.725 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000858088512 636121151 /nfs/dbraw/zinc/12/11/51/636121151.db2.gz HMJZCKLTYABKHZ-HNNXBMFYSA-N 2 0 275.440 2.715 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)c1O ZINC000873222409 642075064 /nfs/dbraw/zinc/07/50/64/642075064.db2.gz QVMWPAFXUJFWQA-JTQLQIEISA-N 2 0 298.814 2.532 20 10 CFCDRP COc1ccc(O)c(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223949 642078675 /nfs/dbraw/zinc/07/86/75/642078675.db2.gz VOFFZBSSBAZKDV-KRWDZBQOSA-N 2 0 292.423 2.598 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873232906 642086741 /nfs/dbraw/zinc/08/67/41/642086741.db2.gz QUUYIQCXLYUQPO-MRXNPFEDSA-N 2 0 292.398 2.933 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000873249712 642097079 /nfs/dbraw/zinc/09/70/79/642097079.db2.gz CCRWPUZTDDECGH-KKZNHRDASA-N 2 0 299.212 2.543 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000873258167 642103432 /nfs/dbraw/zinc/10/34/32/642103432.db2.gz XIUOGRGCJSZWGW-NOLJZWGESA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000876661935 642962521 /nfs/dbraw/zinc/96/25/21/642962521.db2.gz KOFOQOUTSROKOP-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(O)c1 ZINC000876761059 642998189 /nfs/dbraw/zinc/99/81/89/642998189.db2.gz YAXFKARYFIRUGV-OAHLLOKOSA-N 2 0 274.408 2.618 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C)cc2O)C1 ZINC000876771611 643003723 /nfs/dbraw/zinc/00/37/23/643003723.db2.gz VCLOWHRHOLMHLG-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000876812357 643020389 /nfs/dbraw/zinc/02/03/89/643020389.db2.gz LISHYJNQJLFFRF-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000876946781 643074837 /nfs/dbraw/zinc/07/48/37/643074837.db2.gz RDLXQVMLZHLJFG-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2c(C)cccc2O)C1 ZINC000876988546 643095810 /nfs/dbraw/zinc/09/58/10/643095810.db2.gz GDOXVUCYYZQJTJ-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000877477382 643294222 /nfs/dbraw/zinc/29/42/22/643294222.db2.gz CCLHQOCHBKRFSC-WMLDXEAASA-N 2 0 275.440 2.844 20 10 CFCDRP Cc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(O)c1 ZINC000877481638 643298689 /nfs/dbraw/zinc/29/86/89/643298689.db2.gz NZHAYBFHVFOPPH-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c(O)c1 ZINC000877524837 643328720 /nfs/dbraw/zinc/32/87/20/643328720.db2.gz ICEUWFDYLNQQRB-CQSZACIVSA-N 2 0 262.397 2.521 20 10 CFCDRP Cc1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)c(O)c1 ZINC000877568223 643366481 /nfs/dbraw/zinc/36/64/81/643366481.db2.gz HVCAVTLFPZHKJF-UHFFFAOYSA-N 2 0 264.413 2.911 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC000877740618 643508031 /nfs/dbraw/zinc/50/80/31/643508031.db2.gz KMQQNYABTNXXAQ-FUHWJXTLSA-N 2 0 287.451 2.587 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1O ZINC000877758149 643538765 /nfs/dbraw/zinc/53/87/65/643538765.db2.gz KUEUYKHNWONHDH-STQMWFEESA-N 2 0 262.397 2.916 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1 ZINC000092380882 650919233 /nfs/dbraw/zinc/91/92/33/650919233.db2.gz NSGOZLNIXJFSHR-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H]2CCN(C)[C@H](C)C2)c1O ZINC000252878580 651028393 /nfs/dbraw/zinc/02/83/93/651028393.db2.gz YIIIBOKXJRWMKH-MFKMUULPSA-N 2 0 298.814 2.627 20 10 CFCDRP CC[NH+]1CCC(N(C)Cc2c(O)cccc2Cl)CC1 ZINC000131571376 645754581 /nfs/dbraw/zinc/75/45/81/645754581.db2.gz QHHMVTHYLXVYML-UHFFFAOYSA-N 2 0 282.815 2.962 20 10 CFCDRP CCOc1cccc(C[N@H+](C)C2CCN(CC)CC2)c1O ZINC000131574917 645754974 /nfs/dbraw/zinc/75/49/74/645754974.db2.gz CJHYTYAUQICRPU-UHFFFAOYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCC1([NH3+])CC[NH+]([C@@H]2CCc3cccc(O)c32)CC1 ZINC000925759700 648311484 /nfs/dbraw/zinc/31/14/84/648311484.db2.gz KFZAESDMSULKOX-CYBMUJFWSA-N 2 0 260.381 2.583 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925781633 648321505 /nfs/dbraw/zinc/32/15/05/648321505.db2.gz IYJSYZQCDCITKT-NWDGAFQWSA-N 2 0 284.350 2.596 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1O ZINC000925799131 648327604 /nfs/dbraw/zinc/32/76/04/648327604.db2.gz UBDOSGFXEZDHFX-UMVBOHGHSA-N 2 0 262.397 2.679 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c1 ZINC000925847629 648343839 /nfs/dbraw/zinc/34/38/39/648343839.db2.gz XMSUMXNYRVGWGV-IAOVAPTHSA-N 2 0 274.408 2.883 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925779386 776536812 /nfs/dbraw/zinc/53/68/12/776536812.db2.gz YIWORWRLANVEAW-QWHCGFSZSA-N 2 0 298.377 2.904 20 10 CFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC001231879132 777363814 /nfs/dbraw/zinc/36/38/14/777363814.db2.gz WRUQKOJJRDDMMP-WBVHZDCISA-N 2 0 296.414 2.929 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(O)c1 ZINC001235197235 778411068 /nfs/dbraw/zinc/41/10/68/778411068.db2.gz FORINDWBBXFXMH-UKRRQHHQSA-N 2 0 288.435 2.731 20 10 CFCDRP Oc1ccc(F)cc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235229525 778423027 /nfs/dbraw/zinc/42/30/27/778423027.db2.gz QCANLOKJWYZPMB-MRXNPFEDSA-N 2 0 292.398 2.885 20 10 CFCDRP C[NH+](C)C1CCC([N@H+](C)Cc2ccccc2O)CC1 ZINC001168327323 778434273 /nfs/dbraw/zinc/43/42/73/778434273.db2.gz JPBYGHOQKDQHFT-UHFFFAOYSA-N 2 0 262.397 2.697 20 10 CFCDRP Cc1cc(O)c(CN2CCC[NH2+][C@@H](C)C2)cc1Cl ZINC001236095451 778690072 /nfs/dbraw/zinc/69/00/72/778690072.db2.gz UNAKQWJEAVVUBW-NSHDSACASA-N 2 0 268.788 2.538 20 10 CFCDRP C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCC[NH2+]1 ZINC001236100412 778692686 /nfs/dbraw/zinc/69/26/86/778692686.db2.gz HGZJOWHHCUVVNA-ZDUSSCGKSA-N 2 0 276.424 2.874 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC[C@H]2CCCC[NH2+]2)cc1 ZINC001236188963 778730682 /nfs/dbraw/zinc/73/06/82/778730682.db2.gz GGCRJEUHAGQTFF-MRXNPFEDSA-N 2 0 275.440 2.717 20 10 CFCDRP CC[C@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236934066 778982640 /nfs/dbraw/zinc/98/26/40/778982640.db2.gz CEDFFEMAWQONRB-AWEZNQCLSA-N 2 0 293.430 2.808 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237405487 779099020 /nfs/dbraw/zinc/09/90/20/779099020.db2.gz QTADSORATFSDOU-SMDDNHRTSA-N 2 0 280.799 2.620 20 10 CFCDRP CCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237417070 779103380 /nfs/dbraw/zinc/10/33/80/779103380.db2.gz RZSDRTKOTCVIJE-GOEBONIOSA-N 2 0 274.408 2.529 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC001205094783 779169324 /nfs/dbraw/zinc/16/93/24/779169324.db2.gz PLHKQYQWAUZBFV-INIZCTEOSA-N 2 0 275.440 2.846 20 10 CFCDRP [NH3+]CC[C@H]1CN(c2cccc3c2C[NH2+]CC3)c2ccccc21 ZINC001168550598 779942678 /nfs/dbraw/zinc/94/26/78/779942678.db2.gz VUZMZPVDBWINDJ-HNNXBMFYSA-N 2 0 293.414 2.916 20 10 CFCDRP [NH3+]CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001205053567 780638216 /nfs/dbraw/zinc/63/82/16/780638216.db2.gz PHFSWZBEYLCUMC-UHFFFAOYSA-N 2 0 288.313 2.582 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1 ZINC000700818908 780726693 /nfs/dbraw/zinc/72/66/93/780726693.db2.gz ORYXVKDUQQWFFD-MRXNPFEDSA-N 2 0 275.440 2.574 20 10 CFCDRP COc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1C ZINC000134403883 540785856 /nfs/dbraw/zinc/78/58/56/540785856.db2.gz XBPALUYZQRGVJE-UHFFFAOYSA-N 2 0 276.424 2.825 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccccc1O ZINC000037643960 372679404 /nfs/dbraw/zinc/67/94/04/372679404.db2.gz WIOIGWIIPLFCEA-DZGCQCFKSA-N 2 0 262.397 2.775 20 10 CFCDRP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000037786355 372710332 /nfs/dbraw/zinc/71/03/32/372710332.db2.gz WUCKBCXIEBTVRY-UHFFFAOYSA-N 2 0 262.397 2.745 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)ccc2O)[C@H](C)C1 ZINC000093639522 375278282 /nfs/dbraw/zinc/27/82/82/375278282.db2.gz ATWSRSQQUSQXQL-GDBMZVCRSA-N 2 0 276.424 2.863 20 10 CFCDRP CC[NH+](CC)CCC[N@H+](C)Cc1ccccc1O ZINC000179568573 380558036 /nfs/dbraw/zinc/55/80/36/380558036.db2.gz LTYDPGPKMNNYFT-UHFFFAOYSA-N 2 0 250.386 2.556 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2O)C1 ZINC000179581525 380560169 /nfs/dbraw/zinc/56/01/69/380560169.db2.gz IFLKZXPRZDEVII-CQSZACIVSA-N 2 0 262.397 2.556 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296138376 381270552 /nfs/dbraw/zinc/27/05/52/381270552.db2.gz WCLAQFRWZQZJRB-CQSZACIVSA-N 2 0 262.397 2.701 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672032 381699654 /nfs/dbraw/zinc/69/96/54/381699654.db2.gz JULNFZHBOKVGFW-MJBXVCDLSA-N 2 0 274.408 2.976 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[NH+](C)C)c(O)c1C ZINC000273369933 385679490 /nfs/dbraw/zinc/67/94/90/385679490.db2.gz FVSUSPKOVJZAKX-CYBMUJFWSA-N 2 0 250.386 2.611 20 10 CFCDRP COc1cccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1O ZINC000038041762 174043339 /nfs/dbraw/zinc/04/33/39/174043339.db2.gz KIAVQTIQCVCJRV-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000093693515 276106348 /nfs/dbraw/zinc/10/63/48/276106348.db2.gz USQRRSFGYVUABB-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423084241 330168889 /nfs/dbraw/zinc/16/88/89/330168889.db2.gz HGMAIHSVEXPIBK-YIONKMFJSA-N 2 0 283.419 2.859 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccccc1O ZINC000228789918 519616322 /nfs/dbraw/zinc/61/63/22/519616322.db2.gz MHLPGPTYPJCGIC-CYBMUJFWSA-N 2 0 250.386 2.773 20 10 CFCDRP CCOCc1cc(C[NH2+]C[C@H](C)C[NH+](C)C)ccc1OC ZINC000291701626 520187043 /nfs/dbraw/zinc/18/70/43/520187043.db2.gz KERDSMRONUYNMU-AWEZNQCLSA-N 2 0 294.439 2.519 20 10 CFCDRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccccc1O ZINC000274731986 522820396 /nfs/dbraw/zinc/82/03/96/522820396.db2.gz CFFGBAOBQRDACQ-OAHLLOKOSA-N 2 0 260.381 2.695 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c1 ZINC000293346676 525360630 /nfs/dbraw/zinc/36/06/30/525360630.db2.gz GUEGPNQWQYJXCC-QWHCGFSZSA-N 2 0 250.386 2.549 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649022 525365707 /nfs/dbraw/zinc/36/57/07/525365707.db2.gz UQVBBUDVRYXAIR-UONOGXRCSA-N 2 0 274.408 2.836 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CN(C)C[C@H]2C)cc1F ZINC000756117192 574075890 /nfs/dbraw/zinc/07/58/90/574075890.db2.gz JMMABSBPZXWNTG-CZUORRHYSA-N 2 0 293.430 2.712 20 10 CFCDRP C[NH+](C)CC1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738075000 574156941 /nfs/dbraw/zinc/15/69/41/574156941.db2.gz AYOCRCRFKDEKTI-UHFFFAOYSA-N 2 0 299.418 2.714 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000044517553 618027047 /nfs/dbraw/zinc/02/70/47/618027047.db2.gz NYACISDGLGVNEA-ZDUSSCGKSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000044516511 618027214 /nfs/dbraw/zinc/02/72/14/618027214.db2.gz VYQXHRKASPKWBI-CQSZACIVSA-N 2 0 275.440 2.745 20 10 CFCDRP C[C@@H](CC[NH2+]C/C=C\c1ccc(N(C)C)cc1)[NH+](C)C ZINC000895291892 618513067 /nfs/dbraw/zinc/51/30/67/618513067.db2.gz JJXDLRGNDGIBIC-XHPSBEMXSA-N 2 0 275.440 2.696 20 10 CFCDRP c1csc(SCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)n1 ZINC000166644260 618706751 /nfs/dbraw/zinc/70/67/51/618706751.db2.gz DJYGONWTAINUEW-QWHCGFSZSA-N 2 0 297.493 2.842 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccccc1O ZINC000925787220 619112381 /nfs/dbraw/zinc/11/23/81/619112381.db2.gz ZGQUAXDETOTFFZ-AAEUAGOBSA-N 2 0 284.350 2.678 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000895555980 619554468 /nfs/dbraw/zinc/55/44/68/619554468.db2.gz DDJDTEHTWIQNNW-HNNXBMFYSA-N 2 0 297.402 2.806 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000841027642 620255433 /nfs/dbraw/zinc/25/54/33/620255433.db2.gz DODTYNRMJNHMMA-OZZQIWQLSA-N 2 0 287.451 2.873 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H]4CCC[C@@H]34)cc2)CC1 ZINC000897955568 620310807 /nfs/dbraw/zinc/31/08/07/620310807.db2.gz WPZRMNUMMSWFKB-QXAKKESOSA-N 2 0 299.462 2.717 20 10 CFCDRP CCCC[C@@H](COC)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000841041773 620398561 /nfs/dbraw/zinc/39/85/61/620398561.db2.gz BTYMGKRBMDZYFR-RDJZCZTQSA-N 2 0 293.455 2.547 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]([NH3+])CC(F)F ZINC000903889093 621460372 /nfs/dbraw/zinc/46/03/72/621460372.db2.gz ONKNQOJUFQDFIP-LBPRGKRZSA-N 2 0 272.339 2.587 20 10 CFCDRP [NH3+][C@H]1C[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)C1 ZINC000904320810 621573670 /nfs/dbraw/zinc/57/36/70/621573670.db2.gz PMWBCQXQTDPNGE-OTVXOJSOSA-N 2 0 274.408 2.874 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000904411051 621592748 /nfs/dbraw/zinc/59/27/48/621592748.db2.gz SVUBETLFVPXIIH-INIZCTEOSA-N 2 0 275.440 2.704 20 10 CFCDRP Cc1cc(O)c(CN2CC[C@@]3(C2)CCCC[NH2+]3)cc1C ZINC000904430842 621595365 /nfs/dbraw/zinc/59/53/65/621595365.db2.gz MAQOJTBQALIYFH-QGZVFWFLSA-N 2 0 274.408 2.727 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@@H]21 ZINC000230126047 623257515 /nfs/dbraw/zinc/25/75/15/623257515.db2.gz UYWMSGQARHWPOF-DDTOSNHZSA-N 2 0 280.799 2.605 20 10 CFCDRP Cc1cc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)ccc1N1CCCCC1 ZINC000827458224 624008611 /nfs/dbraw/zinc/00/86/11/624008611.db2.gz UOZXLZBHWAGSPY-HDICACEKSA-N 2 0 299.462 2.637 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)[C@@H](C)[NH3+])c1O ZINC000817979221 625972862 /nfs/dbraw/zinc/97/28/62/625972862.db2.gz IVAAUJNMDYEXJU-UTLUCORTSA-N 2 0 256.777 2.740 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921581147 625991217 /nfs/dbraw/zinc/99/12/17/625991217.db2.gz HVGLTFMLZBODIO-MRXNPFEDSA-N 2 0 288.435 2.833 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c(O)c1 ZINC000763591762 627000468 /nfs/dbraw/zinc/00/04/68/627000468.db2.gz VPQAZXHPSZICQL-OAHLLOKOSA-N 2 0 292.423 2.707 20 10 CFCDRP CC[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000766030026 627172874 /nfs/dbraw/zinc/17/28/74/627172874.db2.gz SMOFAULBTXARIU-UHFFFAOYSA-N 2 0 275.440 2.635 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CCN(Cc2c(O)cccc2OC)C1 ZINC000769502858 627448275 /nfs/dbraw/zinc/44/82/75/627448275.db2.gz BVUHFFLQINCXLO-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)c(O)c1 ZINC000769513786 627449849 /nfs/dbraw/zinc/44/98/49/627449849.db2.gz DPYQUNLTSAIHPN-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Oc1ccc(-c2ccccc2)cc1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000770393149 627518323 /nfs/dbraw/zinc/51/83/23/627518323.db2.gz AVPPIIULTUAXTM-ROUUACIJSA-N 2 0 294.398 2.710 20 10 CFCDRP Oc1ccc(-c2ccccc2)cc1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000770393147 627518484 /nfs/dbraw/zinc/51/84/84/627518484.db2.gz AVPPIIULTUAXTM-QZTJIDSGSA-N 2 0 294.398 2.710 20 10 CFCDRP CCN(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000773728504 627851961 /nfs/dbraw/zinc/85/19/61/627851961.db2.gz CULFLVWFSIMOAX-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000775639282 628048888 /nfs/dbraw/zinc/04/88/88/628048888.db2.gz SDGRWIZWHFWZMD-UHFFFAOYSA-N 2 0 287.451 2.814 20 10 CFCDRP CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(C)C ZINC000775652766 628050027 /nfs/dbraw/zinc/05/00/27/628050027.db2.gz RZARZRQGBYECFD-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C3CC3)cc2)CC1 ZINC000775677162 628053783 /nfs/dbraw/zinc/05/37/83/628053783.db2.gz IGHSBWJPMDUVPN-IBGZPJMESA-N 2 0 299.462 2.813 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]CCCC[N@H+](C)C2CC2)c1 ZINC000835063082 629365419 /nfs/dbraw/zinc/36/54/19/629365419.db2.gz UHDSCRWAKAMAJT-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1F ZINC000796722376 629955183 /nfs/dbraw/zinc/95/51/83/629955183.db2.gz DWYRLOYUXWTSPS-UHFFFAOYSA-N 2 0 293.430 2.854 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]3C3CC3)cc2)CC1 ZINC000797905872 630122031 /nfs/dbraw/zinc/12/20/31/630122031.db2.gz RGFHDKRJTWCOGI-RBUKOAKNSA-N 2 0 299.462 2.717 20 10 CFCDRP C[N@H+](Cc1ccccc1O)Cc1cccc2c1CC[NH2+]C2 ZINC000852745640 634820682 /nfs/dbraw/zinc/82/06/82/634820682.db2.gz YWLIHYQZGUBEBR-UHFFFAOYSA-N 2 0 282.387 2.670 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000840086303 630868446 /nfs/dbraw/zinc/86/84/46/630868446.db2.gz MBVSZIBXEBVWTN-SFHVURJKSA-N 2 0 288.435 2.927 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000840086300 630868763 /nfs/dbraw/zinc/86/87/63/630868763.db2.gz MBVSZIBXEBVWTN-GOSISDBHSA-N 2 0 288.435 2.927 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000840931342 631266221 /nfs/dbraw/zinc/26/62/21/631266221.db2.gz FNBPFHLUYJIUNZ-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2=CC[N@H+](C)CC2)c(Cl)c1 ZINC000840937688 631270142 /nfs/dbraw/zinc/27/01/42/631270142.db2.gz WGOALIAQRUOCBZ-UHFFFAOYSA-N 2 0 280.799 2.706 20 10 CFCDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841029591 631310803 /nfs/dbraw/zinc/31/08/03/631310803.db2.gz ILBKPIAXMXRZDA-GWCFXTLKSA-N 2 0 268.788 2.653 20 10 CFCDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000841029251 631311227 /nfs/dbraw/zinc/31/12/27/631311227.db2.gz NAQAQFKKIKPQDT-LBPRGKRZSA-N 2 0 256.349 2.702 20 10 CFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841031687 631311613 /nfs/dbraw/zinc/31/16/13/631311613.db2.gz VKYSBRWPFBAPEW-WMZOPIPTSA-N 2 0 287.451 2.894 20 10 CFCDRP CCOc1cccc(C[NH2+]CC2([NH3+])CCCCCC2)c1O ZINC000841044119 631319019 /nfs/dbraw/zinc/31/90/19/631319019.db2.gz WBPMXRMNUWOSNP-UHFFFAOYSA-N 2 0 292.423 2.932 20 10 CFCDRP C[C@]1(C[NH2+]Cc2c(O)cccc2Cl)CCC[NH2+]C1 ZINC000841058381 631326339 /nfs/dbraw/zinc/32/63/39/631326339.db2.gz WUPJMGAXTZSCHJ-AWEZNQCLSA-N 2 0 268.788 2.525 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1O ZINC000841058487 631326614 /nfs/dbraw/zinc/32/66/14/631326614.db2.gz RYURJGGYBUMCOA-OLZOCXBDSA-N 2 0 268.788 2.714 20 10 CFCDRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841064908 631327627 /nfs/dbraw/zinc/32/76/27/631327627.db2.gz VVFZPKXBBVJQJU-CRAIPNDOSA-N 2 0 287.451 2.765 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1F ZINC000841079634 631332720 /nfs/dbraw/zinc/33/27/20/631332720.db2.gz LBJHZYQAVYTKBO-CYBMUJFWSA-N 2 0 281.419 2.889 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1c(O)cccc1Cl ZINC000841078915 631333323 /nfs/dbraw/zinc/33/33/23/631333323.db2.gz JSTIBCBYNTYKLR-JTQLQIEISA-N 2 0 256.777 2.653 20 10 CFCDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000841083570 631334234 /nfs/dbraw/zinc/33/42/34/631334234.db2.gz QEDLDNSSAWXOGQ-DLBZAZTESA-N 2 0 287.451 2.894 20 10 CFCDRP C[C@@H]1CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@@H]1C[NH3+] ZINC000841099798 631340216 /nfs/dbraw/zinc/34/02/16/631340216.db2.gz PCRHSDIYKVHZNE-LUJIMGINSA-N 2 0 287.451 2.683 20 10 CFCDRP CSC1(C[NH2+][C@@H](C)c2ccccc2O)CC[NH+](C)CC1 ZINC000810252677 631349318 /nfs/dbraw/zinc/34/93/18/631349318.db2.gz SHOQCTOPTVBOIC-ZDUSSCGKSA-N 2 0 294.464 2.870 20 10 CFCDRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843052906 631817943 /nfs/dbraw/zinc/81/79/43/631817943.db2.gz OLTQQYMVLLHITF-QGZVFWFLSA-N 2 0 287.451 2.718 20 10 CFCDRP CCOc1ccc(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)c(O)c1 ZINC000843056458 631820380 /nfs/dbraw/zinc/82/03/80/631820380.db2.gz KPAWATWUKJTYJR-OAHLLOKOSA-N 2 0 280.412 2.596 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000843056489 631820460 /nfs/dbraw/zinc/82/04/60/631820460.db2.gz MWSIBIQOQSZKKJ-UHFFFAOYSA-N 2 0 277.456 2.950 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000843118703 631840328 /nfs/dbraw/zinc/84/03/28/631840328.db2.gz MZQQEOUEIYILFD-SIEMBAAWSA-N 2 0 299.462 2.841 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1C ZINC000843114879 631840496 /nfs/dbraw/zinc/84/04/96/631840496.db2.gz DHXLNJBGGDQETC-QGZVFWFLSA-N 2 0 274.408 2.585 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1 ZINC000843124567 631843844 /nfs/dbraw/zinc/84/38/44/631843844.db2.gz CDBDRGYMGJQGRL-HUUCEWRRSA-N 2 0 274.408 2.522 20 10 CFCDRP [NH3+]CCCCCC[NH2+]Cc1cc(Cl)ccc1O ZINC000843126134 631845628 /nfs/dbraw/zinc/84/56/28/631845628.db2.gz ANPBRCMKRGPUMS-UHFFFAOYSA-N 2 0 256.777 2.654 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c1O ZINC000843125885 631845887 /nfs/dbraw/zinc/84/58/87/631845887.db2.gz BRGJEPNIFRPBFJ-HNNXBMFYSA-N 2 0 274.408 2.522 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccc1O ZINC000843343896 631933061 /nfs/dbraw/zinc/93/30/61/631933061.db2.gz KJKVVYGQBDLTGD-LBPRGKRZSA-N 2 0 256.349 2.702 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)C[NH+](C)C)cc1F ZINC000813784591 631959405 /nfs/dbraw/zinc/95/94/05/631959405.db2.gz KTJFLBYSPZWIQL-CQSZACIVSA-N 2 0 295.446 2.959 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H](C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000813877522 631971594 /nfs/dbraw/zinc/97/15/94/631971594.db2.gz YNYQUSAXUOTKLR-RHSMWYFYSA-N 2 0 277.456 2.991 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)cc1C ZINC000844901559 632331167 /nfs/dbraw/zinc/33/11/67/632331167.db2.gz GRNGFJUTWWOCOX-RDJZCZTQSA-N 2 0 274.408 2.570 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCC2(C[NH3+])CC2)c2c1c(F)ccc2O ZINC000844921605 632337324 /nfs/dbraw/zinc/33/73/24/632337324.db2.gz QGXKRGFIYGWRSA-JQWIXIFHSA-N 2 0 278.371 2.798 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CCC[NH+]2CCCC2)c1O ZINC000846137600 632643850 /nfs/dbraw/zinc/64/38/50/632643850.db2.gz TYTLKHRMFXCIHD-CYBMUJFWSA-N 2 0 278.396 2.537 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCN(C)[C@@H](C)C2)c1O ZINC000846148273 632647175 /nfs/dbraw/zinc/64/71/75/632647175.db2.gz POEUTBWVQKHUOX-AVGNSLFASA-N 2 0 278.396 2.534 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1O ZINC000846168278 632651644 /nfs/dbraw/zinc/65/16/44/632651644.db2.gz JAKCENNMEIJHAS-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)cc1C ZINC000817866329 632715306 /nfs/dbraw/zinc/71/53/06/632715306.db2.gz YSGYWFRXIMGSQX-DZKIICNBSA-N 2 0 276.424 2.814 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000817894865 632720671 /nfs/dbraw/zinc/72/06/71/632720671.db2.gz RLQVHVCOXGOTHG-SUMWQHHRSA-N 2 0 275.440 2.539 20 10 CFCDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899477 632723472 /nfs/dbraw/zinc/72/34/72/632723472.db2.gz OXUTUTROLWKCMI-ZIAGYGMSSA-N 2 0 261.413 2.502 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC2CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817940123 632743656 /nfs/dbraw/zinc/74/36/56/632743656.db2.gz FKEZBASTUGNHKZ-GWCFXTLKSA-N 2 0 278.371 2.669 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817943127 632746430 /nfs/dbraw/zinc/74/64/30/632746430.db2.gz IYCJXJVAYUELTE-ZDUSSCGKSA-N 2 0 276.424 2.921 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817945979 632748346 /nfs/dbraw/zinc/74/83/46/632748346.db2.gz PDKKBTZHIBLONH-KBPBESRZSA-N 2 0 288.435 2.921 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC000817945703 632748658 /nfs/dbraw/zinc/74/86/58/632748658.db2.gz JZTOOASZEUJALZ-UONOGXRCSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817954397 632753551 /nfs/dbraw/zinc/75/35/51/632753551.db2.gz CJULBLZJCNZEFL-RHSMWYFYSA-N 2 0 275.440 2.793 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000817956684 632755498 /nfs/dbraw/zinc/75/54/98/632755498.db2.gz AOLCCLWYVDTAGU-KZNAEPCWSA-N 2 0 287.451 2.712 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccc(N(C)C)cc1 ZINC000817959030 632757023 /nfs/dbraw/zinc/75/70/23/632757023.db2.gz ANYFZPNDXSUDMN-JLJPHGGASA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccccc1O ZINC000817959475 632757647 /nfs/dbraw/zinc/75/76/47/632757647.db2.gz GIAGYMVPTJKZNI-QEJZJMRPSA-N 2 0 262.397 2.950 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817959898 632758136 /nfs/dbraw/zinc/75/81/36/632758136.db2.gz WKIXQPODQJYWED-USWWRNFRSA-N 2 0 266.360 2.653 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817959357 632758345 /nfs/dbraw/zinc/75/83/45/632758345.db2.gz BXMBYKHKQTWKBV-NSHDSACASA-N 2 0 262.397 2.659 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1 ZINC000817960678 632759630 /nfs/dbraw/zinc/75/96/30/632759630.db2.gz PKWVMBWGVUMOJG-HUBLWGQQSA-N 2 0 278.396 2.569 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cc(F)ccc1O ZINC000817961304 632760071 /nfs/dbraw/zinc/76/00/71/632760071.db2.gz WWCYXVZGOUTSIZ-WDMOLILDSA-N 2 0 266.360 2.699 20 10 CFCDRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964760 632763388 /nfs/dbraw/zinc/76/33/88/632763388.db2.gz HBTSFYFUVNTLHQ-ZDUSSCGKSA-N 2 0 291.414 2.686 20 10 CFCDRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817965348 632763672 /nfs/dbraw/zinc/76/36/72/632763672.db2.gz PESWUDPWGXBORZ-LBPRGKRZSA-N 2 0 288.313 2.671 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc2ccccc2c1O ZINC000817966009 632763782 /nfs/dbraw/zinc/76/37/82/632763782.db2.gz ZBJJOGOXHVLYCF-BDJLRTHQSA-N 2 0 270.376 2.933 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817965720 632764096 /nfs/dbraw/zinc/76/40/96/632764096.db2.gz UMXWUEYGWCFZQP-HOTGVXAUSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968192 632767212 /nfs/dbraw/zinc/76/72/12/632767212.db2.gz HJACYCNHRQREOI-JQWIXIFHSA-N 2 0 268.788 2.838 20 10 CFCDRP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(C)cc1O ZINC000817969071 632767272 /nfs/dbraw/zinc/76/72/72/632767272.db2.gz QQNPUUZKISJSOK-UKRRQHHQSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(F)ccc1O ZINC000817979796 632777102 /nfs/dbraw/zinc/77/71/02/632777102.db2.gz FJTGEEQQVAKXQX-DGCLKSJQSA-N 2 0 266.360 2.714 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000817983406 632780338 /nfs/dbraw/zinc/78/03/38/632780338.db2.gz CHPHVVHRSQDQNF-CQSZACIVSA-N 2 0 275.440 2.935 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2[NH3+])c(O)c1C ZINC000818614437 632879736 /nfs/dbraw/zinc/87/97/36/632879736.db2.gz ATMDIDGGFKRVGT-BPLDGKMQSA-N 2 0 262.397 2.930 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000848557452 633288914 /nfs/dbraw/zinc/28/89/14/633288914.db2.gz IEBRPJWMNFZMLD-MELADBBJSA-N 2 0 262.397 2.691 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000848562642 633289958 /nfs/dbraw/zinc/28/99/58/633289958.db2.gz KDTWXRYDFDNOJI-WNHMFEDGSA-N 2 0 287.451 2.696 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000848563286 633290066 /nfs/dbraw/zinc/29/00/66/633290066.db2.gz QPIYPPGZHNNPDQ-MAEOIBBWSA-N 2 0 289.467 2.963 20 10 CFCDRP CCc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)c1O ZINC000848894501 633380609 /nfs/dbraw/zinc/38/06/09/633380609.db2.gz JLIALOYUWLYHPC-AWEZNQCLSA-N 2 0 276.424 2.776 20 10 CFCDRP CCc1cccc(C[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000848915031 633399209 /nfs/dbraw/zinc/39/92/09/633399209.db2.gz QNYAIKJILBCIKO-UHFFFAOYSA-N 2 0 276.424 2.919 20 10 CFCDRP CC(C)[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000048995525 650284566 /nfs/dbraw/zinc/28/45/66/650284566.db2.gz HHIIJSTXRSYZHP-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1O ZINC000872250790 641717987 /nfs/dbraw/zinc/71/79/87/641717987.db2.gz BRRWMJVEUYSKIG-AWEZNQCLSA-N 2 0 262.397 2.568 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1F ZINC000872252978 641719680 /nfs/dbraw/zinc/71/96/80/641719680.db2.gz XHRDPRZEZUKXBQ-CQSZACIVSA-N 2 0 293.430 2.760 20 10 CFCDRP C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CC[NH2+]CC1 ZINC000873219960 642073397 /nfs/dbraw/zinc/07/33/97/642073397.db2.gz HXTGGNPVBNMRLZ-MBVDDHJVSA-N 2 0 287.451 2.744 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000873250438 642096853 /nfs/dbraw/zinc/09/68/53/642096853.db2.gz HOTSCJNVIBIZJG-JMSVASOKSA-N 2 0 274.408 2.659 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000873259090 642104586 /nfs/dbraw/zinc/10/45/86/642104586.db2.gz YXLPKCLRKAFIAC-IRUJWGPZSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1O ZINC000873262675 642106176 /nfs/dbraw/zinc/10/61/76/642106176.db2.gz BFLGBTDRJMFCFL-FQUUOJAGSA-N 2 0 260.381 2.573 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000873268978 642110858 /nfs/dbraw/zinc/11/08/58/642110858.db2.gz JGENCYVNDYPSFS-CHWSQXEVSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)c(O)c1 ZINC000877019954 643106161 /nfs/dbraw/zinc/10/61/61/643106161.db2.gz ILACLNLISPSVPP-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000877524825 643327978 /nfs/dbraw/zinc/32/79/78/643327978.db2.gz HMEXVKLQBAEKGZ-CQSZACIVSA-N 2 0 262.397 2.521 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000877524824 643328590 /nfs/dbraw/zinc/32/85/90/643328590.db2.gz HMEXVKLQBAEKGZ-AWEZNQCLSA-N 2 0 262.397 2.521 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000877653403 643433019 /nfs/dbraw/zinc/43/30/19/643433019.db2.gz JKQWNBUKODXIAP-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093451375 650940205 /nfs/dbraw/zinc/94/02/05/650940205.db2.gz RWLKYKQVGMHHCR-OKZBNKHCSA-N 2 0 287.451 2.763 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])c2c1c(F)ccc2O ZINC000925737499 648304065 /nfs/dbraw/zinc/30/40/65/648304065.db2.gz JMUWERAKFZADPE-MWLCHTKSSA-N 2 0 266.360 2.797 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])c2c1c(F)ccc2O ZINC000925737497 648304431 /nfs/dbraw/zinc/30/44/31/648304431.db2.gz JMUWERAKFZADPE-GXSJLCMTSA-N 2 0 266.360 2.797 20 10 CFCDRP CCC[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC1CC1 ZINC001204598738 773207430 /nfs/dbraw/zinc/20/74/30/773207430.db2.gz OYPLLIBVUQLBFP-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1ccccc1O ZINC001207487187 776021086 /nfs/dbraw/zinc/02/10/86/776021086.db2.gz RQUUPUDVHLZPBG-UHFFFAOYSA-N 2 0 262.397 2.556 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)cc1Cl ZINC001231870356 777359945 /nfs/dbraw/zinc/35/99/45/777359945.db2.gz VLZJFLQLQBFBNA-UHFFFAOYSA-N 2 0 294.826 2.882 20 10 CFCDRP CC(C)(C)c1cccc(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)c1O ZINC001235017996 778355580 /nfs/dbraw/zinc/35/55/80/778355580.db2.gz QRMYBSHYMAREMG-XJKSGUPXSA-N 2 0 288.435 2.874 20 10 CFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H]1C ZINC001235695701 778540667 /nfs/dbraw/zinc/54/06/67/778540667.db2.gz ZTXLAVFZSCLFPI-CVEARBPZSA-N 2 0 287.451 2.717 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)cc1 ZINC001235928539 778612657 /nfs/dbraw/zinc/61/26/57/778612657.db2.gz ACWGDBZASPHGEC-IAGOWNOFSA-N 2 0 287.451 2.574 20 10 CFCDRP C[N@H+](Cc1ccccc1O)C1CC[NH+](CC2CC2)CC1 ZINC001168387668 778766473 /nfs/dbraw/zinc/76/64/73/778766473.db2.gz OWSSSFSQINSDMY-UHFFFAOYSA-N 2 0 274.408 2.698 20 10 CFCDRP CN(C)c1ccc(CN(C2CCC2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001237142695 779025546 /nfs/dbraw/zinc/02/55/46/779025546.db2.gz BLMUXJHSIOLVAQ-GOSISDBHSA-N 2 0 287.451 2.859 20 10 CFCDRP Oc1ccc(Cl)cc1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383091 779087915 /nfs/dbraw/zinc/08/79/15/779087915.db2.gz OCZFZUAQWWFZGR-RISCZKNCSA-N 2 0 280.799 2.620 20 10 CFCDRP [NH3+]CC[C@@H]1CN(c2cccc3c2C[NH2+]CC3)c2ccccc21 ZINC001168550600 779943228 /nfs/dbraw/zinc/94/32/28/779943228.db2.gz VUZMZPVDBWINDJ-OAHLLOKOSA-N 2 0 293.414 2.916 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000700817578 780726914 /nfs/dbraw/zinc/72/69/14/780726914.db2.gz VVDCZPOSQFPYTJ-OLZOCXBDSA-N 2 0 280.387 2.914 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001117953225 781032273 /nfs/dbraw/zinc/03/22/73/781032273.db2.gz CODBZFHEDJXOCS-QGZVFWFLSA-N 2 0 287.451 2.765 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC[N@@H+]1C ZINC000090720473 375026814 /nfs/dbraw/zinc/02/68/14/375026814.db2.gz OVFPYUOOXPRFKQ-DOTOQJQBSA-N 2 0 287.451 2.859 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000093596833 375271739 /nfs/dbraw/zinc/27/17/39/375271739.db2.gz CMZSSUNOWMOURG-KRWDZBQOSA-N 2 0 287.451 2.670 20 10 CFCDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccccc3O)C2)CC1 ZINC000369720916 381321576 /nfs/dbraw/zinc/32/15/76/381321576.db2.gz KKELRTPYVAZVCZ-UHFFFAOYSA-N 2 0 274.408 2.700 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185671628 381699822 /nfs/dbraw/zinc/69/98/22/381699822.db2.gz PJUKELASXVXKSM-TZMCWYRMSA-N 2 0 298.402 2.539 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)c1cc(F)ccc1O ZINC000185672705 381699967 /nfs/dbraw/zinc/69/99/67/381699967.db2.gz SZWNYUYLTWINGZ-MDZLAQPJSA-N 2 0 278.371 2.807 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000185672097 381700022 /nfs/dbraw/zinc/70/00/22/381700022.db2.gz WUQZEWOTZKHRAH-GVXVVHGQSA-N 2 0 278.371 2.807 20 10 CFCDRP c1cc(N2CCCCC2)ccc1CN1CC[NH+]2CCC1CC2 ZINC000377617508 382303634 /nfs/dbraw/zinc/30/36/34/382303634.db2.gz ACCJRHQVHMSYGK-UHFFFAOYSA-N 2 0 299.462 2.957 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251779772 383396772 /nfs/dbraw/zinc/39/67/72/383396772.db2.gz SJPYCASYBCDBLH-MJBXVCDLSA-N 2 0 290.407 2.678 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000285393573 385555041 /nfs/dbraw/zinc/55/50/41/385555041.db2.gz DQTPNIFCXOTASC-JWTNVVGKSA-N 2 0 287.451 2.810 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000020128810 171015922 /nfs/dbraw/zinc/01/59/22/171015922.db2.gz VIGLEUDTWMPFKP-AWEZNQCLSA-N 2 0 292.423 2.927 20 10 CFCDRP CCOc1cccc(C[NH2+]C2CC[NH+](C(C)C)CC2)c1O ZINC000020189119 171054448 /nfs/dbraw/zinc/05/44/48/171054448.db2.gz DKOCZWDZNUANED-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000230658240 519617728 /nfs/dbraw/zinc/61/77/28/519617728.db2.gz VJNXBXGPSGNOHD-LBPRGKRZSA-N 2 0 268.376 2.912 20 10 CFCDRP CC(C)(C)[NH+]1CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000226585445 518709037 /nfs/dbraw/zinc/70/90/37/518709037.db2.gz WKCVJYIDUFJKKF-UHFFFAOYSA-N 2 0 280.387 2.884 20 10 CFCDRP CC[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000050286770 521579784 /nfs/dbraw/zinc/57/97/84/521579784.db2.gz SSSBDJZUKNBVRZ-UHFFFAOYSA-N 2 0 287.451 2.643 20 10 CFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000227328917 523752576 /nfs/dbraw/zinc/75/25/76/523752576.db2.gz LBLKBVFHWBMEPA-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CCC[NH+]2CCC(C)CC2)c1 ZINC000020146359 524750361 /nfs/dbraw/zinc/75/03/61/524750361.db2.gz SHRRUYVHGOCXQO-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000157550942 524773524 /nfs/dbraw/zinc/77/35/24/524773524.db2.gz SJPYCASYBCDBLH-MELADBBJSA-N 2 0 290.407 2.678 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)cc1C ZINC000292075688 525319027 /nfs/dbraw/zinc/31/90/27/525319027.db2.gz LWUIWICQHZKJBS-KRWDZBQOSA-N 2 0 274.408 2.537 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)c1 ZINC000277421383 525341850 /nfs/dbraw/zinc/34/18/50/525341850.db2.gz JAZFOJUEUUCSKX-HNNXBMFYSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000093598033 525347316 /nfs/dbraw/zinc/34/73/16/525347316.db2.gz RYLJJDPKBVPZPC-OAHLLOKOSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)c1 ZINC000049553877 525365402 /nfs/dbraw/zinc/36/54/02/525365402.db2.gz GKQBPAZUCDEVNY-OLZOCXBDSA-N 2 0 250.386 2.691 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(O)c1 ZINC000251014782 525937824 /nfs/dbraw/zinc/93/78/24/525937824.db2.gz LUCHVOCJUVLUGI-ZNMIVQPWSA-N 2 0 274.408 2.978 20 10 CFCDRP Oc1ccccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000228408881 526372126 /nfs/dbraw/zinc/37/21/26/526372126.db2.gz DBAKCFHSDJAVBF-UHFFFAOYSA-N 2 0 283.375 2.546 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC(C[NH+](C)C)CC2)c1 ZINC000754731868 574117396 /nfs/dbraw/zinc/11/73/96/574117396.db2.gz KNFHZEVDGWFCQT-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)c1 ZINC000182472159 625312669 /nfs/dbraw/zinc/31/26/69/625312669.db2.gz XWACFAHBTGACOV-OLZOCXBDSA-N 2 0 278.396 2.536 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000063197635 619162684 /nfs/dbraw/zinc/16/26/84/619162684.db2.gz FFEIVNNOTVHYNE-SFHVURJKSA-N 2 0 287.451 2.717 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CCC[NH+]2CCCC2)c1O ZINC000228677176 620072756 /nfs/dbraw/zinc/07/27/56/620072756.db2.gz AOJRGTJWNOSQAO-UHFFFAOYSA-N 2 0 298.814 2.630 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000841005786 620211935 /nfs/dbraw/zinc/21/19/35/620211935.db2.gz KDTSXOPIIXVLAX-DOTOQJQBSA-N 2 0 289.467 2.963 20 10 CFCDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000841058666 620423379 /nfs/dbraw/zinc/42/33/79/620423379.db2.gz VBHWYNHQYKTRSB-BDAKNGLRSA-N 2 0 272.751 2.544 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000904355077 621581939 /nfs/dbraw/zinc/58/19/39/621581939.db2.gz MXULPVCZIOTDCM-ZDUSSCGKSA-N 2 0 262.397 2.619 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(F)c2[O-])CC[C@@H]1C[NH3+] ZINC000904412209 621593184 /nfs/dbraw/zinc/59/31/84/621593184.db2.gz SFGVBENGBTXGQK-NXEZZACHSA-N 2 0 286.778 2.601 20 10 CFCDRP Cc1cc(O)c(CN2CC[C@]3(C2)CCCC[NH2+]3)cc1C ZINC000904430841 621595485 /nfs/dbraw/zinc/59/54/85/621595485.db2.gz MAQOJTBQALIYFH-KRWDZBQOSA-N 2 0 274.408 2.727 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000044533401 622918540 /nfs/dbraw/zinc/91/85/40/622918540.db2.gz LSKKBZANAMIRDA-KBPBESRZSA-N 2 0 262.397 2.693 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+]Cc1cc(Cl)ccc1O ZINC000227436237 623109747 /nfs/dbraw/zinc/10/97/47/623109747.db2.gz KLSVJRJZOVCQNZ-UHFFFAOYSA-N 2 0 270.804 2.866 20 10 CFCDRP CC(C)[N@H+](C)CCCNCc1ccc2c(c1)CCCO2 ZINC000921520089 625972582 /nfs/dbraw/zinc/97/25/82/625972582.db2.gz FLNCWTDFFGCZNY-UHFFFAOYSA-N 2 0 276.424 2.832 20 10 CFCDRP Cc1cc(C[N@H+](C2CC2)C2CC[NH2+]CC2)ccc1N(C)C ZINC000923280766 626462391 /nfs/dbraw/zinc/46/23/91/626462391.db2.gz HVJPVFAFMAOPCF-UHFFFAOYSA-N 2 0 287.451 2.777 20 10 CFCDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000839183296 626529912 /nfs/dbraw/zinc/52/99/12/626529912.db2.gz VYJVJFKNXITKIG-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000839182383 626529967 /nfs/dbraw/zinc/52/99/67/626529967.db2.gz MWIYEQJSBAWPBQ-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(OC)c2O)C[C@@H]1C ZINC000769469698 627444296 /nfs/dbraw/zinc/44/42/96/627444296.db2.gz CSCTUTHIJHBVFN-ZFWWWQNUSA-N 2 0 292.423 2.705 20 10 CFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775639592 628048276 /nfs/dbraw/zinc/04/82/76/628048276.db2.gz ZPIIYWJGFIECLS-MRXNPFEDSA-N 2 0 287.451 2.670 20 10 CFCDRP C[C@H](C1CC1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648481 628049636 /nfs/dbraw/zinc/04/96/36/628049636.db2.gz AAYIBOOEKAEEBO-OAHLLOKOSA-N 2 0 287.451 2.669 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)ccc2O)C[C@H]1C ZINC000775715470 628058816 /nfs/dbraw/zinc/05/88/16/628058816.db2.gz FQQGBWOAPPOCPQ-UKRRQHHQSA-N 2 0 292.423 2.705 20 10 CFCDRP CCC(CC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775857593 628076646 /nfs/dbraw/zinc/07/66/46/628076646.db2.gz SQPYGSUUDWNGJQ-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@H]3C3CC3)cc2)CC1 ZINC000797905871 630121951 /nfs/dbraw/zinc/12/19/51/630121951.db2.gz RGFHDKRJTWCOGI-OALUTQOASA-N 2 0 299.462 2.717 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c(Cl)c1 ZINC000843128182 630823046 /nfs/dbraw/zinc/82/30/46/630823046.db2.gz IKZMFPQVLHTLDQ-UWVGGRQHSA-N 2 0 256.777 2.569 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[NH+](C)C)c1O ZINC000808672137 631025215 /nfs/dbraw/zinc/02/52/15/631025215.db2.gz DSCGIYKSQZBZMS-NSHDSACASA-N 2 0 270.804 2.956 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[NH+](C)C)c1O ZINC000808672136 631025430 /nfs/dbraw/zinc/02/54/30/631025430.db2.gz DSCGIYKSQZBZMS-LLVKDONJSA-N 2 0 270.804 2.956 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000841028996 631310236 /nfs/dbraw/zinc/31/02/36/631310236.db2.gz KUQOPPFCXYGGKH-UHFFFAOYSA-N 2 0 263.429 2.668 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1O ZINC000841035280 631315069 /nfs/dbraw/zinc/31/50/69/631315069.db2.gz ZLPQSOUECWEEGO-MNOVXSKESA-N 2 0 298.814 2.532 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC2([NH3+])CCCCCC2)c1 ZINC000841042074 631319203 /nfs/dbraw/zinc/31/92/03/631319203.db2.gz DQJWIPCCSRIIFS-UHFFFAOYSA-N 2 0 262.397 2.842 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC[NH2+]CC2)c1O ZINC000841057767 631325817 /nfs/dbraw/zinc/32/58/17/631325817.db2.gz NIZKMWUGDINBTA-CYBMUJFWSA-N 2 0 268.788 2.586 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1O ZINC000841062247 631327076 /nfs/dbraw/zinc/32/70/76/631327076.db2.gz UQJODMPGLOYHJV-GWCFXTLKSA-N 2 0 268.788 2.584 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c(Cl)c1 ZINC000841083396 631334528 /nfs/dbraw/zinc/33/45/28/631334528.db2.gz BVPMOZQSCJHGRM-MNOVXSKESA-N 2 0 268.788 2.571 20 10 CFCDRP C[NH2+]C[C@@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000843045410 631811705 /nfs/dbraw/zinc/81/17/05/631811705.db2.gz WQGHHEWAGVOCSD-YXMMZVCTSA-N 2 0 287.451 2.697 20 10 CFCDRP [NH3+]CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843047001 631814161 /nfs/dbraw/zinc/81/41/61/631814161.db2.gz CPENOBYCMASDDT-UHFFFAOYSA-N 2 0 287.451 2.848 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CCC[NH3+])c(C(F)(F)F)c1 ZINC000843050299 631814727 /nfs/dbraw/zinc/81/47/27/631814727.db2.gz GVBDFVHTUJUUPN-UHFFFAOYSA-N 2 0 289.345 2.552 20 10 CFCDRP C[NH2+]CC1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000843049985 631814869 /nfs/dbraw/zinc/81/48/69/631814869.db2.gz XHYGEQLBDSKODB-PLNGDYQASA-N 2 0 287.451 2.697 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000843048769 631814879 /nfs/dbraw/zinc/81/48/79/631814879.db2.gz XFLIJFODOPNHCA-AWEZNQCLSA-N 2 0 275.440 2.620 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000843050954 631815616 /nfs/dbraw/zinc/81/56/16/631815616.db2.gz CJXYGYPWEBJWJX-KAUISWQESA-N 2 0 287.451 2.825 20 10 CFCDRP Cc1cc(O)c(C[N@@H+](C)CC[C@H]([NH3+])C(C)C)cc1C ZINC000843056774 631820056 /nfs/dbraw/zinc/82/00/56/631820056.db2.gz ZOKOOWUVQLBMOE-HNNXBMFYSA-N 2 0 264.413 2.814 20 10 CFCDRP Cc1cc(O)c(C[N@@H+](C)CC[C@@H]([NH3+])C(C)C)cc1C ZINC000843056775 631820597 /nfs/dbraw/zinc/82/05/97/631820597.db2.gz ZOKOOWUVQLBMOE-OAHLLOKOSA-N 2 0 264.413 2.814 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843058266 631821239 /nfs/dbraw/zinc/82/12/39/631821239.db2.gz QPIGQROYMWVDRT-RDJZCZTQSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1C ZINC000843059054 631821751 /nfs/dbraw/zinc/82/17/51/631821751.db2.gz DULBQMYCOMWMEP-BPUTZDHNSA-N 2 0 274.408 2.568 20 10 CFCDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843058267 631822107 /nfs/dbraw/zinc/82/21/07/631822107.db2.gz QPIGQROYMWVDRT-WBVHZDCISA-N 2 0 287.451 2.846 20 10 CFCDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843116701 631840627 /nfs/dbraw/zinc/84/06/27/631840627.db2.gz LOVSVKACULAZMI-GOSISDBHSA-N 2 0 287.451 2.848 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000843122270 631841433 /nfs/dbraw/zinc/84/14/33/631841433.db2.gz AVFCCQDQWCTKNK-INIZCTEOSA-N 2 0 275.440 2.764 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2CC[NH3+])cc1C ZINC000843123666 631842903 /nfs/dbraw/zinc/84/29/03/631842903.db2.gz MUQQLLITSGTVCK-OAHLLOKOSA-N 2 0 262.397 2.712 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000843128913 631848273 /nfs/dbraw/zinc/84/82/73/631848273.db2.gz ZEGRDULUJDOSMO-QGZVFWFLSA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)ccc1N(C)C ZINC000815018043 632188595 /nfs/dbraw/zinc/18/85/95/632188595.db2.gz DNSZWCQPOCZXQQ-UHFFFAOYSA-N 2 0 289.467 2.835 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000844900651 632330861 /nfs/dbraw/zinc/33/08/61/632330861.db2.gz CDIULCJGDAJJRQ-WMZOPIPTSA-N 2 0 287.451 2.622 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1F ZINC000844903863 632332299 /nfs/dbraw/zinc/33/22/99/632332299.db2.gz QCRPLZQFGGOQLP-UHFFFAOYSA-N 2 0 293.430 2.891 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC(CC[NH3+])CC1 ZINC000844910346 632333798 /nfs/dbraw/zinc/33/37/98/632333798.db2.gz GFJVXKSSWJYFGH-UHFFFAOYSA-N 2 0 275.440 2.622 20 10 CFCDRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(C)cc1O ZINC000844922041 632337315 /nfs/dbraw/zinc/33/73/15/632337315.db2.gz ZMEQVDSUBCZBPP-AWEZNQCLSA-N 2 0 262.397 2.870 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846148175 632646516 /nfs/dbraw/zinc/64/65/16/632646516.db2.gz XXUVBTXSQXQFGF-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899472 632722811 /nfs/dbraw/zinc/72/28/11/632722811.db2.gz OXUTUTROLWKCMI-KBPBESRZSA-N 2 0 261.413 2.502 20 10 CFCDRP CN1CCCc2cc(C[NH2+]C3CCC(C[NH3+])CC3)ccc21 ZINC000817901890 632725499 /nfs/dbraw/zinc/72/54/99/632725499.db2.gz ZJQPMAZKFMMTCC-UHFFFAOYSA-N 2 0 287.451 2.676 20 10 CFCDRP C[NH2+]CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000817939250 632742771 /nfs/dbraw/zinc/74/27/71/632742771.db2.gz BDHOHDSSAAZADD-SNVBAGLBSA-N 2 0 256.777 2.614 20 10 CFCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817937467 632743264 /nfs/dbraw/zinc/74/32/64/632743264.db2.gz WVOQCCSNPVZFHM-VIFPVBQESA-N 2 0 299.212 2.557 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH3+])c1ccc(N2CCCCC2)c(F)c1 ZINC000817938203 632743398 /nfs/dbraw/zinc/74/33/98/632743398.db2.gz GTKCDDWIWUGFKB-CYBMUJFWSA-N 2 0 279.403 2.815 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000817943408 632746720 /nfs/dbraw/zinc/74/67/20/632746720.db2.gz MZJMRHJYUDHKHN-AWEZNQCLSA-N 2 0 250.386 2.741 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccccc1O ZINC000817949561 632750940 /nfs/dbraw/zinc/75/09/40/632750940.db2.gz RHTCEALXJRIKPS-ZDUSSCGKSA-N 2 0 270.376 2.744 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2c1c(F)ccc2O ZINC000817954661 632754818 /nfs/dbraw/zinc/75/48/18/632754818.db2.gz GDNIRELRLHGZQW-NTZNESFSSA-N 2 0 278.371 2.669 20 10 CFCDRP Nc1ccc(CC[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000817956782 632755866 /nfs/dbraw/zinc/75/58/66/632755866.db2.gz CRTNLMASJCSFBG-IRXDYDNUSA-N 2 0 267.376 2.546 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000817959866 632758035 /nfs/dbraw/zinc/75/80/35/632758035.db2.gz WBWKBFGGPWYZOH-SKDRFNHKSA-N 2 0 256.777 2.680 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c(O)c1 ZINC000817960730 632759671 /nfs/dbraw/zinc/75/96/71/632759671.db2.gz QRIYPDSORRSPKF-GUTXKFCHSA-N 2 0 262.397 2.869 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817962386 632761924 /nfs/dbraw/zinc/76/19/24/632761924.db2.gz KXIUMXFZAFVEKV-HUUCEWRRSA-N 2 0 275.440 2.922 20 10 CFCDRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817964489 632763046 /nfs/dbraw/zinc/76/30/46/632763046.db2.gz AKFWPVVAQPVEAF-OAHLLOKOSA-N 2 0 287.451 2.937 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCC2)c2c1c(F)ccc2O ZINC000817965055 632763845 /nfs/dbraw/zinc/76/38/45/632763845.db2.gz ODXMKZITXVHQHJ-MWLCHTKSSA-N 2 0 264.344 2.551 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc2c(cc1O)CCCC2 ZINC000817965896 632764482 /nfs/dbraw/zinc/76/44/82/632764482.db2.gz WTMMFCRYCDTZDP-MEDUHNTESA-N 2 0 274.408 2.659 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(O)c1C ZINC000817969923 632768554 /nfs/dbraw/zinc/76/85/54/632768554.db2.gz IICXXGRWWRSVOQ-IHRRRGAJSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000817970533 632769400 /nfs/dbraw/zinc/76/94/00/632769400.db2.gz ZHNWGHZNDOEQIM-WCQGTBRESA-N 2 0 268.788 2.966 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c(O)c1C ZINC000817971629 632771137 /nfs/dbraw/zinc/77/11/37/632771137.db2.gz OMCMBZYEFYNWAX-WHOFXGATSA-N 2 0 262.397 2.658 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000817972614 632772513 /nfs/dbraw/zinc/77/25/13/632772513.db2.gz YNAUFPXAWSZPGC-JKIFEVAISA-N 2 0 275.440 2.791 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1O ZINC000817976192 632774513 /nfs/dbraw/zinc/77/45/13/632774513.db2.gz HSZJSOQTOBZVIY-HIFRSBDPSA-N 2 0 260.381 2.575 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1O ZINC000817976458 632774560 /nfs/dbraw/zinc/77/45/60/632774560.db2.gz YYZWDSVJJCRNMW-MGPQQGTHSA-N 2 0 262.397 2.808 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000817976535 632774649 /nfs/dbraw/zinc/77/46/49/632774649.db2.gz NDEQOKHXKJMTAC-OLZOCXBDSA-N 2 0 250.386 2.869 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000817978051 632774844 /nfs/dbraw/zinc/77/48/44/632774844.db2.gz USPSTHDDCYOXCN-UONOGXRCSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000817978214 632776200 /nfs/dbraw/zinc/77/62/00/632776200.db2.gz YMUHJBLZEKHTHZ-UWVGGRQHSA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000846705041 632778316 /nfs/dbraw/zinc/77/83/16/632778316.db2.gz XLPHQVJBDCNNDR-PJFORWJISA-N 2 0 273.424 2.577 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000817987022 632782259 /nfs/dbraw/zinc/78/22/59/632782259.db2.gz PDZGHYXZTNUURD-LJISPDSOSA-N 2 0 274.408 2.739 20 10 CFCDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]Cc1cc(Br)ccc1O ZINC000818431752 632843560 /nfs/dbraw/zinc/84/35/60/632843560.db2.gz SNGQRNQUZSBEMA-VXGBXAGGSA-N 2 0 299.212 2.514 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC2([NH3+])CCCC2)cc1 ZINC000849349849 633626165 /nfs/dbraw/zinc/62/61/65/633626165.db2.gz LDQDMMVRJMSVGV-UHFFFAOYSA-N 2 0 275.440 2.894 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1C ZINC000858245601 636162804 /nfs/dbraw/zinc/16/28/04/636162804.db2.gz KHTCFQYSGHIULB-HNNXBMFYSA-N 2 0 276.424 2.831 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1 ZINC000858245154 636162892 /nfs/dbraw/zinc/16/28/92/636162892.db2.gz NZMGECUYLWPMEM-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP CCOc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c(O)c1 ZINC000858244632 636163001 /nfs/dbraw/zinc/16/30/01/636163001.db2.gz DYCKRHVZPRTYOK-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP Cc1ccc([C@H](C)N[C@H]2CC[C@H](C)[NH2+]C2)c(O)c1C ZINC000863547036 637693058 /nfs/dbraw/zinc/69/30/58/637693058.db2.gz OEKIZSXSWRYNLJ-UBHSHLNASA-N 2 0 262.397 2.800 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1C ZINC000872251510 641718060 /nfs/dbraw/zinc/71/80/60/641718060.db2.gz LGGVFERBIGEQEF-HNNXBMFYSA-N 2 0 276.424 2.877 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873220074 642073013 /nfs/dbraw/zinc/07/30/13/642073013.db2.gz JABJPHHTHJYXKH-AWEZNQCLSA-N 2 0 275.440 2.539 20 10 CFCDRP COc1cccc(O)c1C[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000873223143 642076787 /nfs/dbraw/zinc/07/67/87/642076787.db2.gz IGBJOFGJPAOQEQ-QGZVFWFLSA-N 2 0 292.423 2.598 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000873239686 642090221 /nfs/dbraw/zinc/09/02/21/642090221.db2.gz AQTHRVRTCJJWTL-MGPQQGTHSA-N 2 0 262.397 2.869 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000873263140 642106496 /nfs/dbraw/zinc/10/64/96/642106496.db2.gz GOMQJAOXTIINIQ-XQLPTFJDSA-N 2 0 274.408 2.882 20 10 CFCDRP CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccccc1O ZINC000873268251 642111291 /nfs/dbraw/zinc/11/12/91/642111291.db2.gz BAZIGTWHGLHIQE-IUODEOHRSA-N 2 0 262.397 2.821 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(C)cccc2O)[C@H](C)C1 ZINC000876763683 643000198 /nfs/dbraw/zinc/00/01/98/643000198.db2.gz LZEFUNYXDLZPAD-ZBFHGGJFSA-N 2 0 276.424 2.863 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c(O)c1 ZINC000876948290 643075334 /nfs/dbraw/zinc/07/53/34/643075334.db2.gz KMVSFSURGIOLPK-HNNXBMFYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000877020559 643107531 /nfs/dbraw/zinc/10/75/31/643107531.db2.gz XQVAUCQTTVJMLE-OAHLLOKOSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(O)c1 ZINC000877068560 643133581 /nfs/dbraw/zinc/13/35/81/643133581.db2.gz RSWVTWIHHISYIN-MQVJKMGUSA-N 2 0 274.408 2.806 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2c(C)cccc2O)CC1 ZINC000877143414 643176033 /nfs/dbraw/zinc/17/60/33/643176033.db2.gz NZZXATSIZYDCID-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000877644397 643428483 /nfs/dbraw/zinc/42/84/83/643428483.db2.gz UFNUXKQMMABDLI-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)CC1CC[NH2+]CC1 ZINC000094021224 650950874 /nfs/dbraw/zinc/95/08/74/650950874.db2.gz TVIHQZCYBMWNGF-UHFFFAOYSA-N 2 0 289.467 2.963 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000251160905 650985004 /nfs/dbraw/zinc/98/50/04/650985004.db2.gz MIIKDVOIOSDGDZ-GOEBONIOSA-N 2 0 274.408 2.665 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC34CCC4)cc2)CC1 ZINC000883290536 645723859 /nfs/dbraw/zinc/72/38/59/645723859.db2.gz XGAMXRYKKNQPEN-GOSISDBHSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@H]([NH2+]CCCSc1nccs1)C1CC[NH+](C)CC1 ZINC000132314888 645905840 /nfs/dbraw/zinc/90/58/40/645905840.db2.gz SHGLKRMWTMGKGQ-LBPRGKRZSA-N 2 0 299.509 2.945 20 10 CFCDRP C[NH+](C)CC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000132798385 645965420 /nfs/dbraw/zinc/96/54/20/645965420.db2.gz HULYCJCPLDAKPP-UHFFFAOYSA-N 2 0 282.815 2.819 20 10 CFCDRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1O ZINC000925799128 648327574 /nfs/dbraw/zinc/32/75/74/648327574.db2.gz UBDOSGFXEZDHFX-NFAWXSAZSA-N 2 0 262.397 2.679 20 10 CFCDRP Cc1cc(C)c(C[N@@H+](C)C2CCN(C)CC2)c(O)c1 ZINC001231841102 777345596 /nfs/dbraw/zinc/34/55/96/777345596.db2.gz DCXCRSSOEKVRQO-UHFFFAOYSA-N 2 0 262.397 2.535 20 10 CFCDRP C[NH+](C)CC1CC[NH+](Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232261071 777496348 /nfs/dbraw/zinc/49/63/48/777496348.db2.gz BHJIIZFFGXMNRJ-UHFFFAOYSA-N 2 0 298.814 2.525 20 10 CFCDRP CC(C)(C)c1cc(O)c(CN2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1Cl ZINC001235209215 778415684 /nfs/dbraw/zinc/41/56/84/778415684.db2.gz JOWPRGGZRBEOTO-HBYGRHMLSA-N 2 0 294.826 2.732 20 10 CFCDRP C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235695704 778540629 /nfs/dbraw/zinc/54/06/29/778540629.db2.gz ZTXLAVFZSCLFPI-JKSUJKDBSA-N 2 0 287.451 2.717 20 10 CFCDRP CC[N@H+](CCC1CC[NH2+]CC1)Cc1ccc(N(C)C)cc1 ZINC001236279877 778758815 /nfs/dbraw/zinc/75/88/15/778758815.db2.gz SLRFIHZLKYVGNN-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP CCc1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(O)c1 ZINC001236599242 778889889 /nfs/dbraw/zinc/88/98/89/778889889.db2.gz AQADMXLLXZAYBP-HNNXBMFYSA-N 2 0 288.435 2.919 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237385023 779088966 /nfs/dbraw/zinc/08/89/66/779088966.db2.gz ZGPNUFDWJNAAHM-HKUYNNGSSA-N 2 0 299.462 2.861 20 10 CFCDRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001205116730 779257766 /nfs/dbraw/zinc/25/77/66/779257766.db2.gz HGAGPVXXVBOLBO-OAHLLOKOSA-N 2 0 270.376 2.859 20 10 CFCDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccccc1O ZINC000019914859 372208161 /nfs/dbraw/zinc/20/81/61/372208161.db2.gz YHJUAPUSASLFHT-AWEZNQCLSA-N 2 0 264.413 2.992 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000037197139 372661689 /nfs/dbraw/zinc/66/16/89/372661689.db2.gz QBVYRLMDGBGXRN-AWEZNQCLSA-N 2 0 277.456 2.991 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccccc1O ZINC000037643959 372679523 /nfs/dbraw/zinc/67/95/23/372679523.db2.gz WIOIGWIIPLFCEA-ZFWWWQNUSA-N 2 0 262.397 2.775 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000093692678 375299257 /nfs/dbraw/zinc/29/92/57/375299257.db2.gz MUYCQNPAXQVLKO-KRWDZBQOSA-N 2 0 289.467 2.916 20 10 CFCDRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c(O)c1 ZINC000125532116 377167238 /nfs/dbraw/zinc/16/72/38/377167238.db2.gz ZSIRLBJDKUEOAC-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000129920511 377489610 /nfs/dbraw/zinc/48/96/10/377489610.db2.gz DMRWFWGGLCYIIS-CYBMUJFWSA-N 2 0 294.826 2.963 20 10 CFCDRP C[N@@H+](Cc1c(O)cccc1Cl)CC1CC[NH+](C)CC1 ZINC000134005697 377975133 /nfs/dbraw/zinc/97/51/33/377975133.db2.gz GORIHNBHJCWWQK-UHFFFAOYSA-N 2 0 282.815 2.819 20 10 CFCDRP C[NH+](C)CCC1CC[NH+](Cc2ccccc2O)CC1 ZINC000179562432 380556932 /nfs/dbraw/zinc/55/69/32/380556932.db2.gz CHVIJKKVANQLCN-UHFFFAOYSA-N 2 0 262.397 2.556 20 10 CFCDRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1O ZINC000183431224 381271113 /nfs/dbraw/zinc/27/11/13/381271113.db2.gz RUVXMIYEBGIBJL-CYBMUJFWSA-N 2 0 274.408 2.917 20 10 CFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1O ZINC000296040728 381225371 /nfs/dbraw/zinc/22/53/71/381225371.db2.gz UHGJTPYKBZVVBZ-FUDCBSFHSA-N 2 0 260.381 2.668 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000185650834 381693696 /nfs/dbraw/zinc/69/36/96/381693696.db2.gz BFFZSTGRCCMCMX-MCIONIFRSA-N 2 0 292.423 2.924 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c(O)c1C ZINC000273562988 385687750 /nfs/dbraw/zinc/68/77/50/385687750.db2.gz IRANUBBEIBKAAB-JSGCOSHPSA-N 2 0 264.413 3.000 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccccc1O ZINC000020128762 171016256 /nfs/dbraw/zinc/01/62/56/171016256.db2.gz GEWLFISCAIJKTM-CQSZACIVSA-N 2 0 262.397 2.919 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccccc1O ZINC000020129085 171016637 /nfs/dbraw/zinc/01/66/37/171016637.db2.gz IHXXXCJNRXBBCY-OAHLLOKOSA-N 2 0 262.397 2.919 20 10 CFCDRP CC1CC[NH+](CCC[NH2+]Cc2cc(F)ccc2O)CC1 ZINC000226582952 521007854 /nfs/dbraw/zinc/00/78/54/521007854.db2.gz VHMMWAYGSMBYTG-UHFFFAOYSA-N 2 0 280.387 2.743 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000360253573 521155903 /nfs/dbraw/zinc/15/59/03/521155903.db2.gz IUIQFVFCURVCNF-CABCVRRESA-N 2 0 290.407 2.507 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000277587767 524394839 /nfs/dbraw/zinc/39/48/39/524394839.db2.gz UNNFARKMXGTJGN-HNNXBMFYSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1cccc(C[NH2+]CCC2CC[NH+](C)CC2)c1O ZINC000164680076 524433626 /nfs/dbraw/zinc/43/36/26/524433626.db2.gz OWFQTJPCSADQQP-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@H](C[NH2+][C@@H](C)c1ccccc1O)C[NH+]1CCCC1 ZINC000062077558 524496391 /nfs/dbraw/zinc/49/63/91/524496391.db2.gz DOPAMAJBKGHAMK-KGLIPLIRSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1C ZINC000246238656 525315306 /nfs/dbraw/zinc/31/53/06/525315306.db2.gz GHJOQUCWPIIMRC-NVXWUHKLSA-N 2 0 288.435 2.925 20 10 CFCDRP COc1cccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1O ZINC000037786293 526010174 /nfs/dbraw/zinc/01/01/74/526010174.db2.gz DMPJZUKAYCCSOV-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP COc1cccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1O ZINC000088163756 526011907 /nfs/dbraw/zinc/01/19/07/526011907.db2.gz SXMUXCRTYYRTLK-GOOCMWNKSA-N 2 0 290.407 2.506 20 10 CFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733326202 574221822 /nfs/dbraw/zinc/22/18/22/574221822.db2.gz OEFWVBKSYXFDLX-HNNXBMFYSA-N 2 0 293.430 2.712 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N(C)C)cc1 ZINC000734850242 574304036 /nfs/dbraw/zinc/30/40/36/574304036.db2.gz WKQKFTBFRJKATG-UHFFFAOYSA-N 2 0 277.456 2.916 20 10 CFCDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000044516509 618026770 /nfs/dbraw/zinc/02/67/70/618026770.db2.gz VYQXHRKASPKWBI-AWEZNQCLSA-N 2 0 275.440 2.745 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000895391772 618564490 /nfs/dbraw/zinc/56/44/90/618564490.db2.gz DWCLIOXURKNFJV-CQSZACIVSA-N 2 0 292.423 2.531 20 10 CFCDRP [NH3+]CCC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000070183445 625280561 /nfs/dbraw/zinc/28/05/61/625280561.db2.gz UITWSPBIOOYVCW-UHFFFAOYSA-N 2 0 268.788 2.606 20 10 CFCDRP CCOc1cccc(C[NH+]2CCC(CC[NH2+]C)CC2)c1O ZINC000070188863 625281080 /nfs/dbraw/zinc/28/10/80/625281080.db2.gz VMMXLTYDCLHKLN-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000105454238 619093343 /nfs/dbraw/zinc/09/33/43/619093343.db2.gz ZSKFKTYQHKTOMM-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1C ZINC000925798305 619120243 /nfs/dbraw/zinc/12/02/43/619120243.db2.gz QOECLYWWDNVSHP-VHDGCEQUSA-N 2 0 276.424 2.905 20 10 CFCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781987 619465851 /nfs/dbraw/zinc/46/58/51/619465851.db2.gz IHHJEAPZASDMHS-NHYWBVRUSA-N 2 0 296.361 2.587 20 10 CFCDRP CCC1([NH+]2CCC2)CC[NH+](Cc2ccccc2O)CC1 ZINC000895827169 619612784 /nfs/dbraw/zinc/61/27/84/619612784.db2.gz GHKFMWGZARJFCI-UHFFFAOYSA-N 2 0 274.408 2.843 20 10 CFCDRP Cc1cc(C)c([C@@H](C)N[C@H]2C[NH2+]CC2(C)C)c(O)c1 ZINC000902441184 621081144 /nfs/dbraw/zinc/08/11/44/621081144.db2.gz CNHITVAEOMQACZ-OCCSQVGLSA-N 2 0 262.397 2.658 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)cc1C ZINC000903959348 621479781 /nfs/dbraw/zinc/47/97/81/621479781.db2.gz GIRYQXNRKYWQBI-GOSISDBHSA-N 2 0 288.435 2.975 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000904412252 621593260 /nfs/dbraw/zinc/59/32/60/621593260.db2.gz QWAKQFQMSMJUKJ-OAHLLOKOSA-N 2 0 288.435 2.994 20 10 CFCDRP [NH3+]C1CC([NH2+]Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC000906511209 621995761 /nfs/dbraw/zinc/99/57/61/621995761.db2.gz YOBPELQLQIARBN-UHFFFAOYSA-N 2 0 298.386 2.551 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000841084809 622201759 /nfs/dbraw/zinc/20/17/59/622201759.db2.gz PZXJRLHYYKPEML-CVEARBPZSA-N 2 0 275.440 2.750 20 10 CFCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@@H]21 ZINC000230125640 623256841 /nfs/dbraw/zinc/25/68/41/623256841.db2.gz HIHLERHUJXRTGC-COPLHBTASA-N 2 0 280.799 2.605 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])c(O)c1 ZINC000817975727 625972302 /nfs/dbraw/zinc/97/23/02/625972302.db2.gz AAJBZQKTMDRKNV-QWHCGFSZSA-N 2 0 250.386 2.869 20 10 CFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921620388 625998421 /nfs/dbraw/zinc/99/84/21/625998421.db2.gz TVUJVPBOVDMNMG-MRXNPFEDSA-N 2 0 288.435 2.832 20 10 CFCDRP c1cn2c(n1)CC[C@H](C[NH2+]Cc1ccc3c(c1)CCCO3)C2 ZINC000922027102 626198080 /nfs/dbraw/zinc/19/80/80/626198080.db2.gz ZMYJOCIKDDQQFI-OAHLLOKOSA-N 2 0 297.402 2.560 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CC[C@H]1[NH3+] ZINC000843051076 626547802 /nfs/dbraw/zinc/54/78/02/626547802.db2.gz ACSWRMKLFURGEJ-SMDDNHRTSA-N 2 0 282.815 2.913 20 10 CFCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2O)CC1 ZINC000770508758 627526514 /nfs/dbraw/zinc/52/65/14/627526514.db2.gz GYSMCIGXZWYFDZ-UHFFFAOYSA-N 2 0 276.424 2.944 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)c1 ZINC000775368765 628016701 /nfs/dbraw/zinc/01/67/01/628016701.db2.gz FBSYIOGEEWDBPA-KGLIPLIRSA-N 2 0 292.423 2.926 20 10 CFCDRP C[C@@H](C1CC1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648478 628049466 /nfs/dbraw/zinc/04/94/66/628049466.db2.gz AAYIBOOEKAEEBO-HNNXBMFYSA-N 2 0 287.451 2.669 20 10 CFCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775653620 628050212 /nfs/dbraw/zinc/05/02/12/628050212.db2.gz KLCWBCDIEQNPGB-UHFFFAOYSA-N 2 0 287.451 2.811 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC000776252311 628122002 /nfs/dbraw/zinc/12/20/02/628122002.db2.gz BHZHYCFSADMXMV-OAHLLOKOSA-N 2 0 287.451 2.717 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CCCC[NH+](C)C)cc1 ZINC000835036014 629329957 /nfs/dbraw/zinc/32/99/57/629329957.db2.gz IRNMEGUVWZOMRL-FPLPWBNLSA-N 2 0 275.440 2.697 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC[N@@H+]1C ZINC000835042020 629337472 /nfs/dbraw/zinc/33/74/72/629337472.db2.gz FYLKZSLUOPMPCZ-AMFYOEQGSA-N 2 0 287.451 2.838 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000796673387 629948911 /nfs/dbraw/zinc/94/89/11/629948911.db2.gz CIOMAUFTALAOBT-KURKYZTESA-N 2 0 287.451 2.715 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)C[C@H](C)[NH3+])c(Cl)c1 ZINC000843128190 630822386 /nfs/dbraw/zinc/82/23/86/630822386.db2.gz IKZMFPQVLHTLDQ-VHSXEESVSA-N 2 0 256.777 2.569 20 10 CFCDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841029049 631310339 /nfs/dbraw/zinc/31/03/39/631310339.db2.gz DYVIWDHBUUOAFE-FUHWJXTLSA-N 2 0 287.451 2.894 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000841029477 631310392 /nfs/dbraw/zinc/31/03/92/631310392.db2.gz HQPMZNCLXABYCQ-RDJZCZTQSA-N 2 0 275.440 2.750 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031013 631312438 /nfs/dbraw/zinc/31/24/38/631312438.db2.gz QTTQJDBQHNCAJN-MFKMUULPSA-N 2 0 298.814 2.661 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1F ZINC000841037760 631315679 /nfs/dbraw/zinc/31/56/79/631315679.db2.gz WYMMEWFSKDGTLT-AWEZNQCLSA-N 2 0 293.430 2.761 20 10 CFCDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000841055720 631322441 /nfs/dbraw/zinc/32/24/41/631322441.db2.gz URKMFRQAEHIZQD-NWDGAFQWSA-N 2 0 299.212 2.514 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000841056346 631324767 /nfs/dbraw/zinc/32/47/67/631324767.db2.gz FIUZIEXILKGWLU-SNAWJCMRSA-N 2 0 287.451 2.745 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841072345 631330973 /nfs/dbraw/zinc/33/09/73/631330973.db2.gz IVKHNYJRKUQRSS-ZDUSSCGKSA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC23CC[NH2+]CC3)c(Cl)c1 ZINC000841078133 631331976 /nfs/dbraw/zinc/33/19/76/631331976.db2.gz DLPSYHGQTYKMAU-AWEZNQCLSA-N 2 0 280.799 2.586 20 10 CFCDRP C[N@H+](CCCCCCC[NH3+])Cc1ccccc1O ZINC000842471923 631639065 /nfs/dbraw/zinc/63/90/65/631639065.db2.gz HISDDCNZGJXZEQ-UHFFFAOYSA-N 2 0 250.386 2.733 20 10 CFCDRP C[NH2+]C[C@@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000843045407 631811383 /nfs/dbraw/zinc/81/13/83/631811383.db2.gz WQGHHEWAGVOCSD-AATOQMJSSA-N 2 0 287.451 2.697 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH3+])CC2)c(Cl)c1 ZINC000843047584 631814234 /nfs/dbraw/zinc/81/42/34/631814234.db2.gz OVAIYVYLLZLFSX-UHFFFAOYSA-N 2 0 268.788 2.525 20 10 CFCDRP CC[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000843050210 631814911 /nfs/dbraw/zinc/81/49/11/631814911.db2.gz BUDAEFNTNCHFKG-ROEZOGTPSA-N 2 0 287.451 2.825 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000843050952 631815035 /nfs/dbraw/zinc/81/50/35/631815035.db2.gz CJXYGYPWEBJWJX-BWTRYIQHSA-N 2 0 287.451 2.825 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c1O ZINC000843051947 631816501 /nfs/dbraw/zinc/81/65/01/631816501.db2.gz NANOZDUCRREYRP-RYUDHWBXSA-N 2 0 282.815 2.913 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C)C2)cc1 ZINC000843053483 631818040 /nfs/dbraw/zinc/81/80/40/631818040.db2.gz YSWJAOWYDQQTAB-INIZCTEOSA-N 2 0 275.440 2.574 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1F ZINC000843057051 631820891 /nfs/dbraw/zinc/82/08/91/631820891.db2.gz FULYQOUAXOLNGW-HIFRSBDPSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1O ZINC000843060184 631822798 /nfs/dbraw/zinc/82/27/98/631822798.db2.gz XLBRRPPJYSONIE-GLQYFDAESA-N 2 0 294.826 2.913 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1O ZINC000843060185 631823316 /nfs/dbraw/zinc/82/33/16/631823316.db2.gz XLBRRPPJYSONIE-NILFDRSVSA-N 2 0 294.826 2.913 20 10 CFCDRP CC(C)[N@H+](Cc1ccc(N(C)C)cc1)CC(C)(C)[NH3+] ZINC000843061049 631823741 /nfs/dbraw/zinc/82/37/41/631823741.db2.gz XZHFGAKBWNWOLS-UHFFFAOYSA-N 2 0 263.429 2.700 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1C ZINC000843111998 631838590 /nfs/dbraw/zinc/83/85/90/631838590.db2.gz BTDDNQYUCCOTSO-CQSZACIVSA-N 2 0 262.397 2.570 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843120204 631841086 /nfs/dbraw/zinc/84/10/86/631841086.db2.gz VPYAHIOUAPCURF-UHFFFAOYSA-N 2 0 280.799 2.621 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000843119336 631841324 /nfs/dbraw/zinc/84/13/24/631841324.db2.gz YXWNDIHHACDTAZ-GOSISDBHSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000843119337 631841711 /nfs/dbraw/zinc/84/17/11/631841711.db2.gz YXWNDIHHACDTAZ-SFHVURJKSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC000843126251 631844852 /nfs/dbraw/zinc/84/48/52/631844852.db2.gz GXYYHCUQTHSLEE-JKSUJKDBSA-N 2 0 288.435 2.912 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1 ZINC000843126062 631845869 /nfs/dbraw/zinc/84/58/69/631845869.db2.gz FQIRXJXNHSFPTF-ONEGZZNKSA-N 2 0 299.462 2.841 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000843126254 631845900 /nfs/dbraw/zinc/84/59/00/631845900.db2.gz HAFCPTHIUUOXSD-HKUYNNGSSA-N 2 0 299.462 2.861 20 10 CFCDRP Oc1cccc(Cl)c1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000843126765 631847104 /nfs/dbraw/zinc/84/71/04/631847104.db2.gz MTLKLTREOVKUBD-UHFFFAOYSA-N 2 0 280.799 2.621 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccc1O ZINC000843343895 631933391 /nfs/dbraw/zinc/93/33/91/631933391.db2.gz KJKVVYGQBDLTGD-GFCCVEGCSA-N 2 0 256.349 2.702 20 10 CFCDRP C[N@H+](CCCC1CC[NH2+]CC1)Cc1ccccc1O ZINC000843357780 631936551 /nfs/dbraw/zinc/93/65/51/631936551.db2.gz WECFSUODSCQSPY-UHFFFAOYSA-N 2 0 262.397 2.604 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1O ZINC000844900621 632330783 /nfs/dbraw/zinc/33/07/83/632330783.db2.gz BKQITRZWBPRRTP-IUODEOHRSA-N 2 0 262.397 2.650 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1 ZINC000844901984 632331334 /nfs/dbraw/zinc/33/13/34/632331334.db2.gz LRBKEKLMKDVXTR-XJKSGUPXSA-N 2 0 292.423 2.740 20 10 CFCDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(F)ccc1O ZINC000844926976 632339651 /nfs/dbraw/zinc/33/96/51/632339651.db2.gz XTDHTUQXMRTLOG-NSHDSACASA-N 2 0 266.360 2.572 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000817413757 632625337 /nfs/dbraw/zinc/62/53/37/632625337.db2.gz GKKFYHCVXDIFBX-HSBZDZAISA-N 2 0 292.423 2.924 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1O ZINC000846137909 632643327 /nfs/dbraw/zinc/64/33/27/632643327.db2.gz NXYNXWRNLNXWLG-LBPRGKRZSA-N 2 0 280.412 2.639 20 10 CFCDRP Cc1cccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817865745 632715216 /nfs/dbraw/zinc/71/52/16/632715216.db2.gz NOBLHGCWSCOEPP-GUTXKFCHSA-N 2 0 262.397 2.506 20 10 CFCDRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901160 632725141 /nfs/dbraw/zinc/72/51/41/632725141.db2.gz STMHFHCRGCPBMX-PBHICJAKSA-N 2 0 287.451 2.547 20 10 CFCDRP c1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc2c1OCC2 ZINC000817902378 632726070 /nfs/dbraw/zinc/72/60/70/632726070.db2.gz OYVWILSOAGTAMQ-YESZJQIVSA-N 2 0 286.419 2.632 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)c1cc(F)ccc1O ZINC000817938305 632742815 /nfs/dbraw/zinc/74/28/15/632742815.db2.gz INQIZSIFPZDXTE-NSHDSACASA-N 2 0 266.360 2.844 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC2([NH3+])CCCCC2)c1 ZINC000817938010 632743026 /nfs/dbraw/zinc/74/30/26/632743026.db2.gz BHUXZDDZWVBJLI-GFCCVEGCSA-N 2 0 278.396 2.713 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000817943481 632746475 /nfs/dbraw/zinc/74/64/75/632746475.db2.gz OLVCDEDAUBZNDY-CQSZACIVSA-N 2 0 263.429 2.793 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817942753 632746638 /nfs/dbraw/zinc/74/66/38/632746638.db2.gz DFXHXWQYHPVPQF-ZYHUDNBSSA-N 2 0 266.360 2.669 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)c2c1c(F)ccc2O ZINC000817947096 632749226 /nfs/dbraw/zinc/74/92/26/632749226.db2.gz JYCPKQMXVQHVMG-PGHLRGPGSA-N 2 0 278.371 2.939 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c1O ZINC000817953681 632753783 /nfs/dbraw/zinc/75/37/83/632753783.db2.gz SMABDBNGOUMCBD-UWVGGRQHSA-N 2 0 256.777 2.742 20 10 CFCDRP CC[C@H]([NH2+]CC(C)(C)[NH3+])c1cc(Cl)ccc1O ZINC000817959698 632757714 /nfs/dbraw/zinc/75/77/14/632757714.db2.gz GSXITRCHHKQLNM-NSHDSACASA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)[NH3+])c1cc(Br)ccc1O ZINC000817959987 632757918 /nfs/dbraw/zinc/75/79/18/632757918.db2.gz JRMRRHWCSBFJGG-MRVPVSSYSA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817965397 632763959 /nfs/dbraw/zinc/76/39/59/632763959.db2.gz TZCJMUGHEBLMIJ-RHSMWYFYSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817967849 632766397 /nfs/dbraw/zinc/76/63/97/632766397.db2.gz MMGPNKXZZOHZAO-KRWDZBQOSA-N 2 0 273.424 2.713 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c(O)c1C ZINC000817967723 632766706 /nfs/dbraw/zinc/76/67/06/632766706.db2.gz LHTFRDUVQJDPRM-ZDUSSCGKSA-N 2 0 260.381 2.579 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817969053 632767392 /nfs/dbraw/zinc/76/73/92/632767392.db2.gz QJQCJERQNHZJLE-DOTOQJQBSA-N 2 0 275.440 2.935 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c(O)c1 ZINC000817971401 632771291 /nfs/dbraw/zinc/77/12/91/632771291.db2.gz LWMWJISQEAZFSK-MELADBBJSA-N 2 0 262.397 2.800 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000817977033 632774921 /nfs/dbraw/zinc/77/49/21/632774921.db2.gz ZMFNYAAVIHVEEE-YOEHRIQHSA-N 2 0 287.451 2.935 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c(O)c1 ZINC000817978205 632776130 /nfs/dbraw/zinc/77/61/30/632776130.db2.gz YLDZKKBZPCIJQH-CHWSQXEVSA-N 2 0 250.386 2.787 20 10 CFCDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N(C)C)cc1 ZINC000817979335 632776247 /nfs/dbraw/zinc/77/62/47/632776247.db2.gz AGUSNYLHAYYUAP-GOEBONIOSA-N 2 0 275.440 2.935 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817979383 632776319 /nfs/dbraw/zinc/77/63/19/632776319.db2.gz JYHSKPKDKPFPTG-WCQYABFASA-N 2 0 258.365 2.933 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000817980708 632777761 /nfs/dbraw/zinc/77/77/61/632777761.db2.gz WPBWYNLPBVRQAT-PWSUYJOCSA-N 2 0 256.777 2.824 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817981437 632777836 /nfs/dbraw/zinc/77/78/36/632777836.db2.gz JIDFYEYYPYCYCT-UNEWFSDZSA-N 2 0 275.440 2.921 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817982309 632778941 /nfs/dbraw/zinc/77/89/41/632778941.db2.gz RMKGEQGCBBBGKS-KCQAQPDRSA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000817987021 632782160 /nfs/dbraw/zinc/78/21/60/632782160.db2.gz PDZGHYXZTNUURD-GBJTYRQASA-N 2 0 274.408 2.739 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])c1O ZINC000818431002 632843721 /nfs/dbraw/zinc/84/37/21/632843721.db2.gz CPXSQYJDFUEIGY-CHWSQXEVSA-N 2 0 268.788 2.714 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCCN3CCCC[C@H]23)cc1 ZINC000848574340 633293891 /nfs/dbraw/zinc/29/38/91/633293891.db2.gz CQRGGKSDTGIVAP-QZTJIDSGSA-N 2 0 287.451 2.859 20 10 CFCDRP CCc1cccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1O ZINC000848895959 633381933 /nfs/dbraw/zinc/38/19/33/633381933.db2.gz ZOXDLRGUNWPRSY-UHFFFAOYSA-N 2 0 288.435 2.919 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)c1O ZINC000848910818 633394834 /nfs/dbraw/zinc/39/48/34/633394834.db2.gz ACGBRZBTBDWUPM-DOTOQJQBSA-N 2 0 288.435 2.871 20 10 CFCDRP Oc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093919 634902554 /nfs/dbraw/zinc/90/25/54/634902554.db2.gz UINGUJWTHBONNT-OAHLLOKOSA-N 2 0 274.408 2.604 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)c2c1c(F)ccc2O ZINC000854224466 635263740 /nfs/dbraw/zinc/26/37/40/635263740.db2.gz XRIFTJCMELUFLD-CMPLNLGQSA-N 2 0 278.371 2.941 20 10 CFCDRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1ccccc1O ZINC000854230279 635266001 /nfs/dbraw/zinc/26/60/01/635266001.db2.gz LPJOGNOJHQFJTE-KGLIPLIRSA-N 2 0 250.386 2.806 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000854230282 635266902 /nfs/dbraw/zinc/26/69/02/635266902.db2.gz LSAPYXYIRKHLPK-ZWNOBZJWSA-N 2 0 254.349 2.555 20 10 CFCDRP Cc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000858239692 636160520 /nfs/dbraw/zinc/16/05/20/636160520.db2.gz SEIDHKZEQMYUSW-CQSZACIVSA-N 2 0 262.397 2.663 20 10 CFCDRP CCOc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c(O)c1 ZINC000858244633 636162759 /nfs/dbraw/zinc/16/27/59/636162759.db2.gz DYCKRHVZPRTYOK-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000858244752 636162862 /nfs/dbraw/zinc/16/28/62/636162862.db2.gz GUSJGUVIEKFFOD-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000858491318 636270052 /nfs/dbraw/zinc/27/00/52/636270052.db2.gz FDWWDIXEOATVQN-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2c(O)cccc2Cl)C1 ZINC000872251238 641717571 /nfs/dbraw/zinc/71/75/71/641717571.db2.gz IPEQPROVRUYILR-NSHDSACASA-N 2 0 282.815 2.913 20 10 CFCDRP CCOc1cccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1O ZINC000872251225 641717657 /nfs/dbraw/zinc/71/76/57/641717657.db2.gz HZWBNIQWEGODSK-CQSZACIVSA-N 2 0 292.423 2.659 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000872252080 641717779 /nfs/dbraw/zinc/71/77/79/641717779.db2.gz OQVRXHJTZNSHNQ-AWEZNQCLSA-N 2 0 292.423 2.659 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1O ZINC000873248432 642094564 /nfs/dbraw/zinc/09/45/64/642094564.db2.gz ADARCEUJNAQTBM-JBLDHEPKSA-N 2 0 268.788 2.742 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873254404 642100183 /nfs/dbraw/zinc/10/01/83/642100183.db2.gz SKHFHADEKOHLPN-NFAWXSAZSA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c(O)c1 ZINC000876782123 643007547 /nfs/dbraw/zinc/00/75/47/643007547.db2.gz OXMSSLZOVVNXAJ-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2c(C)cccc2O)C1 ZINC000876963915 643084701 /nfs/dbraw/zinc/08/47/01/643084701.db2.gz KSCOHGCSIYIZHE-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)c(O)c1 ZINC000877181605 643192429 /nfs/dbraw/zinc/19/24/29/643192429.db2.gz FFHRFPMPZWBCJF-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)c(O)c1 ZINC000877458561 643280273 /nfs/dbraw/zinc/28/02/73/643280273.db2.gz YFQKVCMQAJGKKK-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP Cc1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c(O)c1 ZINC000877479577 643297432 /nfs/dbraw/zinc/29/74/32/643297432.db2.gz WGUZSILIPLPQBW-OAHLLOKOSA-N 2 0 262.397 2.617 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(Cl)ccc2O)CC[C@H]1[NH3+] ZINC000251848358 650995949 /nfs/dbraw/zinc/99/59/49/650995949.db2.gz RNAKRWFNTSVJBU-ZWNOBZJWSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925781635 648321167 /nfs/dbraw/zinc/32/11/67/648321167.db2.gz IYJSYZQCDCITKT-RYUDHWBXSA-N 2 0 284.350 2.596 20 10 CFCDRP CC[NH+]1CCN(c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001140300423 770491870 /nfs/dbraw/zinc/49/18/70/770491870.db2.gz PCCDTQWCJOJDCZ-UHFFFAOYSA-N 2 0 287.451 2.814 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(N(C)C)cc1 ZINC000693914759 775249398 /nfs/dbraw/zinc/24/93/98/775249398.db2.gz CXXJBTOBTFROTL-YOEHRIQHSA-N 2 0 275.440 2.888 20 10 CFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@H]2C1 ZINC001231883685 777366800 /nfs/dbraw/zinc/36/68/00/777366800.db2.gz NDAMANLPJULYAQ-IAGOWNOFSA-N 2 0 296.414 2.929 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)cc1 ZINC001235928541 778612885 /nfs/dbraw/zinc/61/28/85/778612885.db2.gz ACWGDBZASPHGEC-SJORKVTESA-N 2 0 287.451 2.574 20 10 CFCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(CC)cc3O)C[C@H]2C1 ZINC001236788757 778937422 /nfs/dbraw/zinc/93/74/22/778937422.db2.gz QDCLHDBOXJZHRZ-IAGOWNOFSA-N 2 0 288.435 2.728 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236947026 778983963 /nfs/dbraw/zinc/98/39/63/778983963.db2.gz HGRNGOSDMGGTEJ-UHFFFAOYSA-N 2 0 288.435 2.994 20 10 CFCDRP CC(C)c1ccc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(O)c1 ZINC001237048205 778998816 /nfs/dbraw/zinc/99/88/16/778998816.db2.gz BRNLTMSVYDYJQC-WBVHZDCISA-N 2 0 288.435 2.899 20 10 CFCDRP [NH3+][C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001205109539 779232749 /nfs/dbraw/zinc/23/27/49/779232749.db2.gz IAUUSRLOLCIKHX-AWEZNQCLSA-N 2 0 270.376 2.859 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@@H]4[C@@H]3C2)c1 ZINC000093537587 347678745 /nfs/dbraw/zinc/67/87/45/347678745.db2.gz ZMSJWIIGEUWNSA-BRWVUGGUSA-N 2 0 286.419 2.617 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000092043020 375084131 /nfs/dbraw/zinc/08/41/31/375084131.db2.gz QWAZUXZWFILMDM-WMZOPIPTSA-N 2 0 287.451 2.669 20 10 CFCDRP COc1cccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c1O ZINC000093660104 375288551 /nfs/dbraw/zinc/28/85/51/375288551.db2.gz CNDPNLKRGGSMFH-HNNXBMFYSA-N 2 0 292.423 2.707 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000293748121 382260789 /nfs/dbraw/zinc/26/07/89/382260789.db2.gz WOWQXTIZLLFMQO-KRWDZBQOSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CCC[NH+](C)C)c(O)c1 ZINC000293773038 382274011 /nfs/dbraw/zinc/27/40/11/382274011.db2.gz PRJLDENOBMQTDZ-CYBMUJFWSA-N 2 0 250.386 2.611 20 10 CFCDRP CC[C@@H]([NH2+]CCn1ccnc1C)c1ccc(N(C)C)cc1 ZINC000268799035 384663360 /nfs/dbraw/zinc/66/33/60/384663360.db2.gz ITOSKQSSXXZPDL-QGZVFWFLSA-N 2 0 286.423 2.998 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000020129067 171016538 /nfs/dbraw/zinc/01/65/38/171016538.db2.gz DZPQLPCSKREBSJ-ZDUSSCGKSA-N 2 0 278.396 2.537 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000360253576 521155604 /nfs/dbraw/zinc/15/56/04/521155604.db2.gz IUIQFVFCURVCNF-LSDHHAIUSA-N 2 0 290.407 2.507 20 10 CFCDRP Cc1cccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c1O ZINC000289626256 524374881 /nfs/dbraw/zinc/37/48/81/524374881.db2.gz LUPRBHPEJCVILS-XYPWUTKMSA-N 2 0 274.408 2.758 20 10 CFCDRP C[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)C[NH+]1CCCC1 ZINC000094618160 524499684 /nfs/dbraw/zinc/49/96/84/524499684.db2.gz KDZAVGGWSCHLIU-CHWSQXEVSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000290421427 525341206 /nfs/dbraw/zinc/34/12/06/525341206.db2.gz KRRKHXFLXUUZRM-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000045663886 525361737 /nfs/dbraw/zinc/36/17/37/525361737.db2.gz DTVJVABQLXYNER-ZDUSSCGKSA-N 2 0 250.386 2.693 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649179 525391354 /nfs/dbraw/zinc/39/13/54/525391354.db2.gz HLZGDGBDCXBCRA-STQMWFEESA-N 2 0 260.381 2.527 20 10 CFCDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1O ZINC000278462060 525425976 /nfs/dbraw/zinc/42/59/76/525425976.db2.gz MTGZPRHKBNDZIQ-CYBMUJFWSA-N 2 0 274.408 2.917 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc(F)ccc1O ZINC000094616882 525435176 /nfs/dbraw/zinc/43/51/76/525435176.db2.gz JBKFAMFGUBDRIT-GFCCVEGCSA-N 2 0 266.360 2.668 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(F)ccc1O ZINC000094617612 525504488 /nfs/dbraw/zinc/50/44/88/525504488.db2.gz ABRPQGHDDUTMEP-VXGBXAGGSA-N 2 0 278.371 2.666 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)c(O)c1 ZINC000049553638 525941702 /nfs/dbraw/zinc/94/17/02/525941702.db2.gz DIVKWVHBQWDJEY-OLZOCXBDSA-N 2 0 250.386 2.691 20 10 CFCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743399130 574362686 /nfs/dbraw/zinc/36/26/86/574362686.db2.gz QREYFTPWEGUHMB-AWEZNQCLSA-N 2 0 288.435 2.655 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000106869067 619124538 /nfs/dbraw/zinc/12/45/38/619124538.db2.gz ZCQVVWPNYWXETH-JKSUJKDBSA-N 2 0 274.408 2.720 20 10 CFCDRP C[C@@H]1C[C@@H](C[N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC000841002667 620188582 /nfs/dbraw/zinc/18/85/82/620188582.db2.gz ASUAEYWAYJBLRG-ZBFHGGJFSA-N 2 0 275.440 2.573 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000841062048 620424320 /nfs/dbraw/zinc/42/43/20/620424320.db2.gz RNPCSRWYOBWPRJ-ZBFHGGJFSA-N 2 0 275.440 2.763 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1F ZINC000841073742 621142771 /nfs/dbraw/zinc/14/27/71/621142771.db2.gz XDTLEQWKOLJGQO-CQSZACIVSA-N 2 0 279.403 2.514 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCC[NH2+]C1 ZINC000903726960 621428135 /nfs/dbraw/zinc/42/81/35/621428135.db2.gz PONZPKGLTYRYJF-OAHLLOKOSA-N 2 0 276.424 2.994 20 10 CFCDRP CCC1([NH3+])CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000903947479 621485092 /nfs/dbraw/zinc/48/50/92/621485092.db2.gz WRFNEZCQWKKYFD-UHFFFAOYSA-N 2 0 262.397 2.712 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(F)c2[O-])C[C@H]1CC[NH3+] ZINC000903976827 621493490 /nfs/dbraw/zinc/49/34/90/621493490.db2.gz CJACXFBIENDLBR-NXEZZACHSA-N 2 0 286.778 2.601 20 10 CFCDRP CCC[N@H+](Cc1ccccc1O)C[C@@]1(C)CCC[NH2+]C1 ZINC000904315843 621571410 /nfs/dbraw/zinc/57/14/10/621571410.db2.gz FMYXMVAKVOUMHL-KRWDZBQOSA-N 2 0 276.424 2.994 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000904412251 621593095 /nfs/dbraw/zinc/59/30/95/621593095.db2.gz QWAKQFQMSMJUKJ-HNNXBMFYSA-N 2 0 288.435 2.994 20 10 CFCDRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(F)c2[O-])CC[C@@H]1C[NH3+] ZINC000904412211 621593559 /nfs/dbraw/zinc/59/35/59/621593559.db2.gz SFGVBENGBTXGQK-VHSXEESVSA-N 2 0 286.778 2.601 20 10 CFCDRP CCOc1cccc(CN2CC[C@@]3(C2)CCCC[NH2+]3)c1O ZINC000904431566 621595440 /nfs/dbraw/zinc/59/54/40/621595440.db2.gz WRAQGMUEPXLCHW-QGZVFWFLSA-N 2 0 290.407 2.509 20 10 CFCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@H]21 ZINC000228533550 623148140 /nfs/dbraw/zinc/14/81/40/623148140.db2.gz HIHLERHUJXRTGC-MISXGVKJSA-N 2 0 280.799 2.605 20 10 CFCDRP COc1cc(Cl)cc(C[N@H+](C)C2CCC([NH3+])CC2)c1O ZINC000229104347 623182907 /nfs/dbraw/zinc/18/29/07/623182907.db2.gz QWKPBPYENRKNFW-UHFFFAOYSA-N 2 0 298.814 2.756 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1O ZINC000229103786 623183386 /nfs/dbraw/zinc/18/33/86/623183386.db2.gz XLIZZQFCPXFWOK-NSHDSACASA-N 2 0 298.814 2.615 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C4(C)CC4)CC3)cc2)CC1 ZINC000825124086 623634666 /nfs/dbraw/zinc/63/46/66/623634666.db2.gz HGNIWLMRPVLWFV-UHFFFAOYSA-N 2 0 299.462 2.861 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCN2C)cc1F ZINC000152108760 623647924 /nfs/dbraw/zinc/64/79/24/623647924.db2.gz WVPBHIQGBNBWLM-OAHLLOKOSA-N 2 0 293.430 2.856 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@H]3C3CC3)cc2)CC1 ZINC000825249906 623658865 /nfs/dbraw/zinc/65/88/65/623658865.db2.gz QSRXADXLPPPFHY-HKUYNNGSSA-N 2 0 299.462 2.574 20 10 CFCDRP [NH3+]Cc1ccc2c(c1)CCCN2CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923286817 626463149 /nfs/dbraw/zinc/46/31/49/626463149.db2.gz PXOJRFCDSGPRLT-DODVFSASSA-N 2 0 299.462 2.819 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)ccc1N(C)C ZINC000923365240 626468902 /nfs/dbraw/zinc/46/89/02/626468902.db2.gz DDYWKYBBFAOKHJ-SFHVURJKSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1cccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c1O ZINC000839179924 626529818 /nfs/dbraw/zinc/52/98/18/626529818.db2.gz AXCKKRSJTGHXQX-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC34CCCC4)cc2)CC1 ZINC000758524845 626596962 /nfs/dbraw/zinc/59/69/62/626596962.db2.gz LIWZFVYNCOUDTO-SFHVURJKSA-N 2 0 299.462 2.861 20 10 CFCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000771823432 627634345 /nfs/dbraw/zinc/63/43/45/627634345.db2.gz BLGQDKFCNPSXOE-GOSISDBHSA-N 2 0 289.467 2.963 20 10 CFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC000775711943 628057758 /nfs/dbraw/zinc/05/77/58/628057758.db2.gz KTFSAIGKMHEZCM-UHFFFAOYSA-N 2 0 287.451 2.813 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1O ZINC000775725643 628059619 /nfs/dbraw/zinc/05/96/19/628059619.db2.gz KOIPUKRKCJHGKJ-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP CC(C)[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775790662 628069188 /nfs/dbraw/zinc/06/91/88/628069188.db2.gz AUOUZNOAZBWRNP-OAHLLOKOSA-N 2 0 275.440 2.573 20 10 CFCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccccc2O)C1 ZINC000779024650 628346776 /nfs/dbraw/zinc/34/67/76/628346776.db2.gz IKWXKRCLBJLCCF-HNNXBMFYSA-N 2 0 274.408 2.556 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1 ZINC000791010792 629280573 /nfs/dbraw/zinc/28/05/73/629280573.db2.gz KHNABVRIBNTQGV-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC[N@@H+]1C ZINC000835042023 629338334 /nfs/dbraw/zinc/33/83/34/629338334.db2.gz FYLKZSLUOPMPCZ-HEDFYIJFSA-N 2 0 287.451 2.838 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCCC[N@H+](C)C2CC2)cc1F ZINC000835061986 629364073 /nfs/dbraw/zinc/36/40/73/629364073.db2.gz MFIFJXFOSPCETK-UHFFFAOYSA-N 2 0 293.430 2.856 20 10 CFCDRP COc1ccc(C[NH2+]CCCCCC[NH3+])cc1C ZINC000843129044 630832960 /nfs/dbraw/zinc/83/29/60/630832960.db2.gz QBBYYYVZDSVGRN-UHFFFAOYSA-N 2 0 250.386 2.612 20 10 CFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000040620685 649985646 /nfs/dbraw/zinc/98/56/46/649985646.db2.gz VDQJEGGBRLSFHL-MRXNPFEDSA-N 2 0 275.440 2.573 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000840951237 631279264 /nfs/dbraw/zinc/27/92/64/631279264.db2.gz YUEOBEOCVXLMAF-GOSISDBHSA-N 2 0 287.451 2.589 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+]C1CC[NH2+]CC1 ZINC000841026420 631309113 /nfs/dbraw/zinc/30/91/13/631309113.db2.gz BDNUZHOBLOSSRI-UHFFFAOYSA-N 2 0 273.424 2.519 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1C ZINC000841029552 631309992 /nfs/dbraw/zinc/30/99/92/631309992.db2.gz IFRBODCMUATJSF-HIFRSBDPSA-N 2 0 262.397 2.616 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031501 631312624 /nfs/dbraw/zinc/31/26/24/631312624.db2.gz STZCTTLGGIFDED-BXUZGUMPSA-N 2 0 282.815 2.961 20 10 CFCDRP C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCC[NH2+]C1 ZINC000841033286 631313096 /nfs/dbraw/zinc/31/30/96/631313096.db2.gz MMNZESGLCDLANK-VHSXEESVSA-N 2 0 286.778 2.662 20 10 CFCDRP C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCC[NH2+]C1 ZINC000841033287 631313795 /nfs/dbraw/zinc/31/37/95/631313795.db2.gz MMNZESGLCDLANK-ZJUUUORDSA-N 2 0 286.778 2.662 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1O ZINC000841035290 631315273 /nfs/dbraw/zinc/31/52/73/631315273.db2.gz ZLPQSOUECWEEGO-WDEREUQCSA-N 2 0 298.814 2.532 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2([NH3+])CCCCC2)cc1C ZINC000841039422 631316716 /nfs/dbraw/zinc/31/67/16/631316716.db2.gz OJFOKTSHSZRWQD-UHFFFAOYSA-N 2 0 262.397 2.760 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000841056345 631324465 /nfs/dbraw/zinc/32/44/65/631324465.db2.gz FIUZIEXILKGWLU-PLNGDYQASA-N 2 0 287.451 2.745 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c(Cl)c1 ZINC000841057429 631324777 /nfs/dbraw/zinc/32/47/77/631324777.db2.gz MNLGAHBIWQZUHB-HNNXBMFYSA-N 2 0 282.815 2.833 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1F ZINC000841062813 631328355 /nfs/dbraw/zinc/32/83/55/631328355.db2.gz CRPOBDRTOMGBRS-CZUORRHYSA-N 2 0 293.430 2.760 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c(Cl)c1 ZINC000841089850 631337143 /nfs/dbraw/zinc/33/71/43/631337143.db2.gz AYSFDHSUEHEUJY-IAQYHMDHSA-N 2 0 282.815 2.771 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000841100792 631339730 /nfs/dbraw/zinc/33/97/30/631339730.db2.gz KAOOYMULADRYAF-WBVHZDCISA-N 2 0 289.467 2.950 20 10 CFCDRP C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000842211893 631567155 /nfs/dbraw/zinc/56/71/55/631567155.db2.gz ZOPYMTHANWGWNJ-LQYUOIDQSA-N 2 0 275.440 2.553 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCCCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000843045060 631812057 /nfs/dbraw/zinc/81/20/57/631812057.db2.gz HFVUKXHGESDZJO-ZNUVNQELSA-N 2 0 287.451 2.968 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@H](C)[NH3+])CC2)c(Cl)c1 ZINC000843048759 631815191 /nfs/dbraw/zinc/81/51/91/631815191.db2.gz WFAPKBRUOBHLQW-NSHDSACASA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000843052865 631816034 /nfs/dbraw/zinc/81/60/34/631816034.db2.gz WVPSDHHCFJVEIC-GDBMZVCRSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([NH2+]CC3CC3)CC2)cc1C ZINC000843054153 631817993 /nfs/dbraw/zinc/81/79/93/631817993.db2.gz FUJUKOUFCFJSIM-UHFFFAOYSA-N 2 0 288.435 2.973 20 10 CFCDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843057182 631819724 /nfs/dbraw/zinc/81/97/24/631819724.db2.gz GJHNPHKOVDMGFI-RDJZCZTQSA-N 2 0 287.451 2.846 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000843059411 631821985 /nfs/dbraw/zinc/82/19/85/631821985.db2.gz LGVFLEBTCKDJTN-SZMVWBNQSA-N 2 0 287.451 2.702 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C[C@]2(C)CC[NH2+]C2)C2CC2)cc1 ZINC000843060913 631822901 /nfs/dbraw/zinc/82/29/01/631822901.db2.gz RQPUIWBVLDWMSZ-GOSISDBHSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c(Cl)c1 ZINC000843113770 631838160 /nfs/dbraw/zinc/83/81/60/631838160.db2.gz CURSVEJEEWCEOY-CQSZACIVSA-N 2 0 268.788 2.525 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1 ZINC000843113635 631838409 /nfs/dbraw/zinc/83/84/09/631838409.db2.gz ZUJMDUYJXRFWBI-MAVJXHJTSA-N 2 0 287.451 2.827 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000843122273 631841199 /nfs/dbraw/zinc/84/11/99/631841199.db2.gz AVFCCQDQWCTKNK-MRXNPFEDSA-N 2 0 275.440 2.764 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000843128275 631847498 /nfs/dbraw/zinc/84/74/98/631847498.db2.gz VMCCKYKTZCQLMU-AEFFLSMTSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c1 ZINC000843127934 631848041 /nfs/dbraw/zinc/84/80/41/631848041.db2.gz UQMATVGBAQDJTC-OAHLLOKOSA-N 2 0 274.408 2.522 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC3(CC[NH2+]C3)CC2)c(Cl)c1 ZINC000843128444 631848280 /nfs/dbraw/zinc/84/82/80/631848280.db2.gz XLVIAVMGNMDDBA-UHFFFAOYSA-N 2 0 294.826 2.930 20 10 CFCDRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C[NH+](C)C ZINC000813877565 631971070 /nfs/dbraw/zinc/97/10/70/631971070.db2.gz ZYDULJKNJRBAGE-NQBHXWOUSA-N 2 0 280.387 2.867 20 10 CFCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1cc(Cl)ccc1O ZINC000813877318 631971523 /nfs/dbraw/zinc/97/15/23/631971523.db2.gz RPVITWCJTXQAFZ-WDEREUQCSA-N 2 0 270.804 2.894 20 10 CFCDRP Cc1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)ccc1N(C)C ZINC000815052890 632191459 /nfs/dbraw/zinc/19/14/59/632191459.db2.gz FXWZMFJCZGLJKP-KRWDZBQOSA-N 2 0 289.467 2.835 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)ccc1N(C)C ZINC000815121249 632206696 /nfs/dbraw/zinc/20/66/96/632206696.db2.gz UCDXNLHXAWELLC-SFHVURJKSA-N 2 0 287.451 2.589 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1 ZINC000844901983 632331205 /nfs/dbraw/zinc/33/12/05/632331205.db2.gz LRBKEKLMKDVXTR-CZUORRHYSA-N 2 0 292.423 2.740 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000844904411 632332285 /nfs/dbraw/zinc/33/22/85/632332285.db2.gz LEXHIRSZGMRKNW-UHFFFAOYSA-N 2 0 283.419 2.762 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCC2(C[NH3+])CC2)c2c1c(F)ccc2O ZINC000844921607 632336655 /nfs/dbraw/zinc/33/66/55/632336655.db2.gz QGXKRGFIYGWRSA-ZYHUDNBSSA-N 2 0 278.371 2.798 20 10 CFCDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549393 632481734 /nfs/dbraw/zinc/48/17/34/632481734.db2.gz MPOZVGNJTKUYCJ-CQSZACIVSA-N 2 0 284.403 2.977 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)c1O ZINC000846137654 632643498 /nfs/dbraw/zinc/64/34/98/632643498.db2.gz DYVBADFCNINPDN-ZDUSSCGKSA-N 2 0 280.412 2.782 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1 ZINC000817865155 632714824 /nfs/dbraw/zinc/71/48/24/632714824.db2.gz JJUWSTVTQFPSDA-YDHLFZDLSA-N 2 0 292.423 2.596 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1C[NH3+] ZINC000817865077 632714978 /nfs/dbraw/zinc/71/49/78/632714978.db2.gz GDBXZSGDYUKIRL-UMVBOHGHSA-N 2 0 293.430 2.697 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1F ZINC000817903724 632727254 /nfs/dbraw/zinc/72/72/54/632727254.db2.gz TVQOMIPYBKHMQT-QWHCGFSZSA-N 2 0 281.419 2.887 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817945565 632747747 /nfs/dbraw/zinc/74/77/47/632747747.db2.gz GILADDOINPJGNX-QWRGUYRKSA-N 2 0 268.788 2.696 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(O)c1 ZINC000817945702 632748031 /nfs/dbraw/zinc/74/80/31/632748031.db2.gz JZTOOASZEUJALZ-KGLIPLIRSA-N 2 0 262.397 2.659 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817945982 632748819 /nfs/dbraw/zinc/74/88/19/632748819.db2.gz PDKKBTZHIBLONH-ZIAGYGMSSA-N 2 0 288.435 2.921 20 10 CFCDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)ccc1O ZINC000817947441 632749453 /nfs/dbraw/zinc/74/94/53/632749453.db2.gz NJMAWZKWDKJYIW-OIKLOGQESA-N 2 0 268.788 2.966 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)c2c1c(F)ccc2O ZINC000817947097 632749639 /nfs/dbraw/zinc/74/96/39/632749639.db2.gz JYCPKQMXVQHVMG-YUVKLTJASA-N 2 0 278.371 2.939 20 10 CFCDRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817954402 632753345 /nfs/dbraw/zinc/75/33/45/632753345.db2.gz CJULBLZJCNZEFL-YOEHRIQHSA-N 2 0 275.440 2.793 20 10 CFCDRP CC(C)[NH2+]CCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000817953974 632753578 /nfs/dbraw/zinc/75/35/78/632753578.db2.gz UFSXRIMABXDYOQ-AWEZNQCLSA-N 2 0 263.429 2.791 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000817957856 632756896 /nfs/dbraw/zinc/75/68/96/632756896.db2.gz PZDHXBKYXJAVDN-KBPBESRZSA-N 2 0 262.397 2.741 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000817959684 632758372 /nfs/dbraw/zinc/75/83/72/632758372.db2.gz GHZXGBAZPVLOSV-GFCCVEGCSA-N 2 0 250.386 2.869 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000817960281 632758997 /nfs/dbraw/zinc/75/89/97/632758997.db2.gz LPBJFZHVTCIXBA-JTQLQIEISA-N 2 0 254.349 2.699 20 10 CFCDRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817964488 632762754 /nfs/dbraw/zinc/76/27/54/632762754.db2.gz AKFWPVVAQPVEAF-HNNXBMFYSA-N 2 0 287.451 2.937 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)ccc1O ZINC000817968995 632767486 /nfs/dbraw/zinc/76/74/86/632767486.db2.gz OTZKZZOWCWTILA-NSHDSACASA-N 2 0 286.350 2.985 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)ccc1O ZINC000817968994 632767674 /nfs/dbraw/zinc/76/76/74/632767674.db2.gz OTZKZZOWCWTILA-LLVKDONJSA-N 2 0 286.350 2.985 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c(O)c1 ZINC000817970280 632768305 /nfs/dbraw/zinc/76/83/05/632768305.db2.gz QMNBDHCDUDQSLO-IHRRRGAJSA-N 2 0 262.397 2.658 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976727 632774028 /nfs/dbraw/zinc/77/40/28/632774028.db2.gz SJKBPJYHPMRINI-CJNGLKHVSA-N 2 0 273.424 2.545 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000817976530 632774136 /nfs/dbraw/zinc/77/41/36/632774136.db2.gz NCYKVUJSMLZOLF-NEPJUHHUSA-N 2 0 266.385 2.569 20 10 CFCDRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C)cc1O ZINC000817976755 632774618 /nfs/dbraw/zinc/77/46/18/632774618.db2.gz SVHLPXJMEHDMNE-GDBMZVCRSA-N 2 0 274.408 2.883 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817978670 632776156 /nfs/dbraw/zinc/77/61/56/632776156.db2.gz CXSBKNQCDWPKAD-RISCZKNCSA-N 2 0 262.397 2.659 20 10 CFCDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N(C)C)cc1 ZINC000817979338 632776213 /nfs/dbraw/zinc/77/62/13/632776213.db2.gz AGUSNYLHAYYUAP-ZBFHGGJFSA-N 2 0 275.440 2.935 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817978671 632776330 /nfs/dbraw/zinc/77/63/30/632776330.db2.gz CXSBKNQCDWPKAD-SMDDNHRTSA-N 2 0 262.397 2.659 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000817985058 632782273 /nfs/dbraw/zinc/78/22/73/632782273.db2.gz GCOHKIHMFRIREP-ZIAGYGMSSA-N 2 0 272.392 2.644 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1C ZINC000818431397 632843405 /nfs/dbraw/zinc/84/34/05/632843405.db2.gz KXCHLJDQXPREPO-HNNXBMFYSA-N 2 0 288.435 2.973 20 10 CFCDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431822 632843461 /nfs/dbraw/zinc/84/34/61/632843461.db2.gz URZZVYVTFZLALP-HNNXBMFYSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cccc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c1O ZINC000818431337 632843770 /nfs/dbraw/zinc/84/37/70/632843770.db2.gz JKCPUEMTLYGZNJ-CQSZACIVSA-N 2 0 274.408 2.665 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CCCN3CCCC[C@@H]23)cc1 ZINC000848574341 633294127 /nfs/dbraw/zinc/29/41/27/633294127.db2.gz CQRGGKSDTGIVAP-ROUUACIJSA-N 2 0 287.451 2.859 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350818 633625657 /nfs/dbraw/zinc/62/56/57/633625657.db2.gz XKUJCEHRTINAAS-AWEZNQCLSA-N 2 0 292.398 2.743 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000862482291 637397467 /nfs/dbraw/zinc/39/74/67/637397467.db2.gz GCLFYTKEINPBAP-MRXNPFEDSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2([NH3+])CCOCC2)c1O ZINC000863541560 637689874 /nfs/dbraw/zinc/68/98/74/637689874.db2.gz OKDODXCHGLDGGG-LLVKDONJSA-N 2 0 298.814 2.513 20 10 CFCDRP COc1cccc(O)c1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000865765686 638561904 /nfs/dbraw/zinc/56/19/04/638561904.db2.gz HFKHKWGKLHHNED-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)C2CC[NH2+]CC2)c(Cl)c1 ZINC000873220379 642074394 /nfs/dbraw/zinc/07/43/94/642074394.db2.gz LSCAMFMNFYLEMY-NSHDSACASA-N 2 0 282.815 2.832 20 10 CFCDRP COc1cccc(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)c1O ZINC000873223072 642077111 /nfs/dbraw/zinc/07/71/11/642077111.db2.gz HPDAEMWLKMWXRI-QGZVFWFLSA-N 2 0 292.423 2.598 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1O ZINC000873245423 642093138 /nfs/dbraw/zinc/09/31/38/642093138.db2.gz QOJLKNQWNSVQIN-STQMWFEESA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000873255558 642101622 /nfs/dbraw/zinc/10/16/22/642101622.db2.gz HOTSCJNVIBIZJG-LALPHHSUSA-N 2 0 274.408 2.659 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c(O)c1 ZINC000873266012 642109338 /nfs/dbraw/zinc/10/93/38/642109338.db2.gz YQXPFEUNIDWHAP-APIJFGDWSA-N 2 0 274.408 2.882 20 10 CFCDRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccccc1O ZINC000873270831 642112562 /nfs/dbraw/zinc/11/25/62/642112562.db2.gz BAZIGTWHGLHIQE-SWLSCSKDSA-N 2 0 262.397 2.821 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccccc1O ZINC000873270832 642112652 /nfs/dbraw/zinc/11/26/52/642112652.db2.gz BAZIGTWHGLHIQE-WFASDCNBSA-N 2 0 262.397 2.821 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC000876771224 643004198 /nfs/dbraw/zinc/00/41/98/643004198.db2.gz PCOIHRDOJCVULO-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC000876946638 643075260 /nfs/dbraw/zinc/07/52/60/643075260.db2.gz NFZYZQXFVCTMPG-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1cccc(O)c1C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000877073716 643136494 /nfs/dbraw/zinc/13/64/94/643136494.db2.gz RAINGMVQYNSDPW-KGLIPLIRSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000877656728 643436154 /nfs/dbraw/zinc/43/61/54/643436154.db2.gz QETFSULDSMNTJD-OAHLLOKOSA-N 2 0 274.408 2.807 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1O ZINC000879648859 644363227 /nfs/dbraw/zinc/36/32/27/644363227.db2.gz FFZRURXFBKSCDH-KGLIPLIRSA-N 2 0 262.397 2.917 20 10 CFCDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128331991 644641530 /nfs/dbraw/zinc/64/15/30/644641530.db2.gz CARXKAHJBQOUOQ-LLVKDONJSA-N 2 0 268.788 2.606 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000094617962 650959968 /nfs/dbraw/zinc/95/99/68/650959968.db2.gz LTPVXJRYJGPRQG-GFCCVEGCSA-N 2 0 280.387 2.914 20 10 CFCDRP C=C/C=C/CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883260573 645704631 /nfs/dbraw/zinc/70/46/31/645704631.db2.gz ZKTTZHGHXYVPHF-SNAWJCMRSA-N 2 0 285.435 2.660 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c(O)c1C ZINC000925882438 648354489 /nfs/dbraw/zinc/35/44/89/648354489.db2.gz LWUPXBMHEPYIDP-MCIONIFRSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H](C)C1 ZINC001235821042 778567589 /nfs/dbraw/zinc/56/75/89/778567589.db2.gz XTYCBTOLVFMALW-HZPDHXFCSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(N(C)C)cc1 ZINC000693914748 775249956 /nfs/dbraw/zinc/24/99/56/775249956.db2.gz CXXJBTOBTFROTL-PBHICJAKSA-N 2 0 275.440 2.888 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(N(C)C)cc1 ZINC000693914752 775250345 /nfs/dbraw/zinc/25/03/45/775250345.db2.gz CXXJBTOBTFROTL-RHSMWYFYSA-N 2 0 275.440 2.888 20 10 CFCDRP Cc1cc(C)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)c(O)c1 ZINC001231849992 777350428 /nfs/dbraw/zinc/35/04/28/777350428.db2.gz YNAIAHPYBUXUOE-UHFFFAOYSA-N 2 0 274.408 2.537 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N(C)C)cc1O ZINC001232841778 777689838 /nfs/dbraw/zinc/68/98/38/777689838.db2.gz RWNJJXNNQZBIEV-UHFFFAOYSA-N 2 0 293.455 2.622 20 10 CFCDRP Cc1c(C[NH+]2CCC(C3C[NH2+]C3)CC2)c2ccccc2n1C ZINC001235334743 778458085 /nfs/dbraw/zinc/45/80/85/778458085.db2.gz GHUSGZDIBOOQJU-UHFFFAOYSA-N 2 0 297.446 2.918 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CCCCCCC1 ZINC001235840020 778574688 /nfs/dbraw/zinc/57/46/88/778574688.db2.gz FUDQHJOMKVGOJJ-UHFFFAOYSA-N 2 0 287.451 2.862 20 10 CFCDRP CCc1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236218367 778742909 /nfs/dbraw/zinc/74/29/09/778742909.db2.gz SOCCERXYVLTZNJ-LSDHHAIUSA-N 2 0 262.397 2.656 20 10 CFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(C)CC[NH2+]CC1 ZINC001236274805 778758704 /nfs/dbraw/zinc/75/87/04/778758704.db2.gz HRJLXAMOMGYWPV-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1c(C)cc(OC)cc1O ZINC001236816774 778950972 /nfs/dbraw/zinc/95/09/72/778950972.db2.gz WPPQVWUZRIXAKP-UHFFFAOYSA-N 2 0 294.439 2.873 20 10 CFCDRP CCCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236930782 778982413 /nfs/dbraw/zinc/98/24/13/778982413.db2.gz FRDKRAKMXLKNMW-UHFFFAOYSA-N 2 0 293.430 2.809 20 10 CFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@@H]2C1 ZINC001237051088 778999989 /nfs/dbraw/zinc/99/99/89/778999989.db2.gz HGRKMUFAMHYFFU-IRXDYDNUSA-N 2 0 288.435 2.899 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1 ZINC000700818907 780726312 /nfs/dbraw/zinc/72/63/12/780726312.db2.gz ORYXVKDUQQWFFD-INIZCTEOSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccccc1O ZINC000705991758 781151297 /nfs/dbraw/zinc/15/12/97/781151297.db2.gz VTVLEGRRPLFKAZ-KGLIPLIRSA-N 2 0 262.397 2.775 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@@H]4[C@@H]3C2)cc1 ZINC000093536353 347678667 /nfs/dbraw/zinc/67/86/67/347678667.db2.gz SWRMTTUXGBAJAD-BHIYHBOVSA-N 2 0 299.462 2.669 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(OC)c2O)[C@H](C)C1 ZINC000093639355 375276868 /nfs/dbraw/zinc/27/68/68/375276868.db2.gz KWTWKZRCDDELQE-UKRRQHHQSA-N 2 0 292.423 2.563 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C ZINC000131323960 377696687 /nfs/dbraw/zinc/69/66/87/377696687.db2.gz KFRRYQAFDORGTP-MRXNPFEDSA-N 2 0 288.435 2.927 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(C)c2O)C1 ZINC000180524018 380671342 /nfs/dbraw/zinc/67/13/42/380671342.db2.gz KOXKBQKXLFDVCA-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP C[N@H+](Cc1cc(F)ccc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000289268669 381029438 /nfs/dbraw/zinc/02/94/38/381029438.db2.gz GDMXIGFPDPRBFW-YIONKMFJSA-N 2 0 278.371 2.588 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1O ZINC000183544873 381286202 /nfs/dbraw/zinc/28/62/02/381286202.db2.gz NACKIHOXALDXRF-MJBXVCDLSA-N 2 0 262.397 2.916 20 10 CFCDRP C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000185672114 381699313 /nfs/dbraw/zinc/69/93/13/381699313.db2.gz WUQZEWOTZKHRAH-NTZNESFSSA-N 2 0 278.371 2.807 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2CC([NH+]3CCCCC3)C2)c1 ZINC000373486067 382014887 /nfs/dbraw/zinc/01/48/87/382014887.db2.gz QHIIOPBQONJGAJ-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H](c3nccn3C)C2)cc1C ZINC000366814189 382551299 /nfs/dbraw/zinc/55/12/99/382551299.db2.gz KNDWESMHQULQGT-CQSZACIVSA-N 2 0 285.391 2.732 20 10 CFCDRP COc1ccc(O)c([C@H](C)[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1 ZINC000367316992 382563722 /nfs/dbraw/zinc/56/37/22/382563722.db2.gz GTHOSEVVDZIEBN-KBPBESRZSA-N 2 0 292.423 2.878 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245584747 285398635 /nfs/dbraw/zinc/39/86/35/285398635.db2.gz DCSMWMGYDVSDDP-YOEHRIQHSA-N 2 0 286.419 2.841 20 10 CFCDRP COc1ccc(C[NH2+]CCCn2ccnc2C)cc1C ZINC000069754383 397590301 /nfs/dbraw/zinc/59/03/01/397590301.db2.gz SZPKEMPXQKCRDO-UHFFFAOYSA-N 2 0 273.380 2.688 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000363168340 267078409 /nfs/dbraw/zinc/07/84/09/267078409.db2.gz XFOLWUCWIUHMMF-HOTGVXAUSA-N 2 0 274.408 2.725 20 10 CFCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)c(C)cc2O)C1 ZINC000173499860 520248776 /nfs/dbraw/zinc/24/87/76/520248776.db2.gz QIKZLBSCILGRGX-HNNXBMFYSA-N 2 0 276.424 2.783 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CC)C2)cc1 ZINC000037644244 520905711 /nfs/dbraw/zinc/90/57/11/520905711.db2.gz TXECTPWUMDUELA-KRWDZBQOSA-N 2 0 289.467 2.964 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000290575994 522177658 /nfs/dbraw/zinc/17/76/58/522177658.db2.gz UEIKCESYHUMVCR-WMZOPIPTSA-N 2 0 287.451 2.669 20 10 CFCDRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccccc1O ZINC000274731981 522573373 /nfs/dbraw/zinc/57/33/73/522573373.db2.gz CFFGBAOBQRDACQ-HNNXBMFYSA-N 2 0 260.381 2.695 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH+](C)C)c1ccc(C)cc1O ZINC000279975626 522580172 /nfs/dbraw/zinc/58/01/72/522580172.db2.gz DFXASEJZPDJRMV-AWEZNQCLSA-N 2 0 250.386 2.693 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H](C)C[NH+](C)C)c1ccc(C)cc1O ZINC000293269754 522607538 /nfs/dbraw/zinc/60/75/38/522607538.db2.gz CIWDGTPCUYYRDA-HIFRSBDPSA-N 2 0 264.413 2.939 20 10 CFCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(O)cccc3Cl)CC[C@H]21 ZINC000228183467 523857263 /nfs/dbraw/zinc/85/72/63/523857263.db2.gz CHXVLGSODXCNKG-SWLSCSKDSA-N 2 0 294.826 2.962 20 10 CFCDRP CN1CCCc2cc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)ccc21 ZINC000192780864 524031312 /nfs/dbraw/zinc/03/13/12/524031312.db2.gz VPEZJYKCMHSQSQ-AYHJJNSGSA-N 2 0 299.462 2.784 20 10 CFCDRP C[C@H](C[NH2+][C@H](C)c1ccccc1O)C[NH+]1CCCC1 ZINC000062077560 524500264 /nfs/dbraw/zinc/50/02/64/524500264.db2.gz DOPAMAJBKGHAMK-ZIAGYGMSSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(O)c1 ZINC000157552359 525936698 /nfs/dbraw/zinc/93/66/98/525936698.db2.gz LUCHVOCJUVLUGI-RRFJBIMHSA-N 2 0 274.408 2.978 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+](C)C)c2c1c(F)ccc2O ZINC000756342550 574227271 /nfs/dbraw/zinc/22/72/71/574227271.db2.gz KOXPZVASGJFXGB-ZYHUDNBSSA-N 2 0 266.360 2.621 20 10 CFCDRP Cc1nccn1CCC[NH2+][C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756432127 574236520 /nfs/dbraw/zinc/23/65/20/574236520.db2.gz HQJBULRWZCHNEZ-JTQLQIEISA-N 2 0 295.333 2.916 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccccc2O)CC1 ZINC000044517554 618027129 /nfs/dbraw/zinc/02/71/29/618027129.db2.gz NYACISDGLGVNEA-CYBMUJFWSA-N 2 0 262.397 2.775 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(C)cc(OC)c2O)C1 ZINC000894200669 618440242 /nfs/dbraw/zinc/44/02/42/618440242.db2.gz QGIFGVMVYDXGKY-CQSZACIVSA-N 2 0 292.423 2.531 20 10 CFCDRP Nc1ccc(CC[NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1 ZINC000925691921 618936677 /nfs/dbraw/zinc/93/66/77/618936677.db2.gz KVOODOUIPLHFQC-MSOLQXFVSA-N 2 0 287.451 2.569 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)c1 ZINC000182472142 625312322 /nfs/dbraw/zinc/31/23/22/625312322.db2.gz XWACFAHBTGACOV-STQMWFEESA-N 2 0 278.396 2.536 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000840946328 619108990 /nfs/dbraw/zinc/10/89/90/619108990.db2.gz OAMCVCGMVATCRG-INIZCTEOSA-N 2 0 289.467 2.881 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925796924 619119243 /nfs/dbraw/zinc/11/92/43/619119243.db2.gz MGQYOMFZLKQTHA-FMCLSXCISA-N 2 0 292.398 2.915 20 10 CFCDRP CCCC[C@@H](COC)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000841041769 620399084 /nfs/dbraw/zinc/39/90/84/620399084.db2.gz BTYMGKRBMDZYFR-DOTOQJQBSA-N 2 0 293.455 2.547 20 10 CFCDRP Cc1cc(C)c([C@H](C)N[C@@H]2C[NH2+]CC2(C)C)c(O)c1 ZINC000902441178 621081284 /nfs/dbraw/zinc/08/12/84/621081284.db2.gz CNHITVAEOMQACZ-GXTWGEPZSA-N 2 0 262.397 2.658 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)c1 ZINC000903959654 621479774 /nfs/dbraw/zinc/47/97/74/621479774.db2.gz LLAPEGDEBYXOBG-QGZVFWFLSA-N 2 0 274.408 2.666 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC000903959653 621479803 /nfs/dbraw/zinc/47/98/03/621479803.db2.gz LLAPEGDEBYXOBG-KRWDZBQOSA-N 2 0 274.408 2.666 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904301356 621568806 /nfs/dbraw/zinc/56/88/06/621568806.db2.gz LFEWTPGOXMMLRJ-CALCHBBNSA-N 2 0 287.451 2.846 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000904355076 621581671 /nfs/dbraw/zinc/58/16/71/621581671.db2.gz MXULPVCZIOTDCM-CYBMUJFWSA-N 2 0 262.397 2.619 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000904420573 621596099 /nfs/dbraw/zinc/59/60/99/621596099.db2.gz ACWGDBZASPHGEC-DLBZAZTESA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087881 622299858 /nfs/dbraw/zinc/29/98/58/622299858.db2.gz RETVGDNEWGNPSI-GDBMZVCRSA-N 2 0 274.408 2.665 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1F ZINC000841091595 622362451 /nfs/dbraw/zinc/36/24/51/622362451.db2.gz BJKKVKGHHCNDAL-UHFFFAOYSA-N 2 0 293.430 2.904 20 10 CFCDRP C[C@@H]([NH2+]CCCCn1ccnc1)c1ccccc1O ZINC000045105517 622965311 /nfs/dbraw/zinc/96/53/11/622965311.db2.gz YVEVFZNBQKBBQX-CYBMUJFWSA-N 2 0 259.353 2.720 20 10 CFCDRP CCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(O)c1 ZINC000824989038 623601151 /nfs/dbraw/zinc/60/11/51/623601151.db2.gz YHEUBBZDINNYNE-GOOCMWNKSA-N 2 0 290.407 2.506 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070171451 625278411 /nfs/dbraw/zinc/27/84/11/625278411.db2.gz WHFPGBGPZBOMQO-WDEREUQCSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c(O)c1C ZINC000817977408 625973355 /nfs/dbraw/zinc/97/33/55/625973355.db2.gz JQLYPYWQWNUFPJ-DGCLKSJQSA-N 2 0 250.386 2.787 20 10 CFCDRP Cc1cc(C[NH2+][C@@](C)(C[NH3+])C(C)C)ccc1N(C)C ZINC000923296442 626463893 /nfs/dbraw/zinc/46/38/93/626463893.db2.gz RWSQRQYBYMZGHH-INIZCTEOSA-N 2 0 263.429 2.524 20 10 CFCDRP Cc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)ccc1N(C)C ZINC000923331326 626465890 /nfs/dbraw/zinc/46/58/90/626465890.db2.gz FXHFBINCHNIQBS-GVDBMIGSSA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)ccc1N(C)C ZINC000923348579 626467883 /nfs/dbraw/zinc/46/78/83/626467883.db2.gz ICQWFIDRIWGPBR-HNNXBMFYSA-N 2 0 275.440 2.622 20 10 CFCDRP CCOc1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000839183501 626529953 /nfs/dbraw/zinc/52/99/53/626529953.db2.gz XKOUQJYMMBBSLU-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CC[C@@H]1[NH3+] ZINC000843051062 626547784 /nfs/dbraw/zinc/54/77/84/626547784.db2.gz ACSWRMKLFURGEJ-FZMZJTMJSA-N 2 0 282.815 2.913 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000843056762 626550153 /nfs/dbraw/zinc/55/01/53/626550153.db2.gz ZJDUFOILCIWZOR-SREVYHEPSA-N 2 0 275.440 2.683 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000757673375 626557565 /nfs/dbraw/zinc/55/75/65/626557565.db2.gz FMZBFMOUYQAMNY-OAHLLOKOSA-N 2 0 294.439 2.710 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC34CCCC4)cc2)CC1 ZINC000758524843 626597053 /nfs/dbraw/zinc/59/70/53/626597053.db2.gz LIWZFVYNCOUDTO-GOSISDBHSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771830419 627635346 /nfs/dbraw/zinc/63/53/46/627635346.db2.gz QVCNOKOTAUQEBD-QAPCUYQASA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775715805 628058760 /nfs/dbraw/zinc/05/87/60/628058760.db2.gz LORMGGQJBLPHIL-HZPDHXFCSA-N 2 0 287.451 2.669 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c1O ZINC000775725646 628059368 /nfs/dbraw/zinc/05/93/68/628059368.db2.gz KOIPUKRKCJHGKJ-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000835039679 629332885 /nfs/dbraw/zinc/33/28/85/629332885.db2.gz KBKSUEGQCJUQCX-XQDHMALISA-N 2 0 287.451 2.697 20 10 CFCDRP CC(C)C1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000793189333 629502010 /nfs/dbraw/zinc/50/20/10/629502010.db2.gz MAVIJBPALMKBBB-UHFFFAOYSA-N 2 0 287.451 2.526 20 10 CFCDRP CCOc1ccc(C[N@H+](CC)CCC[NH+](C)C)c(O)c1 ZINC000809750448 631280073 /nfs/dbraw/zinc/28/00/73/631280073.db2.gz WQIWPPKDOHFYSF-UHFFFAOYSA-N 2 0 280.412 2.565 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000841064073 631328000 /nfs/dbraw/zinc/32/80/00/631328000.db2.gz OWFLLHSXWWZJDQ-WMLDXEAASA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]C2(C)CC[NH2+]CC2)c1O ZINC000841065332 631328791 /nfs/dbraw/zinc/32/87/91/631328791.db2.gz NYZDPNRLUUAUBX-UHFFFAOYSA-N 2 0 268.788 2.586 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H](C)CCC[NH3+])c1O ZINC000841078401 631332222 /nfs/dbraw/zinc/33/22/22/631332222.db2.gz CSNVQQHHAXRBEB-JTQLQIEISA-N 2 0 256.777 2.571 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)ccc1O ZINC000841081192 631332801 /nfs/dbraw/zinc/33/28/01/631332801.db2.gz WCSWZPBJLXZPJC-JTQLQIEISA-N 2 0 256.777 2.653 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H](C)CCCC[NH3+])c1O ZINC000841081689 631333072 /nfs/dbraw/zinc/33/30/72/631333072.db2.gz ZYHRABHKJURANG-JTQLQIEISA-N 2 0 286.803 2.661 20 10 CFCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Cl)cc1O ZINC000841747971 631464502 /nfs/dbraw/zinc/46/45/02/631464502.db2.gz FZUQGTVBQQTKDI-NSHDSACASA-N 2 0 280.799 2.958 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC000843046422 631814192 /nfs/dbraw/zinc/81/41/92/631814192.db2.gz VPIZOMBRWJITCR-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c(Cl)c1 ZINC000843051747 631816663 /nfs/dbraw/zinc/81/66/63/631816663.db2.gz KYXWOAGJQFFOIB-NWDGAFQWSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000843052867 631816856 /nfs/dbraw/zinc/81/68/56/631816856.db2.gz WVPSDHHCFJVEIC-HOCLYGCPSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cccc(C[N@@H+](C)CC[C@H]([NH3+])C(C)C)c1O ZINC000843056716 631820703 /nfs/dbraw/zinc/82/07/03/631820703.db2.gz XPINLBZNOCJLIA-AWEZNQCLSA-N 2 0 250.386 2.506 20 10 CFCDRP CCC[N@H+](Cc1ccccc1O)C[C@]1(C)CC[NH2+]C1 ZINC000843060979 631823138 /nfs/dbraw/zinc/82/31/38/631823138.db2.gz VHFVMNIWAIDRBX-MRXNPFEDSA-N 2 0 262.397 2.604 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000843060968 631823516 /nfs/dbraw/zinc/82/35/16/631823516.db2.gz UTCNZLWHCYDKIV-QGZVFWFLSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1C ZINC000843123742 631844129 /nfs/dbraw/zinc/84/41/29/631844129.db2.gz OZSXTKIWJCDBGX-QGZVFWFLSA-N 2 0 274.408 2.585 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1C ZINC000843126319 631844923 /nfs/dbraw/zinc/84/49/23/631844923.db2.gz JBKZFQKFBJOYFK-MRXNPFEDSA-N 2 0 288.435 2.831 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000843128278 631847452 /nfs/dbraw/zinc/84/74/52/631847452.db2.gz VMCCKYKTZCQLMU-WMZOPIPTSA-N 2 0 287.451 2.717 20 10 CFCDRP CCOc1cccc(C[NH2+]Cc2ccc(C[NH3+])cc2)c1O ZINC000843129726 631848723 /nfs/dbraw/zinc/84/87/23/631848723.db2.gz YZBHWKSZVHMOKE-UHFFFAOYSA-N 2 0 286.375 2.539 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)ccc21 ZINC000843342873 631932300 /nfs/dbraw/zinc/93/23/00/631932300.db2.gz QVJBSWQKYXDCJI-OKZBNKHCSA-N 2 0 299.462 2.547 20 10 CFCDRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000843343891 631933008 /nfs/dbraw/zinc/93/30/08/631933008.db2.gz KHEBAIRFXPKOLQ-HNNXBMFYSA-N 2 0 268.360 2.628 20 10 CFCDRP Cc1ccoc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000813790855 631960120 /nfs/dbraw/zinc/96/01/20/631960120.db2.gz GISFSIDGGUEWMV-UHFFFAOYSA-N 2 0 299.418 2.630 20 10 CFCDRP C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C[NH+](C)C ZINC000813877566 631971270 /nfs/dbraw/zinc/97/12/70/631971270.db2.gz ZYDULJKNJRBAGE-NTZNESFSSA-N 2 0 280.387 2.867 20 10 CFCDRP C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)C[NH+](C)C ZINC000813877564 631971326 /nfs/dbraw/zinc/97/13/26/631971326.db2.gz ZYDULJKNJRBAGE-MDZLAQPJSA-N 2 0 280.387 2.867 20 10 CFCDRP CC(C)C1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000815151146 632218000 /nfs/dbraw/zinc/21/80/00/632218000.db2.gz KQQJJDSUZRZJOQ-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1C ZINC000844904329 632331743 /nfs/dbraw/zinc/33/17/43/632331743.db2.gz IHDULEAKSHEWPJ-UHFFFAOYSA-N 2 0 288.366 2.897 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCC2(C[NH3+])CC2)c2c1c(F)ccc2O ZINC000844921604 632336831 /nfs/dbraw/zinc/33/68/31/632336831.db2.gz QGXKRGFIYGWRSA-CMPLNLGQSA-N 2 0 278.371 2.798 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c1O ZINC000846151357 632648136 /nfs/dbraw/zinc/64/81/36/632648136.db2.gz XAYDQHKYCAAEPK-MELADBBJSA-N 2 0 292.423 2.924 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000846168274 632652302 /nfs/dbraw/zinc/65/23/02/632652302.db2.gz JAKCENNMEIJHAS-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000817887698 632717560 /nfs/dbraw/zinc/71/75/60/632717560.db2.gz CHQNICCLLNMQRA-KBPBESRZSA-N 2 0 263.429 2.748 20 10 CFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817894288 632719938 /nfs/dbraw/zinc/71/99/38/632719938.db2.gz CXBXDJMTVLEJKX-CYBMUJFWSA-N 2 0 298.434 2.766 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCCCC[C@@H]3[NH3+])ccc21 ZINC000817901964 632725363 /nfs/dbraw/zinc/72/53/63/632725363.db2.gz ZZRMYXYUUSLVEB-DLBZAZTESA-N 2 0 287.451 2.819 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000817936304 632741875 /nfs/dbraw/zinc/74/18/75/632741875.db2.gz NMRYDKLDEKWTHE-ZDUSSCGKSA-N 2 0 261.413 2.545 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC[NH2+]CC2)c1O ZINC000817937586 632742736 /nfs/dbraw/zinc/74/27/36/632742736.db2.gz YCWHKSQVUPTYSG-JTQLQIEISA-N 2 0 268.788 2.757 20 10 CFCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817937676 632742813 /nfs/dbraw/zinc/74/28/13/632742813.db2.gz ZLHMSEFOQCIAJZ-LBPRGKRZSA-N 2 0 274.408 2.674 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817945458 632747243 /nfs/dbraw/zinc/74/72/43/632747243.db2.gz DDKDSCISMXIGOZ-ZFWWWQNUSA-N 2 0 262.397 2.741 20 10 CFCDRP [NH3+]CCc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000817950765 632752121 /nfs/dbraw/zinc/75/21/21/632752121.db2.gz ZUTFCTZHGSXMMN-INIZCTEOSA-N 2 0 282.387 2.671 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(O)c1 ZINC000817954704 632755138 /nfs/dbraw/zinc/75/51/38/632755138.db2.gz HHGMQCWWRRTNRB-UONOGXRCSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c(O)c1 ZINC000817959128 632756487 /nfs/dbraw/zinc/75/64/87/632756487.db2.gz PLIMIACKFIYONX-CHWSQXEVSA-N 2 0 250.386 2.643 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817959899 632757952 /nfs/dbraw/zinc/75/79/52/632757952.db2.gz WKIXQPODQJYWED-YUSALJHKSA-N 2 0 266.360 2.653 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817959709 632758265 /nfs/dbraw/zinc/75/82/65/632758265.db2.gz UFRGYOTYQKWZDF-LRDDRELGSA-N 2 0 276.424 2.905 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cc(F)ccc1O ZINC000817961301 632760874 /nfs/dbraw/zinc/76/08/74/632760874.db2.gz WWCYXVZGOUTSIZ-COPLHBTASA-N 2 0 266.360 2.699 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817963268 632762012 /nfs/dbraw/zinc/76/20/12/632762012.db2.gz SYXIEHUDKDUFFB-NEPJUHHUSA-N 2 0 262.397 2.516 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc(Cl)ccc1O ZINC000817962211 632762245 /nfs/dbraw/zinc/76/22/45/632762245.db2.gz IYQWBNMUKSLOSM-JOYOIKCWSA-N 2 0 256.777 2.681 20 10 CFCDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817965399 632763859 /nfs/dbraw/zinc/76/38/59/632763859.db2.gz TZCJMUGHEBLMIJ-YOEHRIQHSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCC1)c1cc2c(cc1O)CCCC2 ZINC000817965071 632764590 /nfs/dbraw/zinc/76/45/90/632764590.db2.gz OXWBAHCVQGTNQV-GFCCVEGCSA-N 2 0 274.408 2.803 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000817966121 632765300 /nfs/dbraw/zinc/76/53/00/632765300.db2.gz GVVOCNDZRSXXBE-BBRMVZONSA-N 2 0 262.397 2.741 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000817968198 632767189 /nfs/dbraw/zinc/76/71/89/632767189.db2.gz HJZZBIGZMWKFKP-GDBMZVCRSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1O ZINC000817968784 632767520 /nfs/dbraw/zinc/76/75/20/632767520.db2.gz MNUHHKSTJQPRNE-LBPRGKRZSA-N 2 0 268.360 2.846 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817977601 632775349 /nfs/dbraw/zinc/77/53/49/632775349.db2.gz LHWVTDVFXVPUCQ-CKYFFXLPSA-N 2 0 266.360 2.797 20 10 CFCDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N(C)C)cc1 ZINC000817979336 632776365 /nfs/dbraw/zinc/77/63/65/632776365.db2.gz AGUSNYLHAYYUAP-HOCLYGCPSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000846705042 632778158 /nfs/dbraw/zinc/77/81/58/632778158.db2.gz XLPHQVJBDCNNDR-RCELQXLSSA-N 2 0 273.424 2.577 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000817982224 632778731 /nfs/dbraw/zinc/77/87/31/632778731.db2.gz PQDFLXIIGUYQQC-JBLDHEPKSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817984979 632781307 /nfs/dbraw/zinc/78/13/07/632781307.db2.gz DJWSLGNCFSUGEK-SMDDNHRTSA-N 2 0 290.382 2.979 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CC2([NH3+])CCCC2)c1O ZINC000849350261 633625822 /nfs/dbraw/zinc/62/58/22/633625822.db2.gz WGJRHEDJZQJPSE-UHFFFAOYSA-N 2 0 268.788 2.715 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2([NH3+])CCCC2)c(O)c1C ZINC000854223131 635263482 /nfs/dbraw/zinc/26/34/82/635263482.db2.gz NSGMVYWYYWZWMU-CYBMUJFWSA-N 2 0 262.397 2.931 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1 ZINC000858491199 636270347 /nfs/dbraw/zinc/27/03/47/636270347.db2.gz ZXJHELKEJIAUTL-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CC2([NH3+])CCOCC2)c1O ZINC000863541561 637690285 /nfs/dbraw/zinc/69/02/85/637690285.db2.gz OKDODXCHGLDGGG-NSHDSACASA-N 2 0 298.814 2.513 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000872254178 641719530 /nfs/dbraw/zinc/71/95/30/641719530.db2.gz VEZFGTLGNJXOOL-INIZCTEOSA-N 2 0 289.467 2.929 20 10 CFCDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000873224188 642078425 /nfs/dbraw/zinc/07/84/25/642078425.db2.gz XIQXXHDYFXCWGU-MRXNPFEDSA-N 2 0 280.387 2.728 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]Cc1cccc3c1CC[NH2+]C3)CC2 ZINC000873235602 642088479 /nfs/dbraw/zinc/08/84/79/642088479.db2.gz PTJWJANHSOLSMK-KRWDZBQOSA-N 2 0 294.398 2.815 20 10 CFCDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1O ZINC000873237720 642089627 /nfs/dbraw/zinc/08/96/27/642089627.db2.gz PNNNVESBGPYQGM-CYBMUJFWSA-N 2 0 282.387 2.889 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1O ZINC000873245422 642093408 /nfs/dbraw/zinc/09/34/08/642093408.db2.gz QOJLKNQWNSVQIN-QWHCGFSZSA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc2c(cc1O)CCCC2 ZINC000873250439 642096476 /nfs/dbraw/zinc/09/64/76/642096476.db2.gz HOTSCJNVIBIZJG-SLEUVZQESA-N 2 0 274.408 2.659 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000873254955 642100740 /nfs/dbraw/zinc/10/07/40/642100740.db2.gz CCRWPUZTDDECGH-QXEWZRGKSA-N 2 0 299.212 2.543 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000873258169 642103349 /nfs/dbraw/zinc/10/33/49/642103349.db2.gz XIUOGRGCJSZWGW-XNRPHZJLSA-N 2 0 261.413 2.531 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000873263878 642107283 /nfs/dbraw/zinc/10/72/83/642107283.db2.gz MLEWMUGQUALHCB-FQUUOJAGSA-N 2 0 290.407 2.582 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000873271668 642112471 /nfs/dbraw/zinc/11/24/71/642112471.db2.gz JGENCYVNDYPSFS-STQMWFEESA-N 2 0 262.397 2.739 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)cc2O)[C@H](C)C1 ZINC000876763599 643000099 /nfs/dbraw/zinc/00/00/99/643000099.db2.gz LCHHFCJLJKPNNG-ZBFHGGJFSA-N 2 0 276.424 2.863 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000876812356 643019703 /nfs/dbraw/zinc/01/97/03/643019703.db2.gz LISHYJNQJLFFRF-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c(O)c1 ZINC000876948291 643074898 /nfs/dbraw/zinc/07/48/98/643074898.db2.gz KMVSFSURGIOLPK-OAHLLOKOSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc(C[NH2+]C2CCC(C[NH+](C)C)CC2)c(O)c1 ZINC000877113587 643157475 /nfs/dbraw/zinc/15/74/75/643157475.db2.gz CNMLYKIBANELHX-UHFFFAOYSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000247156191 650898933 /nfs/dbraw/zinc/89/89/33/650898933.db2.gz XMSWNYHWDYXNQO-NVXWUHKLSA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)ccc1N(C)C ZINC000879579513 644336488 /nfs/dbraw/zinc/33/64/88/644336488.db2.gz MZDPHXHVOSHDBQ-SJLPKXTDSA-N 2 0 287.451 2.587 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000925784201 648322427 /nfs/dbraw/zinc/32/24/27/648322427.db2.gz IFAHCTLVJZHRHL-WWGRRREGSA-N 2 0 288.435 2.777 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000925783095 648322447 /nfs/dbraw/zinc/32/24/47/648322447.db2.gz BYVDMDYJCDCENC-IPYPFGDCSA-N 2 0 262.397 2.597 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925802148 648327988 /nfs/dbraw/zinc/32/79/88/648327988.db2.gz FHLOLNRKMQNQAW-RBSFLKMASA-N 2 0 276.424 2.905 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000383341855 770957005 /nfs/dbraw/zinc/95/70/05/770957005.db2.gz WMXREYDEHZRDGX-HNNXBMFYSA-N 2 0 274.408 2.701 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CC2 ZINC000313193785 776236257 /nfs/dbraw/zinc/23/62/57/776236257.db2.gz MRUKYGANZKTCEU-RRFJBIMHSA-N 2 0 272.392 2.596 20 10 CFCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)cc(C)c1O ZINC001277518851 777218920 /nfs/dbraw/zinc/21/89/20/777218920.db2.gz CIBKFPRVDXDAPH-GOOCMWNKSA-N 2 0 278.371 2.555 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001235224748 778420922 /nfs/dbraw/zinc/42/09/22/778420922.db2.gz OEOKACXUOQFJAY-QZTJIDSGSA-N 2 0 299.462 2.718 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235227229 778421940 /nfs/dbraw/zinc/42/19/40/778421940.db2.gz FKFCJJICLYSTMT-INIZCTEOSA-N 2 0 274.408 2.746 20 10 CFCDRP C[NH+](C)CCC[N@H+](C)Cc1cc2ccccc2cc1O ZINC001236835009 778959559 /nfs/dbraw/zinc/95/95/59/778959559.db2.gz CWDTVLGROCELNB-UHFFFAOYSA-N 2 0 272.392 2.929 20 10 CFCDRP C[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236929180 778982890 /nfs/dbraw/zinc/98/28/90/778982890.db2.gz AHAZHGWSBTVKHG-CQSZACIVSA-N 2 0 291.414 2.562 20 10 CFCDRP CN(C)c1ccc(CN(C2CCC2)[C@H]2CCC[NH2+]C2)cc1 ZINC001237142701 779024826 /nfs/dbraw/zinc/02/48/26/779024826.db2.gz BLMUXJHSIOLVAQ-SFHVURJKSA-N 2 0 287.451 2.859 20 10 CFCDRP Cc1ccc(O)c(C[N@H+](C)CCCCCC[NH3+])c1 ZINC000710730508 781336095 /nfs/dbraw/zinc/33/60/95/781336095.db2.gz TUULCEZLDLMILN-UHFFFAOYSA-N 2 0 250.386 2.652 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000037197140 372661524 /nfs/dbraw/zinc/66/15/24/372661524.db2.gz QBVYRLMDGBGXRN-CQSZACIVSA-N 2 0 277.456 2.991 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c1 ZINC000092253857 375097598 /nfs/dbraw/zinc/09/75/98/375097598.db2.gz VQRACAGHLZFGSW-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000574629997 335034729 /nfs/dbraw/zinc/03/47/29/335034729.db2.gz NAEQMCCQGQFXGJ-CABCVRRESA-N 2 0 285.435 2.964 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1 ZINC000367316993 382563714 /nfs/dbraw/zinc/56/37/14/382563714.db2.gz GTHOSEVVDZIEBN-KGLIPLIRSA-N 2 0 292.423 2.878 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(C)cc2O)C1 ZINC000249372092 383342404 /nfs/dbraw/zinc/34/24/04/383342404.db2.gz CWFPHBPKDKSFLN-ZIAGYGMSSA-N 2 0 262.397 2.693 20 10 CFCDRP COc1cccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000271039880 385316052 /nfs/dbraw/zinc/31/60/52/385316052.db2.gz LXIOAUDJPUSJBQ-UHFFFAOYSA-N 2 0 292.423 2.705 20 10 CFCDRP Cc1cccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1O ZINC000271910160 385397602 /nfs/dbraw/zinc/39/76/02/385397602.db2.gz QFOLZUJXIKCMOF-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000272638609 385581231 /nfs/dbraw/zinc/58/12/31/385581231.db2.gz YYEQUJCNKAQOQN-UHFFFAOYSA-N 2 0 293.430 2.713 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(OC)ccc1O ZINC000290540078 394230995 /nfs/dbraw/zinc/23/09/95/394230995.db2.gz RERMUUDNVYEBCK-UHFFFAOYSA-N 2 0 280.412 2.565 20 10 CFCDRP CC[NH+]1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000038098137 260125824 /nfs/dbraw/zinc/12/58/24/260125824.db2.gz GBQJRKIIFUYUIB-UHFFFAOYSA-N 2 0 287.451 2.861 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000295976981 276014100 /nfs/dbraw/zinc/01/41/00/276014100.db2.gz MZCTZPYKPVXYLY-UKRRQHHQSA-N 2 0 274.408 2.701 20 10 CFCDRP CCCC[NH+]1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000037150097 520578268 /nfs/dbraw/zinc/57/82/68/520578268.db2.gz POFLWNXCTNGDPG-UHFFFAOYSA-N 2 0 262.397 2.746 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]CC2(C)CC[NH+](C)CC2)c1 ZINC000272542737 521152029 /nfs/dbraw/zinc/15/20/29/521152029.db2.gz LGHMYCRULAEGEI-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1 ZINC000161306530 522169575 /nfs/dbraw/zinc/16/95/75/522169575.db2.gz YDCGQXALGNFSRB-MRXNPFEDSA-N 2 0 275.440 2.526 20 10 CFCDRP CC[C@H]([NH2+]CCCC[NH+](C)C)c1ccccc1O ZINC000045663164 522580249 /nfs/dbraw/zinc/58/02/49/522580249.db2.gz IPLKNPFVBPMWTD-AWEZNQCLSA-N 2 0 250.386 2.775 20 10 CFCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)ccc3O)CC[C@@H]21 ZINC000156092420 523834209 /nfs/dbraw/zinc/83/42/09/523834209.db2.gz XZIJPZZQSAQDIR-DOMZBBRYSA-N 2 0 294.826 2.962 20 10 CFCDRP COc1ccc(C[NH2+]CCC[NH+]2CCCC2)cc1C ZINC000035052760 524070377 /nfs/dbraw/zinc/07/03/77/524070377.db2.gz SVLDRYLTEMSLIY-UHFFFAOYSA-N 2 0 262.397 2.579 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1O ZINC000158112106 524432692 /nfs/dbraw/zinc/43/26/92/524432692.db2.gz GQUKWUAMIZVYBL-CQSZACIVSA-N 2 0 276.424 2.912 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000157550614 524773657 /nfs/dbraw/zinc/77/36/57/524773657.db2.gz SJPYCASYBCDBLH-BFHYXJOUSA-N 2 0 290.407 2.678 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c1 ZINC000293346670 525358677 /nfs/dbraw/zinc/35/86/77/525358677.db2.gz GUEGPNQWQYJXCC-CHWSQXEVSA-N 2 0 250.386 2.549 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000273357891 525362426 /nfs/dbraw/zinc/36/24/26/525362426.db2.gz DBSYDIHBZIUVTK-ZDUSSCGKSA-N 2 0 260.381 2.613 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756788142 574262765 /nfs/dbraw/zinc/26/27/65/574262765.db2.gz BGHQHXMMTUQKHR-BXUZGUMPSA-N 2 0 290.382 2.931 20 10 CFCDRP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c(O)c1 ZINC000725845995 574327764 /nfs/dbraw/zinc/32/77/64/574327764.db2.gz TYCSMOSOXRJKBP-GJZGRUSLSA-N 2 0 290.407 2.507 20 10 CFCDRP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(O)c1 ZINC000725845998 574327774 /nfs/dbraw/zinc/32/77/74/574327774.db2.gz TYCSMOSOXRJKBP-LSDHHAIUSA-N 2 0 290.407 2.507 20 10 CFCDRP C[C@@H](CC[NH2+]C/C=C/c1ccc(N(C)C)cc1)[NH+](C)C ZINC000895291890 618512586 /nfs/dbraw/zinc/51/25/86/618512586.db2.gz JJXDLRGNDGIBIC-LFAOLKIESA-N 2 0 275.440 2.696 20 10 CFCDRP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000236169095 618608725 /nfs/dbraw/zinc/60/87/25/618608725.db2.gz ZNZHFPWKJYDWGY-UHFFFAOYSA-N 2 0 288.366 2.882 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C)C1 ZINC000840931577 619074342 /nfs/dbraw/zinc/07/43/42/619074342.db2.gz XDAJOEPGUYGJES-MRXNPFEDSA-N 2 0 289.467 2.883 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925781370 619103497 /nfs/dbraw/zinc/10/34/97/619103497.db2.gz YHCCCRBNPCLDSR-TZMCWYRMSA-N 2 0 297.393 2.648 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000894764959 619462451 /nfs/dbraw/zinc/46/24/51/619462451.db2.gz DMACKPHSDRLEJE-CQSZACIVSA-N 2 0 292.423 2.529 20 10 CFCDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841030985 620257159 /nfs/dbraw/zinc/25/71/59/620257159.db2.gz QNYJTPOSAWJIEE-WBVHZDCISA-N 2 0 273.424 2.504 20 10 CFCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(Br)ccc1O ZINC000902485126 621111155 /nfs/dbraw/zinc/11/11/55/621111155.db2.gz HYJCPZHXBYFOEW-FXPVBKGRSA-N 2 0 299.212 2.543 20 10 CFCDRP CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904307997 621570483 /nfs/dbraw/zinc/57/04/83/621570483.db2.gz IZHXBFQBOSWPDJ-IYBDPMFKSA-N 2 0 275.440 2.700 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[C@H]1C[NH3+] ZINC000904409997 621591411 /nfs/dbraw/zinc/59/14/11/621591411.db2.gz LHQSRZXRXWGBKA-LUJIMGINSA-N 2 0 287.451 2.683 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(F)c2[O-])CC[C@H]1C[NH3+] ZINC000904412212 621593421 /nfs/dbraw/zinc/59/34/21/621593421.db2.gz SFGVBENGBTXGQK-ZJUUUORDSA-N 2 0 286.778 2.601 20 10 CFCDRP [NH3+]CC1(c2ccccc2)CC[NH+](Cc2ccccc2O)CC1 ZINC000904458694 621600287 /nfs/dbraw/zinc/60/02/87/621600287.db2.gz FPSXRJPLLNOWIM-UHFFFAOYSA-N 2 0 296.414 2.885 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000841084812 622201475 /nfs/dbraw/zinc/20/14/75/622201475.db2.gz PZXJRLHYYKPEML-JKSUJKDBSA-N 2 0 275.440 2.750 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000044533201 622918172 /nfs/dbraw/zinc/91/81/72/622918172.db2.gz GDYKDDBKSUIOHR-HUUCEWRRSA-N 2 0 275.440 2.745 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC000227376306 623108602 /nfs/dbraw/zinc/10/86/02/623108602.db2.gz XPWOTPJIPXZJTA-DZGCQCFKSA-N 2 0 262.397 2.576 20 10 CFCDRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1c(O)cccc1Cl)C2 ZINC000311493648 623465744 /nfs/dbraw/zinc/46/57/44/623465744.db2.gz VBXSSZKWUFNAKJ-NHYWBVRUSA-N 2 0 280.799 2.606 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000824988548 623600875 /nfs/dbraw/zinc/60/08/75/623600875.db2.gz NBKJGIXTCYMKHR-GOOCMWNKSA-N 2 0 290.407 2.506 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c1O ZINC000827951089 624136230 /nfs/dbraw/zinc/13/62/30/624136230.db2.gz WJJSALQBGABGNZ-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1 ZINC000834909831 625920016 /nfs/dbraw/zinc/92/00/16/625920016.db2.gz UQEXHCPCKBQTAV-CYBMUJFWSA-N 2 0 292.423 2.926 20 10 CFCDRP C[N@H+](CCCC[NH2+][C@H]1CCc2cccc(O)c21)C1CC1 ZINC000834909978 625920213 /nfs/dbraw/zinc/92/02/13/625920213.db2.gz VFEWKJKWOMWJOK-HNNXBMFYSA-N 2 0 274.408 2.844 20 10 CFCDRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000922509812 626300581 /nfs/dbraw/zinc/30/05/81/626300581.db2.gz IOONLYIQLSKPLQ-DQEVTTJGSA-N 2 0 299.462 2.573 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CCCN1C)c1ccc(N(C)C)cc1 ZINC000154578265 626310540 /nfs/dbraw/zinc/31/05/40/626310540.db2.gz NFZWZTVKJYAHDU-IRXDYDNUSA-N 2 0 275.440 2.888 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000839182162 626529910 /nfs/dbraw/zinc/52/99/10/626529910.db2.gz LFPHLMFUENYQTK-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000839183485 626530000 /nfs/dbraw/zinc/53/00/00/626530000.db2.gz WXVHHUGBQYCSCR-INIZCTEOSA-N 2 0 275.440 2.574 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)cc2)CC1 ZINC000839190918 626530697 /nfs/dbraw/zinc/53/06/97/626530697.db2.gz LAUYPBCKSCTNIR-NZSAHSFTSA-N 2 0 299.462 2.717 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)c(O)c1 ZINC000769513784 627449820 /nfs/dbraw/zinc/44/98/20/627449820.db2.gz DPYQUNLTSAIHPN-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C)CCCC3)cc2)CC1 ZINC000771828050 627635182 /nfs/dbraw/zinc/63/51/82/627635182.db2.gz QAECOZLIPSGQGY-UHFFFAOYSA-N 2 0 287.451 2.861 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000774187862 627900618 /nfs/dbraw/zinc/90/06/18/627900618.db2.gz IHQIHBVRENYACK-ZNXRZULTSA-N 2 0 287.451 2.776 20 10 CFCDRP CC(C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000776252574 628122970 /nfs/dbraw/zinc/12/29/70/628122970.db2.gz GYZDBGISTCSNSV-MRXNPFEDSA-N 2 0 289.467 2.963 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835035834 629328424 /nfs/dbraw/zinc/32/84/24/629328424.db2.gz MFLPELNTDZZRBI-OSJSJHBBSA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000835038421 629332917 /nfs/dbraw/zinc/33/29/17/629332917.db2.gz RTHPYFJOGQOPFD-PLNGDYQASA-N 2 0 287.451 2.697 20 10 CFCDRP CCN(CC)c1ccc(CN2CCC(C)([NH3+])CC2)cc1F ZINC000843103381 630630328 /nfs/dbraw/zinc/63/03/28/630630328.db2.gz ABJFEZJEEKVUSS-UHFFFAOYSA-N 2 0 293.430 2.985 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000840937257 631271129 /nfs/dbraw/zinc/27/11/29/631271129.db2.gz RDKMXAJRNJWWQS-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000840942626 631273853 /nfs/dbraw/zinc/27/38/53/631273853.db2.gz NYLHQIQIYUONMA-UHFFFAOYSA-N 2 0 289.467 2.979 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000840953476 631280518 /nfs/dbraw/zinc/28/05/18/631280518.db2.gz SCMIUIWODJEVDN-INIZCTEOSA-N 2 0 289.467 2.883 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000841007976 631304451 /nfs/dbraw/zinc/30/44/51/631304451.db2.gz VZYGNYILEDGKPF-CABCVRRESA-N 2 0 276.424 2.992 20 10 CFCDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000841029232 631311160 /nfs/dbraw/zinc/31/11/60/631311160.db2.gz MVUCUNSOQGAAAY-CYBMUJFWSA-N 2 0 282.387 2.931 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1F ZINC000841030652 631311336 /nfs/dbraw/zinc/31/13/36/631311336.db2.gz OBSWAOZPZJOLJM-GDBMZVCRSA-N 2 0 293.430 2.889 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+]Cc1cc(C)c(C)cc1O ZINC000841030996 631311718 /nfs/dbraw/zinc/31/17/18/631311718.db2.gz NINKOPIVNAPADM-UHFFFAOYSA-N 2 0 250.386 2.616 20 10 CFCDRP Cc1cc(Cl)cc(CNC[C@H]2CCCC[NH2+]2)c1O ZINC000841033755 631313081 /nfs/dbraw/zinc/31/30/81/631313081.db2.gz ZEFMBZITUAMYCS-CYBMUJFWSA-N 2 0 268.788 2.586 20 10 CFCDRP CCOc1ccc(C[NH2+]CC2([NH3+])CCCCCC2)c(O)c1 ZINC000841043381 631319647 /nfs/dbraw/zinc/31/96/47/631319647.db2.gz PVNROMHHZSQWRO-UHFFFAOYSA-N 2 0 292.423 2.932 20 10 CFCDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cccc(Br)c2[O-])C1 ZINC000841056186 631323066 /nfs/dbraw/zinc/32/30/66/631323066.db2.gz ZOLQIELHESBSBU-WDEREUQCSA-N 2 0 299.212 2.514 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000841057376 631323359 /nfs/dbraw/zinc/32/33/59/631323359.db2.gz JTYXYVZCLRQIKR-KSLSASGISA-N 2 0 273.424 2.625 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000841057670 631323711 /nfs/dbraw/zinc/32/37/11/631323711.db2.gz KYYOKZFNXHJQJU-MRXNPFEDSA-N 2 0 273.424 2.519 20 10 CFCDRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841064910 631328122 /nfs/dbraw/zinc/32/81/22/631328122.db2.gz VVFZPKXBBVJQJU-QAPCUYQASA-N 2 0 287.451 2.765 20 10 CFCDRP [NH3+]CCC[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000841087976 631336160 /nfs/dbraw/zinc/33/61/60/631336160.db2.gz WMXODZOFEIELRO-MRXNPFEDSA-N 2 0 270.376 2.962 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@@]1(C)C[NH3+] ZINC000841089768 631337290 /nfs/dbraw/zinc/33/72/90/631337290.db2.gz ABSDAWQXXFYWCW-CPHMMYSSSA-N 2 0 287.451 2.683 20 10 CFCDRP C[C@@H]1CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@H]1C[NH3+] ZINC000841099797 631339233 /nfs/dbraw/zinc/33/92/33/631339233.db2.gz PCRHSDIYKVHZNE-GWOVIKRFSA-N 2 0 287.451 2.683 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC000841100790 631339998 /nfs/dbraw/zinc/33/99/98/631339998.db2.gz KAOOYMULADRYAF-NVXWUHKLSA-N 2 0 289.467 2.950 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CC[C@@H]1[NH3+] ZINC000843053136 631817494 /nfs/dbraw/zinc/81/74/94/631817494.db2.gz XQPIYTGNMKBFTE-MFKMUULPSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1O ZINC000843057796 631820710 /nfs/dbraw/zinc/82/07/10/631820710.db2.gz LCHCZVMGLASKRH-WDEREUQCSA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843058265 631821679 /nfs/dbraw/zinc/82/16/79/631821679.db2.gz QPIGQROYMWVDRT-NVXWUHKLSA-N 2 0 287.451 2.846 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000843060232 631822597 /nfs/dbraw/zinc/82/25/97/631822597.db2.gz YLITUSGMFGAFPG-ZJBAIYCDSA-N 2 0 299.462 2.825 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C[C@@]2(C)CC[NH2+]C2)C2CC2)cc1 ZINC000843060914 631822679 /nfs/dbraw/zinc/82/26/79/631822679.db2.gz RQPUIWBVLDWMSZ-SFHVURJKSA-N 2 0 287.451 2.717 20 10 CFCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124766 631843210 /nfs/dbraw/zinc/84/32/10/631843210.db2.gz GKULBCZUJAZPPV-STQMWFEESA-N 2 0 294.826 2.867 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@H]2CC[NH3+])cc1 ZINC000843123920 631843910 /nfs/dbraw/zinc/84/39/10/631843910.db2.gz RRGKJDYWKMAZHQ-XFHJGTJQSA-N 2 0 287.451 2.969 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126358 631845161 /nfs/dbraw/zinc/84/51/61/631845161.db2.gz JOXKWGVBANQEHP-HUUCEWRRSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCCCCC[NH3+])cc1C ZINC000843126066 631845372 /nfs/dbraw/zinc/84/53/72/631845372.db2.gz AIFCSXKKGQHICX-UHFFFAOYSA-N 2 0 250.386 2.618 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)cc1 ZINC000813877077 631971184 /nfs/dbraw/zinc/97/11/84/631971184.db2.gz JYVUTBUPYSTYBP-LSDHHAIUSA-N 2 0 277.456 2.991 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000844220525 632136136 /nfs/dbraw/zinc/13/61/36/632136136.db2.gz GRQSWERIOZIABB-MRXNPFEDSA-N 2 0 289.467 2.964 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000844220524 632136543 /nfs/dbraw/zinc/13/65/43/632136543.db2.gz GRQSWERIOZIABB-INIZCTEOSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC2(C[NH3+])CC2)c(Cl)c1 ZINC000844903898 632331810 /nfs/dbraw/zinc/33/18/10/632331810.db2.gz RGMAMTBMRZLSRA-UHFFFAOYSA-N 2 0 268.788 2.573 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000844921411 632337114 /nfs/dbraw/zinc/33/71/14/632337114.db2.gz IHEUXLNTHNPVTC-CQSZACIVSA-N 2 0 275.440 2.922 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)c(O)c1 ZINC000844922571 632337688 /nfs/dbraw/zinc/33/76/88/632337688.db2.gz ASWOVLHGDSGGQM-ZDUSSCGKSA-N 2 0 262.397 2.741 20 10 CFCDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816509877 632475099 /nfs/dbraw/zinc/47/50/99/632475099.db2.gz FPTCBCUZBMNVHE-AWEZNQCLSA-N 2 0 284.403 2.929 20 10 CFCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C[NH3+] ZINC000817864823 632714696 /nfs/dbraw/zinc/71/46/96/632714696.db2.gz CWPJDKCJXQOWKN-MDZLAQPJSA-N 2 0 282.815 2.851 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000817894374 632719470 /nfs/dbraw/zinc/71/94/70/632719470.db2.gz MGXZOJOLZXKJRI-SJORKVTESA-N 2 0 275.440 2.811 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000817935758 632742074 /nfs/dbraw/zinc/74/20/74/632742074.db2.gz ZQRMEFCBCUFNRR-ZNMIVQPWSA-N 2 0 277.456 2.707 20 10 CFCDRP C[C@H]([NH2+]CCC[NH3+])c1ccc(N2CCCCC2)c(F)c1 ZINC000817938204 632743201 /nfs/dbraw/zinc/74/32/01/632743201.db2.gz GTKCDDWIWUGFKB-ZDUSSCGKSA-N 2 0 279.403 2.815 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817945366 632747117 /nfs/dbraw/zinc/74/71/17/632747117.db2.gz AGUSZRMXUFFVPE-WMLDXEAASA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(Br)cc1O ZINC000817953137 632752428 /nfs/dbraw/zinc/75/24/28/632752428.db2.gz NNYZWHCWVFEYAQ-DTWKUNHWSA-N 2 0 287.201 2.543 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817959708 632757893 /nfs/dbraw/zinc/75/78/93/632757893.db2.gz UFRGYOTYQKWZDF-BLLLJJGKSA-N 2 0 276.424 2.905 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1 ZINC000817960341 632759502 /nfs/dbraw/zinc/75/95/02/632759502.db2.gz MFCUZARFODHKDE-KCQAQPDRSA-N 2 0 262.397 2.869 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)[NH3+])c1ccc2ccccc2c1O ZINC000817960782 632759589 /nfs/dbraw/zinc/75/95/89/632759589.db2.gz PQVIAOAMRKEYPZ-NSHDSACASA-N 2 0 258.365 2.933 20 10 CFCDRP CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccccc1O ZINC000817964667 632763407 /nfs/dbraw/zinc/76/34/07/632763407.db2.gz HUHNRSWSLHVVSF-CQSZACIVSA-N 2 0 262.397 2.823 20 10 CFCDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817965398 632764240 /nfs/dbraw/zinc/76/42/40/632764240.db2.gz TZCJMUGHEBLMIJ-WMLDXEAASA-N 2 0 275.440 2.793 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC000817967815 632766439 /nfs/dbraw/zinc/76/64/39/632766439.db2.gz CHEFVWMZWYFYGT-GFCCVEGCSA-N 2 0 298.386 2.855 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)c(O)c1C ZINC000817971706 632771404 /nfs/dbraw/zinc/77/14/04/632771404.db2.gz PEPTXOTXCWTYGP-XBFCOCLRSA-N 2 0 262.397 2.800 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972370 632771825 /nfs/dbraw/zinc/77/18/25/632771825.db2.gz WBAHXHKKUMFHFN-QRTARXTBSA-N 2 0 275.440 2.934 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000817972615 632772010 /nfs/dbraw/zinc/77/20/10/632772010.db2.gz YNAUFPXAWSZPGC-KEYYUXOJSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972464 632772323 /nfs/dbraw/zinc/77/23/23/632772323.db2.gz XUMDGJPQVIEHTK-IPYPFGDCSA-N 2 0 261.413 2.544 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000817972215 632772328 /nfs/dbraw/zinc/77/23/28/632772328.db2.gz VFAMPBNZRXEXGC-NRUUGDAUSA-N 2 0 268.788 2.694 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000817976714 632774581 /nfs/dbraw/zinc/77/45/81/632774581.db2.gz SCHZJUYAJZIENZ-QKCSRTOESA-N 2 0 290.382 2.811 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000817977030 632775189 /nfs/dbraw/zinc/77/51/89/632775189.db2.gz ZMFNYAAVIHVEEE-PBHICJAKSA-N 2 0 287.451 2.935 20 10 CFCDRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(N(C)C)cc1 ZINC000817977274 632775323 /nfs/dbraw/zinc/77/53/23/632775323.db2.gz FZBSWOVBEWQXKA-CZUORRHYSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817977345 632775453 /nfs/dbraw/zinc/77/54/53/632775453.db2.gz HZYZETBETGBUEB-WOPDTQHZSA-N 2 0 258.365 2.932 20 10 CFCDRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817977942 632775543 /nfs/dbraw/zinc/77/55/43/632775543.db2.gz RVBIUDJBNBOGOF-VGMNWLOBSA-N 2 0 287.201 2.541 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000817978216 632776097 /nfs/dbraw/zinc/77/60/97/632776097.db2.gz YMUHJBLZEKHTHZ-ZJUUUORDSA-N 2 0 256.777 2.824 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000817980193 632776834 /nfs/dbraw/zinc/77/68/34/632776834.db2.gz JUDWWTFEAWUCIC-ZIAGYGMSSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(F)ccc1O ZINC000817979798 632777204 /nfs/dbraw/zinc/77/72/04/632777204.db2.gz FJTGEEQQVAKXQX-WCQYABFASA-N 2 0 266.360 2.714 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(C)cc1O ZINC000817981474 632778089 /nfs/dbraw/zinc/77/80/89/632778089.db2.gz KSJHYSPZMVVVDJ-NFAWXSAZSA-N 2 0 262.397 2.869 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(C)cc1O ZINC000817981473 632778205 /nfs/dbraw/zinc/77/82/05/632778205.db2.gz KSJHYSPZMVVVDJ-IPYPFGDCSA-N 2 0 262.397 2.869 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817984978 632781028 /nfs/dbraw/zinc/78/10/28/632781028.db2.gz DJWSLGNCFSUGEK-RISCZKNCSA-N 2 0 290.382 2.979 20 10 CFCDRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccc1O ZINC000817984917 632781335 /nfs/dbraw/zinc/78/13/35/632781335.db2.gz CAIIOQLEDRCNBM-OAHLLOKOSA-N 2 0 260.381 2.743 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(O)c1 ZINC000848558807 633289416 /nfs/dbraw/zinc/28/94/16/633289416.db2.gz SQUUGEGPHOAULC-KFWWJZLASA-N 2 0 276.424 3.000 20 10 CFCDRP CCc1cccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC)C2)c1O ZINC000848888817 633363802 /nfs/dbraw/zinc/36/38/02/633363802.db2.gz CJNOFVJPZRNSPC-AWEZNQCLSA-N 2 0 276.424 2.728 20 10 CFCDRP CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c1O ZINC000848889209 633363943 /nfs/dbraw/zinc/36/39/43/633363943.db2.gz GUSDTWDOHLWOAE-NVXWUHKLSA-N 2 0 288.435 2.871 20 10 CFCDRP CCc1cccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000848916558 633400767 /nfs/dbraw/zinc/40/07/67/633400767.db2.gz IQAGREKQEZLDOR-AWEZNQCLSA-N 2 0 276.424 2.776 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(N(C)C)cc1 ZINC000854222698 635263118 /nfs/dbraw/zinc/26/31/18/635263118.db2.gz KOYYQHKWNLZZHO-CYBMUJFWSA-N 2 0 261.413 2.675 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000857761105 636023374 /nfs/dbraw/zinc/02/33/74/636023374.db2.gz UWDATYVSXNLGIU-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000158731719 650235024 /nfs/dbraw/zinc/23/50/24/650235024.db2.gz JCDIWCTZZKMBCC-CQSZACIVSA-N 2 0 262.397 2.521 20 10 CFCDRP CC[C@@H]([NH2+]CC1([NH3+])CCOCC1)c1cc(Cl)ccc1O ZINC000863541351 637689044 /nfs/dbraw/zinc/68/90/44/637689044.db2.gz LEWWULCTRNKVMA-CYBMUJFWSA-N 2 0 298.814 2.594 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@]34C[C@H]3CCCC4)cc2)CC1 ZINC000865702928 638524722 /nfs/dbraw/zinc/52/47/22/638524722.db2.gz AJYXODVDRANMMG-IEBWSBKVSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@@H](NC[C@H]1CCC(C)(C)C[NH2+]1)c1ccccc1O ZINC000873234057 642086604 /nfs/dbraw/zinc/08/66/04/642086604.db2.gz BWRLIGYXDNNLNQ-CHWSQXEVSA-N 2 0 262.397 2.821 20 10 CFCDRP [NH3+][C@@H](CC[NH2+][C@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000873235429 642088626 /nfs/dbraw/zinc/08/86/26/642088626.db2.gz OLQGPBRREXDWBF-IRXDYDNUSA-N 2 0 296.414 2.929 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000873241822 642091128 /nfs/dbraw/zinc/09/11/28/642091128.db2.gz GFWZKIXKBSEVCZ-QWHCGFSZSA-N 2 0 292.423 2.830 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c(O)c1 ZINC000873272664 642113762 /nfs/dbraw/zinc/11/37/62/642113762.db2.gz WFQZVKCUSLIJPP-QWHCGFSZSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000876949448 643076054 /nfs/dbraw/zinc/07/60/54/643076054.db2.gz WQIGUSZTORGPMI-AWEZNQCLSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000877551862 643352549 /nfs/dbraw/zinc/35/25/49/643352549.db2.gz MCDDQZGACLVQKI-KRWDZBQOSA-N 2 0 274.408 2.618 20 10 CFCDRP C[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)ccc2O)CCN1C ZINC000093644257 650943806 /nfs/dbraw/zinc/94/38/06/650943806.db2.gz BTZDCOSOFDEULL-BXUZGUMPSA-N 2 0 282.815 2.960 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250359791 650973688 /nfs/dbraw/zinc/97/36/88/650973688.db2.gz RWLKYKQVGMHHCR-KZNAEPCWSA-N 2 0 287.451 2.763 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925787679 648324077 /nfs/dbraw/zinc/32/40/77/648324077.db2.gz ZJKYMMYTQOGYSF-MXWKQRLJSA-N 2 0 268.788 2.552 20 10 CFCDRP C[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2O)CC[NH2+]1 ZINC001210495714 770296162 /nfs/dbraw/zinc/29/61/62/770296162.db2.gz ASPYHTKNVHXGBK-ZDUSSCGKSA-N 2 0 276.424 2.874 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cc(Cl)ccc2O)C[C@@H]1C[NH3+] ZINC000397436556 775135179 /nfs/dbraw/zinc/13/51/79/775135179.db2.gz GXRMTPJLWPUCTA-WZRBSPASSA-N 2 0 282.815 2.851 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925779385 776536161 /nfs/dbraw/zinc/53/61/61/776536161.db2.gz YIWORWRLANVEAW-OLZOCXBDSA-N 2 0 298.377 2.904 20 10 CFCDRP CC[N@H+](CCC[NH+](C)C)Cc1c(C)cc(C)cc1O ZINC001231848601 777350481 /nfs/dbraw/zinc/35/04/81/777350481.db2.gz IZMCTUBJSYAVLE-UHFFFAOYSA-N 2 0 264.413 2.783 20 10 CFCDRP CC[N@H+](C)C1CC[NH+](Cc2c(C)cc(C)cc2O)CC1 ZINC001231850679 777350834 /nfs/dbraw/zinc/35/08/34/777350834.db2.gz SXMVABPCVMWGKY-UHFFFAOYSA-N 2 0 276.424 2.925 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235265712 778439351 /nfs/dbraw/zinc/43/93/51/778439351.db2.gz DOAWWXRRGIWVEG-CJNGLKHVSA-N 2 0 288.435 2.874 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c(O)c1 ZINC001235267747 778440580 /nfs/dbraw/zinc/44/05/80/778440580.db2.gz IJCLXENVALDYKW-CZUORRHYSA-N 2 0 288.435 2.874 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)c(O)c1 ZINC001235939970 778619006 /nfs/dbraw/zinc/61/90/06/778619006.db2.gz RRKCBWZWJBAUQW-HIFRSBDPSA-N 2 0 288.435 2.731 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)c(O)c1 ZINC001235939972 778619278 /nfs/dbraw/zinc/61/92/78/778619278.db2.gz RRKCBWZWJBAUQW-ZFWWWQNUSA-N 2 0 288.435 2.731 20 10 CFCDRP CC[N@H+](CC[C@H]1CCCC[NH2+]1)Cc1ccccc1O ZINC001236044542 778662649 /nfs/dbraw/zinc/66/26/49/778662649.db2.gz NKAZOHPXROYLOQ-OAHLLOKOSA-N 2 0 262.397 2.746 20 10 CFCDRP CCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c(O)c1 ZINC001237417072 779104714 /nfs/dbraw/zinc/10/47/14/779104714.db2.gz RZSDRTKOTCVIJE-HOCLYGCPSA-N 2 0 274.408 2.529 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c1O ZINC001237689974 779162513 /nfs/dbraw/zinc/16/25/13/779162513.db2.gz SRSBHTHEOKDUPE-UHFFFAOYSA-N 2 0 294.826 2.882 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1O ZINC000700832395 780729167 /nfs/dbraw/zinc/72/91/67/780729167.db2.gz XNGHXWOESUKOGW-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccccc1O ZINC000705991759 781151639 /nfs/dbraw/zinc/15/16/39/781151639.db2.gz VTVLEGRRPLFKAZ-UONOGXRCSA-N 2 0 262.397 2.775 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(C)ccc2O)C1 ZINC000093742392 375305504 /nfs/dbraw/zinc/30/55/04/375305504.db2.gz QDEVYKKVAUUSCI-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)C[C@@H]1n1ccnc1 ZINC000180271772 380642094 /nfs/dbraw/zinc/64/20/94/380642094.db2.gz GRBNEPKIYCUAFB-DOMZBBRYSA-N 2 0 289.354 2.811 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cccc(C)c2O)C1 ZINC000180486361 380668007 /nfs/dbraw/zinc/66/80/07/380668007.db2.gz FZUIXMVVQRKPFB-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(OC)ccc2O)C1 ZINC000180524207 380670717 /nfs/dbraw/zinc/67/07/17/380670717.db2.gz NMFFDGSRCZBOHE-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000296369692 381366381 /nfs/dbraw/zinc/36/63/81/381366381.db2.gz JEAUQVFTDSOMBX-AVOUXACISA-N 2 0 274.408 2.976 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CCC[NH+](C)C)c(O)c1 ZINC000293773039 382273560 /nfs/dbraw/zinc/27/35/60/382273560.db2.gz PRJLDENOBMQTDZ-ZDUSSCGKSA-N 2 0 250.386 2.611 20 10 CFCDRP CCOc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000252668470 383426193 /nfs/dbraw/zinc/42/61/93/383426193.db2.gz XJIJLGKWBLYTIB-GJZGRUSLSA-N 2 0 290.407 2.507 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CCC[NH+]2CCCC2)cc1 ZINC000270582656 385154067 /nfs/dbraw/zinc/15/40/67/385154067.db2.gz IXQRLAJYTVDFES-UHFFFAOYSA-N 2 0 275.440 2.670 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1 ZINC000271883731 385395965 /nfs/dbraw/zinc/39/59/65/385395965.db2.gz MBIGORPORFDYOP-UHFFFAOYSA-N 2 0 290.407 2.507 20 10 CFCDRP COCC[N@H+](C)CCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284201903 385546280 /nfs/dbraw/zinc/54/62/80/385546280.db2.gz SFNJVIOWNMJGKL-HNNXBMFYSA-N 2 0 294.439 2.628 20 10 CFCDRP COCC[N@H+](C)CCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284201910 385546411 /nfs/dbraw/zinc/54/64/11/385546411.db2.gz SFNJVIOWNMJGKL-OAHLLOKOSA-N 2 0 294.439 2.628 20 10 CFCDRP CCOc1cccc(C[NH2+]CCC2CC[NH+](C)CC2)c1O ZINC000105454402 393863559 /nfs/dbraw/zinc/86/35/59/393863559.db2.gz KQJHPPRGUUQKDN-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000035628827 172307748 /nfs/dbraw/zinc/30/77/48/172307748.db2.gz BZBLUIDSMANCMR-CQSZACIVSA-N 2 0 262.397 2.837 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@H]4[C@H]3C2)c1 ZINC000367472956 267092387 /nfs/dbraw/zinc/09/23/87/267092387.db2.gz ZMSJWIIGEUWNSA-IKGGRYGDSA-N 2 0 286.419 2.617 20 10 CFCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(Cl)ccc2O)C1 ZINC000367709619 267112010 /nfs/dbraw/zinc/11/20/10/267112010.db2.gz XFKLNTHCHSLZDN-IUODEOHRSA-N 2 0 294.826 2.962 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@H]1CC[NH2+]C1 ZINC000423088565 330169261 /nfs/dbraw/zinc/16/92/61/330169261.db2.gz SGJYWOIHYAJWCB-KBPBESRZSA-N 2 0 271.408 2.574 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1O ZINC000060942144 521364904 /nfs/dbraw/zinc/36/49/04/521364904.db2.gz QERZWMYYSWRJTL-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)ccc1O ZINC000290438057 521653615 /nfs/dbraw/zinc/65/36/15/521653615.db2.gz LQQWVYILPSAEEE-UHFFFAOYSA-N 2 0 268.376 2.695 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000290575991 522177500 /nfs/dbraw/zinc/17/75/00/522177500.db2.gz UEIKCESYHUMVCR-AEFFLSMTSA-N 2 0 287.451 2.669 20 10 CFCDRP C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C[NH+](C)C ZINC000291756745 524486635 /nfs/dbraw/zinc/48/66/35/524486635.db2.gz QXUVCKDAFLKGTO-MRXNPFEDSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)C[NH+]1CCCC1 ZINC000094618157 524749701 /nfs/dbraw/zinc/74/97/01/524749701.db2.gz KDZAVGGWSCHLIU-STQMWFEESA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccccc1O ZINC000228808622 525313152 /nfs/dbraw/zinc/31/31/52/525313152.db2.gz FGYGQHLYTSUSEL-ZDUSSCGKSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH+](C)C)c(O)c1 ZINC000045663673 525726215 /nfs/dbraw/zinc/72/62/15/525726215.db2.gz ZYCLICRHKCQSPE-CYBMUJFWSA-N 2 0 250.386 2.693 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC2=CC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756788146 574262729 /nfs/dbraw/zinc/26/27/29/574262729.db2.gz BGHQHXMMTUQKHR-FZMZJTMJSA-N 2 0 290.382 2.931 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC000742369267 574278349 /nfs/dbraw/zinc/27/83/49/574278349.db2.gz QUYGVEQWZJNQOK-HNNXBMFYSA-N 2 0 276.424 2.829 20 10 CFCDRP C[C@H](CC[NH2+]C/C=C/c1ccc(N(C)C)cc1)[NH+](C)C ZINC000895291891 618513208 /nfs/dbraw/zinc/51/32/08/618513208.db2.gz JJXDLRGNDGIBIC-LQYUOIDQSA-N 2 0 275.440 2.696 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166622791 618706808 /nfs/dbraw/zinc/70/68/08/618706808.db2.gz IRZKPMVNGJAQEO-FUHWJXTLSA-N 2 0 287.451 2.777 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000035628550 618834177 /nfs/dbraw/zinc/83/41/77/618834177.db2.gz ZYWPIPGEELQRCS-ZDUSSCGKSA-N 2 0 264.413 2.939 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000841005789 620212226 /nfs/dbraw/zinc/21/22/26/620212226.db2.gz KDTSXOPIIXVLAX-WBVHZDCISA-N 2 0 289.467 2.963 20 10 CFCDRP CCOc1cccc(C[N@H+](C)CC(C)(C)C[NH+](C)C)c1O ZINC000898310551 620371032 /nfs/dbraw/zinc/37/10/32/620371032.db2.gz XGQSHHHDQWFJAO-UHFFFAOYSA-N 2 0 294.439 2.811 20 10 CFCDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc(N)cc1 ZINC000841038846 620379961 /nfs/dbraw/zinc/37/99/61/620379961.db2.gz RKNSVVJVMXLRGW-YOEHRIQHSA-N 2 0 275.440 2.712 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(Cl)c1 ZINC000841058788 620423423 /nfs/dbraw/zinc/42/34/23/620423423.db2.gz VMWKFSLMKZXLFN-QWRGUYRKSA-N 2 0 268.788 2.714 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000903941317 621482174 /nfs/dbraw/zinc/48/21/74/621482174.db2.gz YRQIBCYEQMWKDW-UHFFFAOYSA-N 2 0 263.429 2.750 20 10 CFCDRP CCC1([NH3+])CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000903946041 621484374 /nfs/dbraw/zinc/48/43/74/621484374.db2.gz GNTPTMIZFZBUMG-WAYWQWQTSA-N 2 0 287.451 2.969 20 10 CFCDRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000903964856 621495875 /nfs/dbraw/zinc/49/58/75/621495875.db2.gz SPMVIHZJPFQSOU-WBVHZDCISA-N 2 0 287.451 2.622 20 10 CFCDRP CCC[N@H+](Cc1ccccc1O)C[C@]1(C)CCC[NH2+]C1 ZINC000904315845 621571695 /nfs/dbraw/zinc/57/16/95/621571695.db2.gz FMYXMVAKVOUMHL-QGZVFWFLSA-N 2 0 276.424 2.994 20 10 CFCDRP c1cc2c(cc1CN[C@H]1CC[NH2+]C13CCCC3)CCCO2 ZINC000904373449 621584674 /nfs/dbraw/zinc/58/46/74/621584674.db2.gz DXXYEVDEFDZZTP-KRWDZBQOSA-N 2 0 286.419 2.776 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000904384259 621588205 /nfs/dbraw/zinc/58/82/05/621588205.db2.gz IDNUFNGWPJEDJP-INIZCTEOSA-N 2 0 288.435 2.879 20 10 CFCDRP COc1cccc(O)c1C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000904445160 621599562 /nfs/dbraw/zinc/59/95/62/621599562.db2.gz XGMLROPULMSQDU-UHFFFAOYSA-N 2 0 292.423 2.598 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000164532126 622958316 /nfs/dbraw/zinc/95/83/16/622958316.db2.gz XMSWNYHWDYXNQO-RDJZCZTQSA-N 2 0 288.435 2.925 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1cc(F)ccc1O ZINC000157652010 623043919 /nfs/dbraw/zinc/04/39/19/623043919.db2.gz VVICQYPDAIUQFK-GMXVVIOVSA-N 2 0 266.360 2.665 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC[NH2+]C1 ZINC000226437313 623075146 /nfs/dbraw/zinc/07/51/46/623075146.db2.gz SWIGALFZQSOAMV-AWEZNQCLSA-N 2 0 262.397 2.604 20 10 CFCDRP COc1cc(Cl)cc(C[NH+]2CCC(CC[NH3+])CC2)c1O ZINC000229103898 623182968 /nfs/dbraw/zinc/18/29/68/623182968.db2.gz XPMZVCWFABPADY-UHFFFAOYSA-N 2 0 298.814 2.615 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(C)(F)F)cc2)CC1 ZINC000824483263 623512101 /nfs/dbraw/zinc/51/21/01/623512101.db2.gz KOVWXFVYZNNAJZ-UHFFFAOYSA-N 2 0 297.393 2.573 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000923294625 626463698 /nfs/dbraw/zinc/46/36/98/626463698.db2.gz KOGGLIBZNPXKNS-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000839183101 626529875 /nfs/dbraw/zinc/52/98/75/626529875.db2.gz UAICPJSQCXKSIU-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP COc1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1C ZINC000839183519 626530090 /nfs/dbraw/zinc/53/00/90/626530090.db2.gz XQGYITTUSRGBTF-HNNXBMFYSA-N 2 0 276.424 2.825 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CC[C@@H]1[NH3+] ZINC000843051064 626547856 /nfs/dbraw/zinc/54/78/56/626547856.db2.gz ACSWRMKLFURGEJ-RISCZKNCSA-N 2 0 282.815 2.913 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c(O)c1 ZINC000763591760 627000615 /nfs/dbraw/zinc/00/06/15/627000615.db2.gz VPQAZXHPSZICQL-HNNXBMFYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCOc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)c(O)c1 ZINC000768303334 627331905 /nfs/dbraw/zinc/33/19/05/627331905.db2.gz RMIWEUZWAFCWIR-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000775708957 628057338 /nfs/dbraw/zinc/05/73/38/628057338.db2.gz QLRXYEAQBUCYJO-IYBDPMFKSA-N 2 0 287.451 2.526 20 10 CFCDRP CC[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775737202 628061211 /nfs/dbraw/zinc/06/12/11/628061211.db2.gz KCLXQJQDFCMRRP-MRXNPFEDSA-N 2 0 287.451 2.670 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(C)CCC3)cc2)CC1 ZINC000776231545 628120206 /nfs/dbraw/zinc/12/02/06/628120206.db2.gz ITPGJFBMVVUNFI-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CCCC[NH+](C)C)cc1 ZINC000835036010 629329601 /nfs/dbraw/zinc/32/96/01/629329601.db2.gz IRNMEGUVWZOMRL-BQYQJAHWSA-N 2 0 275.440 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000835036931 629332461 /nfs/dbraw/zinc/33/24/61/629332461.db2.gz RTGCTZMPTRIOPN-REMYHPOOSA-N 2 0 299.462 2.840 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC3(C)CC3)cc2)CC1 ZINC000793198748 629503612 /nfs/dbraw/zinc/50/36/12/629503612.db2.gz LRPAOFBRPVGWQJ-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000796673386 629948480 /nfs/dbraw/zinc/94/84/80/629948480.db2.gz CIOMAUFTALAOBT-KSZLIROESA-N 2 0 287.451 2.715 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H]3C3CC3)cc2)CC1 ZINC000797905870 630121656 /nfs/dbraw/zinc/12/16/56/630121656.db2.gz RGFHDKRJTWCOGI-MOPGFXCFSA-N 2 0 299.462 2.717 20 10 CFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(F)ccc1O ZINC000809749674 631279579 /nfs/dbraw/zinc/27/95/79/631279579.db2.gz JFYWZONOOZBQIS-UHFFFAOYSA-N 2 0 280.387 2.839 20 10 CFCDRP CCC([NH3+])(CC)CNC/C=C\c1ccc(N(C)C)cc1 ZINC000841028361 631308791 /nfs/dbraw/zinc/30/87/91/631308791.db2.gz BRORTHQPUJGAAW-FPLPWBNLSA-N 2 0 275.440 2.873 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000841027995 631309608 /nfs/dbraw/zinc/30/96/08/631309608.db2.gz IURSXYIEHZFKTH-RHSMWYFYSA-N 2 0 275.440 2.668 20 10 CFCDRP COc1ccc(O)c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000841030228 631310225 /nfs/dbraw/zinc/31/02/25/631310225.db2.gz VBUBDJTZEXOVNU-GFCCVEGCSA-N 2 0 286.375 2.710 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841060671 631325441 /nfs/dbraw/zinc/32/54/41/631325441.db2.gz AQYGRCHVUBGBEW-NVXWUHKLSA-N 2 0 287.451 2.907 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1O ZINC000841062248 631328144 /nfs/dbraw/zinc/32/81/44/631328144.db2.gz UQJODMPGLOYHJV-GXFFZTMASA-N 2 0 268.788 2.584 20 10 CFCDRP COc1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1C ZINC000841078267 631332265 /nfs/dbraw/zinc/33/22/65/631332265.db2.gz DPCVXOGPXXGHRY-CYBMUJFWSA-N 2 0 250.386 2.611 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000841081590 631332819 /nfs/dbraw/zinc/33/28/19/631332819.db2.gz YLVYVONHCFLZSY-AWEZNQCLSA-N 2 0 263.429 2.668 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000841079271 631333440 /nfs/dbraw/zinc/33/34/40/631333440.db2.gz KQQZIMNVBGJTFF-SFHVURJKSA-N 2 0 299.462 2.909 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000841089392 631337105 /nfs/dbraw/zinc/33/71/05/631337105.db2.gz MKIRGWFOKWVLAL-CQSZACIVSA-N 2 0 290.407 2.555 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1C ZINC000841089948 631337591 /nfs/dbraw/zinc/33/75/91/631337591.db2.gz RWYKTAFLQQYLSZ-OAHLLOKOSA-N 2 0 274.408 2.768 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CCC[NH2+]C1CC1 ZINC000841091962 631338242 /nfs/dbraw/zinc/33/82/42/631338242.db2.gz IDTLLAOIIGVFIL-UHFFFAOYSA-N 2 0 287.451 2.909 20 10 CFCDRP Cc1cc(O)c(C[N@@H+](C)C2CCC([NH3+])CC2)cc1C ZINC000843055518 631818858 /nfs/dbraw/zinc/81/88/58/631818858.db2.gz FCBRCEXQRWPGRE-UHFFFAOYSA-N 2 0 262.397 2.711 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c(Cl)c1 ZINC000843057366 631820539 /nfs/dbraw/zinc/82/05/39/631820539.db2.gz JOENMUUXKJLNOY-QWRGUYRKSA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843124422 631844000 /nfs/dbraw/zinc/84/40/00/631844000.db2.gz ASFCNJXSUDLWPX-HUUCEWRRSA-N 2 0 274.408 2.522 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1O ZINC000843130162 631849170 /nfs/dbraw/zinc/84/91/70/631849170.db2.gz ZBLYNDSPCRLOME-NXEZZACHSA-N 2 0 256.777 2.569 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000843342180 631932375 /nfs/dbraw/zinc/93/23/75/631932375.db2.gz KPLMITKWSHBGOX-YESZJQIVSA-N 2 0 287.451 2.539 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)cc1 ZINC000813877074 631970944 /nfs/dbraw/zinc/97/09/44/631970944.db2.gz JYVUTBUPYSTYBP-CABCVRRESA-N 2 0 277.456 2.991 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])cc1C ZINC000844902288 632330917 /nfs/dbraw/zinc/33/09/17/632330917.db2.gz OUDBFODJYIUSRL-BLLLJJGKSA-N 2 0 276.424 2.958 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)c(O)c1C ZINC000844920869 632336453 /nfs/dbraw/zinc/33/64/53/632336453.db2.gz NSKDIQUUWGPCAP-CYBMUJFWSA-N 2 0 262.397 2.789 20 10 CFCDRP C[NH+](C)CCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816528466 632479527 /nfs/dbraw/zinc/47/95/27/632479527.db2.gz DFQUKTOKIRZLQO-UHFFFAOYSA-N 2 0 258.365 2.587 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1O ZINC000846137908 632643766 /nfs/dbraw/zinc/64/37/66/632643766.db2.gz NXYNXWRNLNXWLG-GFCCVEGCSA-N 2 0 280.412 2.639 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000846139476 632643936 /nfs/dbraw/zinc/64/39/36/632643936.db2.gz NVNVXWSZMQHTGX-QWHCGFSZSA-N 2 0 290.407 2.536 20 10 CFCDRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817896385 632720444 /nfs/dbraw/zinc/72/04/44/632720444.db2.gz IACVITYYTSPTKY-KXBFYZLASA-N 2 0 297.446 2.801 20 10 CFCDRP C[C@H]([NH2+]CCC[NH3+])c1ccc(N2CCCCC2)cc1 ZINC000817938165 632742848 /nfs/dbraw/zinc/74/28/48/632742848.db2.gz FZPFGRHLCMVJQV-AWEZNQCLSA-N 2 0 261.413 2.676 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817940125 632744127 /nfs/dbraw/zinc/74/41/27/632744127.db2.gz FKEZBASTUGNHKZ-MFKMUULPSA-N 2 0 278.371 2.669 20 10 CFCDRP C[NH2+]CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817941316 632745524 /nfs/dbraw/zinc/74/55/24/632745524.db2.gz SDHRGXQYPJDPHU-GFCCVEGCSA-N 2 0 258.365 2.806 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000817944024 632746290 /nfs/dbraw/zinc/74/62/90/632746290.db2.gz WECOWFAQHHBRRF-CYBMUJFWSA-N 2 0 250.386 2.659 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817945367 632747645 /nfs/dbraw/zinc/74/76/45/632747645.db2.gz AGUSZRMXUFFVPE-YOEHRIQHSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2c1c(F)ccc2O ZINC000817946070 632748269 /nfs/dbraw/zinc/74/82/69/632748269.db2.gz QVWVXGJVDVXABQ-MDZLAQPJSA-N 2 0 278.371 2.669 20 10 CFCDRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000817950766 632751915 /nfs/dbraw/zinc/75/19/15/632751915.db2.gz ZUTFCTZHGSXMMN-MRXNPFEDSA-N 2 0 282.387 2.671 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc(Br)ccc1O ZINC000817953897 632753586 /nfs/dbraw/zinc/75/35/86/632753586.db2.gz WCDOMEXEATZRJQ-DTWKUNHWSA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817954708 632754730 /nfs/dbraw/zinc/75/47/30/632754730.db2.gz HHVVEXVUVZBUSU-QWRGUYRKSA-N 2 0 268.788 2.696 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(O)c1C ZINC000817955090 632754809 /nfs/dbraw/zinc/75/48/09/632754809.db2.gz QCCYCGYILQJDLM-ZIAGYGMSSA-N 2 0 262.397 2.659 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817959356 632757813 /nfs/dbraw/zinc/75/78/13/632757813.db2.gz BXMBYKHKQTWKBV-LLVKDONJSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(C)cc1O ZINC000817959188 632758128 /nfs/dbraw/zinc/75/81/28/632758128.db2.gz PZMXKUZXZYSRFK-ZIAGYGMSSA-N 2 0 250.386 2.725 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000817960680 632758905 /nfs/dbraw/zinc/75/89/05/632758905.db2.gz PKWVMBWGVUMOJG-YWPYICTPSA-N 2 0 278.396 2.569 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)[NH3+])c1O ZINC000817960815 632759181 /nfs/dbraw/zinc/75/91/81/632759181.db2.gz QWYSINUFLBRAPS-VIFPVBQESA-N 2 0 256.777 2.742 20 10 CFCDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817964461 632762607 /nfs/dbraw/zinc/76/26/07/632762607.db2.gz DMVVYEQWMDYTBZ-CQSZACIVSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817963952 632762782 /nfs/dbraw/zinc/76/27/82/632762782.db2.gz ZCFXWHNHVMTNHR-VXGBXAGGSA-N 2 0 258.365 2.791 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817968496 632767583 /nfs/dbraw/zinc/76/75/83/632767583.db2.gz KFLJBRHJXIKWRF-WZRBSPASSA-N 2 0 278.371 2.811 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000817970534 632769525 /nfs/dbraw/zinc/76/95/25/632769525.db2.gz ZHNWGHZNDOEQIM-ZMLRMANQSA-N 2 0 268.788 2.966 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817970433 632769543 /nfs/dbraw/zinc/76/95/43/632769543.db2.gz VFRRDWBDRMEKGY-NWANDNLSSA-N 2 0 261.413 2.673 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000817976715 632774033 /nfs/dbraw/zinc/77/40/33/632774033.db2.gz SCHZJUYAJZIENZ-SCDSUCTJSA-N 2 0 290.382 2.811 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c(O)c1C ZINC000817976733 632774212 /nfs/dbraw/zinc/77/42/12/632774212.db2.gz SONMTOKVRMJITP-HIFRSBDPSA-N 2 0 274.408 2.802 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976183 632774265 /nfs/dbraw/zinc/77/42/65/632774265.db2.gz HQTAOCIBAHRVJU-DLBZAZTESA-N 2 0 287.451 2.935 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(N(C)C)cc1 ZINC000817976439 632774370 /nfs/dbraw/zinc/77/43/70/632774370.db2.gz XWUVHWMLEXCOMN-UONOGXRCSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cc(F)ccc1O ZINC000817976226 632774384 /nfs/dbraw/zinc/77/43/84/632774384.db2.gz ILHDKGFVNMFOBI-GHMZBOCLSA-N 2 0 254.349 2.699 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976728 632774623 /nfs/dbraw/zinc/77/46/23/632774623.db2.gz SJKBPJYHPMRINI-CZUORRHYSA-N 2 0 273.424 2.545 20 10 CFCDRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976185 632774634 /nfs/dbraw/zinc/77/46/34/632774634.db2.gz HQTAOCIBAHRVJU-IAGOWNOFSA-N 2 0 287.451 2.935 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000817977031 632775468 /nfs/dbraw/zinc/77/54/68/632775468.db2.gz ZMFNYAAVIHVEEE-RHSMWYFYSA-N 2 0 287.451 2.935 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H](C)CCC[NH3+])c(O)c1 ZINC000817978206 632775930 /nfs/dbraw/zinc/77/59/30/632775930.db2.gz YLDZKKBZPCIJQH-OLZOCXBDSA-N 2 0 250.386 2.787 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CC2 ZINC000817980015 632777249 /nfs/dbraw/zinc/77/72/49/632777249.db2.gz HHYLDIDVHSGINR-UONOGXRCSA-N 2 0 260.381 2.501 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000846698998 632777729 /nfs/dbraw/zinc/77/77/29/632777729.db2.gz OCZHUXKCRNRLKB-HOCLYGCPSA-N 2 0 275.440 2.844 20 10 CFCDRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000846705043 632778420 /nfs/dbraw/zinc/77/84/20/632778420.db2.gz XLPHQVJBDCNNDR-SBAHZNLJSA-N 2 0 273.424 2.577 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c(O)c1 ZINC000817981949 632778840 /nfs/dbraw/zinc/77/88/40/632778840.db2.gz OSXZRVOLFLRNRN-MELADBBJSA-N 2 0 262.397 2.787 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c(O)c1 ZINC000817981946 632778968 /nfs/dbraw/zinc/77/89/68/632778968.db2.gz OSXZRVOLFLRNRN-IHRRRGAJSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1O ZINC000817985619 632781864 /nfs/dbraw/zinc/78/18/64/632781864.db2.gz MHKREQMJOSXXJF-QWHCGFSZSA-N 2 0 260.381 2.718 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1O ZINC000817987833 632783221 /nfs/dbraw/zinc/78/32/21/632783221.db2.gz YOAAWKALJHSSEG-KQTLUZQSSA-N 2 0 274.408 2.821 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2([NH3+])CCCC2)c(O)c1C ZINC000854223132 635263039 /nfs/dbraw/zinc/26/30/39/635263039.db2.gz NSGMVYWYYWZWMU-ZDUSSCGKSA-N 2 0 262.397 2.931 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1O ZINC000157344759 650215698 /nfs/dbraw/zinc/21/56/98/650215698.db2.gz VTXBHWDOLNNYHU-HZSPNIEDSA-N 2 0 260.381 2.670 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000858244753 636162627 /nfs/dbraw/zinc/16/26/27/636162627.db2.gz GUSJGUVIEKFFOD-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1 ZINC000858491196 636270133 /nfs/dbraw/zinc/27/01/33/636270133.db2.gz ZXJHELKEJIAUTL-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000122664271 639305758 /nfs/dbraw/zinc/30/57/58/639305758.db2.gz UPSCXPISSSSZSQ-ZBFHGGJFSA-N 2 0 275.440 2.633 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc1F ZINC000122763409 639403744 /nfs/dbraw/zinc/40/37/44/639403744.db2.gz AWMHWPMYTJFOJT-HNNXBMFYSA-N 2 0 293.430 2.665 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1 ZINC000872725741 641913097 /nfs/dbraw/zinc/91/30/97/641913097.db2.gz VTCHLGBRRXMEMT-HOCLYGCPSA-N 2 0 274.408 2.535 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCCC[C@@H]([NH3+])C2)cc1C ZINC000873214803 642071495 /nfs/dbraw/zinc/07/14/95/642071495.db2.gz JGEPUADZIGIQED-OAHLLOKOSA-N 2 0 262.397 2.712 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1F ZINC000873215820 642071579 /nfs/dbraw/zinc/07/15/79/642071579.db2.gz HQEJMYHRARVKON-UKRRQHHQSA-N 2 0 293.430 2.699 20 10 CFCDRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)C1CC[NH2+]CC1 ZINC000873221545 642074835 /nfs/dbraw/zinc/07/48/35/642074835.db2.gz WNEBAGFCAUWDTP-SNVBAGLBSA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(F)ccc1O ZINC000873239825 642090183 /nfs/dbraw/zinc/09/01/83/642090183.db2.gz DIYNURZRJCHEOI-NQBHXWOUSA-N 2 0 266.360 2.699 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000873241823 642090756 /nfs/dbraw/zinc/09/07/56/642090756.db2.gz GFWZKIXKBSEVCZ-STQMWFEESA-N 2 0 292.423 2.830 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000873244813 642092778 /nfs/dbraw/zinc/09/27/78/642092778.db2.gz OFWIEXRHICUQOC-UONOGXRCSA-N 2 0 274.408 2.747 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1O ZINC000873245420 642092932 /nfs/dbraw/zinc/09/29/32/642092932.db2.gz QOJLKNQWNSVQIN-CHWSQXEVSA-N 2 0 262.397 2.821 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2cccc(C)c2O)CC1 ZINC000124804053 642336166 /nfs/dbraw/zinc/33/61/66/642336166.db2.gz UFEHCJXJLLQUSR-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP CCN1CCC([N@H+](C)Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000125227944 642563952 /nfs/dbraw/zinc/56/39/52/642563952.db2.gz UXLOFPLFRZWOGF-UHFFFAOYSA-N 2 0 293.430 2.808 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000877348626 643245682 /nfs/dbraw/zinc/24/56/82/643245682.db2.gz KYJODSYCETWTMV-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000877517138 643322586 /nfs/dbraw/zinc/32/25/86/643322586.db2.gz KELMLXLWKATCQG-YIONKMFJSA-N 2 0 274.408 2.758 20 10 CFCDRP C[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)ccc2O)CCN1C ZINC000093644258 650943694 /nfs/dbraw/zinc/94/36/94/650943694.db2.gz BTZDCOSOFDEULL-SMDDNHRTSA-N 2 0 282.815 2.960 20 10 CFCDRP C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)ccc2O)CCN1C ZINC000093644259 650943875 /nfs/dbraw/zinc/94/38/75/650943875.db2.gz BTZDCOSOFDEULL-RISCZKNCSA-N 2 0 282.815 2.960 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000094617961 650960126 /nfs/dbraw/zinc/96/01/26/650960126.db2.gz LTPVXJRYJGPRQG-LBPRGKRZSA-N 2 0 280.387 2.914 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000252675273 651016355 /nfs/dbraw/zinc/01/63/55/651016355.db2.gz ZCQVVWPNYWXETH-HOTGVXAUSA-N 2 0 274.408 2.720 20 10 CFCDRP CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883291015 645725274 /nfs/dbraw/zinc/72/52/74/645725274.db2.gz PMKUITDOJSXFQZ-AEFFLSMTSA-N 2 0 287.451 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C4CC4)CCC3)cc2)CC1 ZINC000886392176 646994828 /nfs/dbraw/zinc/99/48/28/646994828.db2.gz YQSZMDYEEIAVPC-UHFFFAOYSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Cl)ccc1O ZINC000925737126 648304884 /nfs/dbraw/zinc/30/48/84/648304884.db2.gz FYPKIBOFBVAHEO-SECBINFHSA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925787197 648324465 /nfs/dbraw/zinc/32/44/65/648324465.db2.gz XBNBWDLQPSBJND-SRRSOLGSSA-N 2 0 278.371 2.525 20 10 CFCDRP [NH3+]C[C@@H]1CCCCN1Cc1ccc(C(F)(F)F)cc1O ZINC001204933286 776969649 /nfs/dbraw/zinc/96/96/49/776969649.db2.gz RAMQMPYDQRPLOX-LBPRGKRZSA-N 2 0 288.313 2.724 20 10 CFCDRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC001235246278 778430739 /nfs/dbraw/zinc/43/07/39/778430739.db2.gz XBIMKLWBKLPVIG-CRAIPNDOSA-N 2 0 282.387 2.859 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c(O)c1 ZINC001235267745 778440388 /nfs/dbraw/zinc/44/03/88/778440388.db2.gz IJCLXENVALDYKW-BBRMVZONSA-N 2 0 288.435 2.874 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC2(CCCC2)C1 ZINC001235724173 778547105 /nfs/dbraw/zinc/54/71/05/778547105.db2.gz CVTMQNALTWEHSY-UHFFFAOYSA-N 2 0 299.462 2.862 20 10 CFCDRP C[C@@H]1CC[C@H]([NH3+])CN1Cc1ccc(N2CCCCC2)cc1 ZINC001235893118 778593918 /nfs/dbraw/zinc/59/39/18/778593918.db2.gz VCSCEJBRXWOYLT-WBVHZDCISA-N 2 0 287.451 2.989 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001236188878 778730937 /nfs/dbraw/zinc/73/09/37/778730937.db2.gz FFLBAUPLGAVPCN-UHFFFAOYSA-N 2 0 295.430 2.988 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1Cl ZINC001236321396 778778500 /nfs/dbraw/zinc/77/85/00/778778500.db2.gz JJCSXFSRMVQICF-BETUJISGSA-N 2 0 294.826 2.785 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+](CC(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236476104 778843915 /nfs/dbraw/zinc/84/39/15/778843915.db2.gz VMWQZFZEGWYFJT-OAHLLOKOSA-N 2 0 276.424 2.911 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237405485 779099192 /nfs/dbraw/zinc/09/91/92/779099192.db2.gz QTADSORATFSDOU-RISCZKNCSA-N 2 0 280.799 2.620 20 10 CFCDRP Cc1cc(N2CC[NH+](Cc3c(C)cccc3O)CC2)cc[nH+]1 ZINC001237490818 779119476 /nfs/dbraw/zinc/11/94/76/779119476.db2.gz BSNIMXGQWSELAD-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP [NH3+][C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001205117298 779259593 /nfs/dbraw/zinc/25/95/93/779259593.db2.gz NDCGDZMIPSQNID-LBPRGKRZSA-N 2 0 288.313 2.724 20 10 CFCDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000700811329 780724732 /nfs/dbraw/zinc/72/47/32/780724732.db2.gz BVVNCYHHNUGHAO-HIFRSBDPSA-N 2 0 274.408 2.701 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1 ZINC000705991441 781151697 /nfs/dbraw/zinc/15/16/97/781151697.db2.gz RZYDWMQRJHWZSB-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)CC1CC[NH2+]CC1 ZINC000094011801 283297529 /nfs/dbraw/zinc/29/75/29/283297529.db2.gz UQKXFPBICVFCOG-UHFFFAOYSA-N 2 0 262.397 2.604 20 10 CFCDRP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1C ZINC000037408382 372665206 /nfs/dbraw/zinc/66/52/06/372665206.db2.gz ZTEVBWZUKHTHIF-HNNXBMFYSA-N 2 0 274.408 2.578 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000093693668 375299505 /nfs/dbraw/zinc/29/95/05/375299505.db2.gz YZUXODXVQCIOMX-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000093596831 375272374 /nfs/dbraw/zinc/27/23/74/375272374.db2.gz CMZSSUNOWMOURG-QGZVFWFLSA-N 2 0 287.451 2.670 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000113326835 376010861 /nfs/dbraw/zinc/01/08/61/376010861.db2.gz FEJSUNLQMORNDQ-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c(O)c1 ZINC000125531833 377168129 /nfs/dbraw/zinc/16/81/29/377168129.db2.gz ZSIRLBJDKUEOAC-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C ZINC000131324215 377696140 /nfs/dbraw/zinc/69/61/40/377696140.db2.gz KFRRYQAFDORGTP-INIZCTEOSA-N 2 0 288.435 2.927 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(OC)ccc2O)C1 ZINC000180486584 380667318 /nfs/dbraw/zinc/66/73/18/380667318.db2.gz HRSMFSSAAWXVSM-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000297836847 381573227 /nfs/dbraw/zinc/57/32/27/381573227.db2.gz SEJDHMXNPZNZOA-KFWWJZLASA-N 2 0 274.408 2.842 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000185672076 381699479 /nfs/dbraw/zinc/69/94/79/381699479.db2.gz WUQZEWOTZKHRAH-MDZLAQPJSA-N 2 0 278.371 2.807 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC000295113175 382576818 /nfs/dbraw/zinc/57/68/18/382576818.db2.gz WHHLQZRNEKGTPX-MQVJKMGUSA-N 2 0 274.408 2.724 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(C)cc2O)C1 ZINC000249372088 383342750 /nfs/dbraw/zinc/34/27/50/383342750.db2.gz CWFPHBPKDKSFLN-KGLIPLIRSA-N 2 0 262.397 2.693 20 10 CFCDRP Cc1cccc(C[N@H+](C)CCC[NH+]2CCCC2)c1O ZINC000281313402 385189282 /nfs/dbraw/zinc/18/92/82/385189282.db2.gz QPFASXHILFWLCY-UHFFFAOYSA-N 2 0 262.397 2.618 20 10 CFCDRP CC(C)[N@H+](CCn1ccnc1)Cc1ccc(N(C)C)cc1 ZINC000270789440 385225653 /nfs/dbraw/zinc/22/56/53/385225653.db2.gz CDQLRMPQBSMFBG-UHFFFAOYSA-N 2 0 286.423 2.860 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC[N@@H+]1C ZINC000122917409 393973609 /nfs/dbraw/zinc/97/36/09/393973609.db2.gz AYXCWQUETSEMEI-WMLDXEAASA-N 2 0 287.451 2.641 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000157503229 394346512 /nfs/dbraw/zinc/34/65/12/394346512.db2.gz GYWCQFKSRNUHLK-RRFJBIMHSA-N 2 0 274.408 2.978 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000049554089 287047543 /nfs/dbraw/zinc/04/75/43/287047543.db2.gz ZNMRKVDZCLYOFO-UONOGXRCSA-N 2 0 263.429 2.743 20 10 CFCDRP C[NH+]1CCC(CC[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000297900683 277026457 /nfs/dbraw/zinc/02/64/57/277026457.db2.gz WDVHSYXDUZIPQM-HNNXBMFYSA-N 2 0 274.408 2.701 20 10 CFCDRP C[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)C[NH+]1CCCC1 ZINC000296066697 278287287 /nfs/dbraw/zinc/28/72/87/278287287.db2.gz RYUFOQMRQPTBSY-ZFWWWQNUSA-N 2 0 274.408 2.701 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423088944 330169117 /nfs/dbraw/zinc/16/91/17/330169117.db2.gz TXQWQDDFYTUEKP-BBRMVZONSA-N 2 0 285.435 2.964 20 10 CFCDRP CC(C)C[NH+]1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000227436585 519720824 /nfs/dbraw/zinc/72/08/24/519720824.db2.gz AAPFNZWYBJKVKL-UHFFFAOYSA-N 2 0 262.397 2.602 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000292855648 522184925 /nfs/dbraw/zinc/18/49/25/522184925.db2.gz CEFBASFCLZDPID-GOSISDBHSA-N 2 0 287.451 2.670 20 10 CFCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(O)cccc3Cl)CC[C@H]21 ZINC000228183455 523834379 /nfs/dbraw/zinc/83/43/79/523834379.db2.gz CHXVLGSODXCNKG-IUODEOHRSA-N 2 0 294.826 2.962 20 10 CFCDRP Cc1cccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1O ZINC000290523517 524393201 /nfs/dbraw/zinc/39/32/01/524393201.db2.gz QFYFCRCDMVHHOZ-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1O ZINC000290454522 524403989 /nfs/dbraw/zinc/40/39/89/524403989.db2.gz MMEFLZRCZAHKAD-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)C[NH+]1CCCC1 ZINC000094618158 524495994 /nfs/dbraw/zinc/49/59/94/524495994.db2.gz KDZAVGGWSCHLIU-OLZOCXBDSA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000036908288 524911800 /nfs/dbraw/zinc/91/18/00/524911800.db2.gz NIVRSMKUZWETNK-JKIFEVAISA-N 2 0 275.440 2.571 20 10 CFCDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000230672040 525313749 /nfs/dbraw/zinc/31/37/49/525313749.db2.gz NPXPDFVSRYSINU-LBPRGKRZSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CCC[NH+]2CCC(C)CC2)c1 ZINC000071406641 525348802 /nfs/dbraw/zinc/34/88/02/525348802.db2.gz RHEVGFSBWQGKJK-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c(O)c1 ZINC000037649051 525731372 /nfs/dbraw/zinc/73/13/72/525731372.db2.gz IAACUQGPBGHZGM-ZIAGYGMSSA-N 2 0 274.408 2.836 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1C ZINC000293266344 525921751 /nfs/dbraw/zinc/92/17/51/525921751.db2.gz CFDXFAPKNSZTIK-RISCZKNCSA-N 2 0 264.413 2.857 20 10 CFCDRP c1csc(SCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)n1 ZINC000754792588 574120812 /nfs/dbraw/zinc/12/08/12/574120812.db2.gz DJYGONWTAINUEW-OLZOCXBDSA-N 2 0 297.493 2.842 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH+](C)C)CC2)cc1C ZINC000738077495 574157286 /nfs/dbraw/zinc/15/72/86/574157286.db2.gz VTSZJEUOEAJKOX-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733326203 574221445 /nfs/dbraw/zinc/22/14/45/574221445.db2.gz OEFWVBKSYXFDLX-OAHLLOKOSA-N 2 0 293.430 2.712 20 10 CFCDRP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(O)c1 ZINC000725845991 574327831 /nfs/dbraw/zinc/32/78/31/574327831.db2.gz TYCSMOSOXRJKBP-CABCVRRESA-N 2 0 290.407 2.507 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)cc1 ZINC000925511882 618850653 /nfs/dbraw/zinc/85/06/53/618850653.db2.gz WCPXIWDAEPQTKY-CABCVRRESA-N 2 0 275.440 2.748 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c(O)c1C ZINC000925784303 619108885 /nfs/dbraw/zinc/10/88/85/619108885.db2.gz QOECSJCAZVDMIL-QWHCGFSZSA-N 2 0 298.377 2.904 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000894431771 619382776 /nfs/dbraw/zinc/38/27/76/619382776.db2.gz WVKBRRIVBYHKDW-UHFFFAOYSA-N 2 0 292.423 2.531 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000841005788 620211846 /nfs/dbraw/zinc/21/18/46/620211846.db2.gz KDTSXOPIIXVLAX-RDJZCZTQSA-N 2 0 289.467 2.963 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1 ZINC000841027643 620255602 /nfs/dbraw/zinc/25/56/02/620255602.db2.gz DODTYNRMJNHMMA-WXFDERKXSA-N 2 0 287.451 2.873 20 10 CFCDRP COc1cc(C)cc(C[N@H+](C)CC(C)(C)C[NH+](C)C)c1O ZINC000898306466 620369294 /nfs/dbraw/zinc/36/92/94/620369294.db2.gz JVDOMBGCNJTXJS-UHFFFAOYSA-N 2 0 294.439 2.729 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1 ZINC000841064679 620430706 /nfs/dbraw/zinc/43/07/06/620430706.db2.gz SORODDDUPSHNMA-UHFFFAOYSA-N 2 0 275.440 2.765 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000902485240 621110927 /nfs/dbraw/zinc/11/09/27/621110927.db2.gz JUETYLVEIVVOTK-IRUJWGPZSA-N 2 0 268.788 2.824 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000841073322 621123748 /nfs/dbraw/zinc/12/37/48/621123748.db2.gz RJZZAYDGRIFZDJ-ZDUSSCGKSA-N 2 0 268.788 2.667 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903441478 621377980 /nfs/dbraw/zinc/37/79/80/621377980.db2.gz UINONJSMVUZBHN-WBVHZDCISA-N 2 0 289.467 2.820 20 10 CFCDRP CC(C)([NH3+])CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000903941010 621482468 /nfs/dbraw/zinc/48/24/68/621482468.db2.gz LLSLUMXWNOKWTD-UHFFFAOYSA-N 2 0 275.440 2.894 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000904384260 621588326 /nfs/dbraw/zinc/58/83/26/621588326.db2.gz IDNUFNGWPJEDJP-MRXNPFEDSA-N 2 0 288.435 2.879 20 10 CFCDRP Cc1cccc(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)c1O ZINC000904444626 621599340 /nfs/dbraw/zinc/59/93/40/621599340.db2.gz RFDCRKSWHLZQRP-UHFFFAOYSA-N 2 0 276.424 2.898 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000071409435 625515618 /nfs/dbraw/zinc/51/56/18/625515618.db2.gz MIIKDVOIOSDGDZ-HOCLYGCPSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CC(C)C)cc2F)CC1 ZINC000062734835 623292529 /nfs/dbraw/zinc/29/25/29/623292529.db2.gz GVOWHOMAMUMPKU-UHFFFAOYSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[NH+]2CCCC2)cc1Cl ZINC000825417093 623689172 /nfs/dbraw/zinc/68/91/72/623689172.db2.gz JCFRIYAJQVXDDG-UHFFFAOYSA-N 2 0 282.815 2.930 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c(O)c1 ZINC000817959129 625964172 /nfs/dbraw/zinc/96/41/72/625964172.db2.gz PLIMIACKFIYONX-OLZOCXBDSA-N 2 0 250.386 2.643 20 10 CFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000083552287 625977635 /nfs/dbraw/zinc/97/76/35/625977635.db2.gz IEEUATMPWLNJST-LBPRGKRZSA-N 2 0 282.815 2.866 20 10 CFCDRP Cc1cc(C[NH+]2CCC(CC[NH3+])CC2)ccc1N(C)C ZINC000923385857 626470287 /nfs/dbraw/zinc/47/02/87/626470287.db2.gz FEXVABQXJOLZNC-UHFFFAOYSA-N 2 0 275.440 2.622 20 10 CFCDRP [NH3+]C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843047752 626547355 /nfs/dbraw/zinc/54/73/55/626547355.db2.gz ZRLOMIFOHHWNLL-UHFFFAOYSA-N 2 0 273.424 2.600 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2c(O)cc(C)cc2Cl)CC[C@H]1[NH3+] ZINC000843050380 626547685 /nfs/dbraw/zinc/54/76/85/626547685.db2.gz FDIMQEKKKLSCJC-SMDDNHRTSA-N 2 0 282.815 2.913 20 10 CFCDRP CCC(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000758482575 626595478 /nfs/dbraw/zinc/59/54/78/626595478.db2.gz USUNZVMUPNYBIZ-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(C)(C)C)cc2)CC1 ZINC000771819585 627634028 /nfs/dbraw/zinc/63/40/28/627634028.db2.gz UIVWUABACBAMOW-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccoc1 ZINC000771849365 627637345 /nfs/dbraw/zinc/63/73/45/627637345.db2.gz XMONFSZRSJDSFA-OAHLLOKOSA-N 2 0 299.418 2.882 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH+]3C4CCC3CC4)cc2)CC1 ZINC000775648815 628049211 /nfs/dbraw/zinc/04/92/11/628049211.db2.gz YHWGJVXIKNFSCH-UHFFFAOYSA-N 2 0 285.435 2.565 20 10 CFCDRP CC[NH+]1CCC([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835034019 629329968 /nfs/dbraw/zinc/32/99/68/629329968.db2.gz NFIOVIMFIOYLSE-WAYWQWQTSA-N 2 0 287.451 2.840 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835038342 629331258 /nfs/dbraw/zinc/33/12/58/629331258.db2.gz WGAGWQMGEPCMJB-IDTUSYRASA-N 2 0 275.440 2.696 20 10 CFCDRP CC1=CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000798090227 630149715 /nfs/dbraw/zinc/14/97/15/630149715.db2.gz HLQMCPQZMJBZFC-UHFFFAOYSA-N 2 0 285.435 2.590 20 10 CFCDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000840808431 631227267 /nfs/dbraw/zinc/22/72/67/631227267.db2.gz CDKBLBYCQQYCIP-UKRRQHHQSA-N 2 0 274.408 2.701 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000840808611 631228035 /nfs/dbraw/zinc/22/80/35/631228035.db2.gz NASNRKSNCDVLEZ-UONOGXRCSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000840929632 631266455 /nfs/dbraw/zinc/26/64/55/631266455.db2.gz TVOUVKSTKSSWHA-HNNXBMFYSA-N 2 0 287.451 2.635 20 10 CFCDRP CC[N@H+](CCC[NH+](C)C)Cc1ccc(N(C)C)cc1C ZINC000840949257 631277185 /nfs/dbraw/zinc/27/71/85/631277185.db2.gz SHJRYBMIHOGQGE-UHFFFAOYSA-N 2 0 277.456 2.835 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(C)ccc1O ZINC000809754873 631281320 /nfs/dbraw/zinc/28/13/20/631281320.db2.gz FKGFBHQKYYGWAU-UHFFFAOYSA-N 2 0 264.413 2.864 20 10 CFCDRP C[C@H]1C[C@@H](C[N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC000841002666 631300131 /nfs/dbraw/zinc/30/01/31/631300131.db2.gz ASUAEYWAYJBLRG-HOCLYGCPSA-N 2 0 275.440 2.573 20 10 CFCDRP CCN(CC)c1ccc(CNC[C@@H]([NH3+])C(C)C)cc1F ZINC000841028199 631309225 /nfs/dbraw/zinc/30/92/25/631309225.db2.gz CVZVXYUZCYDZMO-OAHLLOKOSA-N 2 0 281.419 2.745 20 10 CFCDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841029599 631310667 /nfs/dbraw/zinc/31/06/67/631310667.db2.gz ILBKPIAXMXRZDA-ZWNOBZJWSA-N 2 0 268.788 2.653 20 10 CFCDRP C[C@@H]([NH2+]Cc1cccc(Cl)c1[O-])[C@H]1CCC[NH2+]C1 ZINC000841033713 631313366 /nfs/dbraw/zinc/31/33/66/631313366.db2.gz USNGCHWZTFHRLY-MNOVXSKESA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(Cl)cc(CNC[C@@H]2CCCC[NH2+]2)c1O ZINC000841033757 631314089 /nfs/dbraw/zinc/31/40/89/631314089.db2.gz ZEFMBZITUAMYCS-ZDUSSCGKSA-N 2 0 268.788 2.586 20 10 CFCDRP [NH3+]C1(C[NH2+]Cc2cc(Cl)ccc2O)CCCCC1 ZINC000841039549 631318423 /nfs/dbraw/zinc/31/84/23/631318423.db2.gz TXWYPGFOWXJYAN-UHFFFAOYSA-N 2 0 268.788 2.797 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC2([NH3+])CCCCCC2)cc1 ZINC000841042748 631320180 /nfs/dbraw/zinc/32/01/80/631320180.db2.gz QYCAWCGWLZCCNS-UHFFFAOYSA-N 2 0 275.440 2.894 20 10 CFCDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841051706 631322152 /nfs/dbraw/zinc/32/21/52/631322152.db2.gz QRJZXMSZXKNBLX-SNVBAGLBSA-N 2 0 289.345 2.598 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000841057375 631323816 /nfs/dbraw/zinc/32/38/16/631323816.db2.gz JTYXYVZCLRQIKR-FZZYSBJUSA-N 2 0 273.424 2.625 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1F ZINC000841057724 631324177 /nfs/dbraw/zinc/32/41/77/631324177.db2.gz MNCXMAPYHBAXLS-OAHLLOKOSA-N 2 0 293.430 2.904 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000841072433 631330927 /nfs/dbraw/zinc/33/09/27/631330927.db2.gz KEPFETVWVBUNBB-LBPRGKRZSA-N 2 0 282.815 2.976 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000841081253 631332627 /nfs/dbraw/zinc/33/26/27/631332627.db2.gz ZLZRRVPUUSDRCN-QGZVFWFLSA-N 2 0 287.451 2.765 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000841080166 631333001 /nfs/dbraw/zinc/33/30/01/631333001.db2.gz OJNDNQAZYLGEMP-CQSZACIVSA-N 2 0 263.429 2.750 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H](C)CCCC[NH3+])c1O ZINC000841079387 631333102 /nfs/dbraw/zinc/33/31/02/631333102.db2.gz LTVSEDBUUJIEOR-NSHDSACASA-N 2 0 270.804 2.961 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)CCC[NH3+])c(Cl)c1 ZINC000841080173 631333459 /nfs/dbraw/zinc/33/34/59/631333459.db2.gz OMAUTWPXSNONKY-SNVBAGLBSA-N 2 0 256.777 2.571 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1O ZINC000841085219 631333924 /nfs/dbraw/zinc/33/39/24/631333924.db2.gz XBFPUDYCUBPQMR-MFKMUULPSA-N 2 0 268.788 2.571 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)cc1 ZINC000841087942 631335538 /nfs/dbraw/zinc/33/55/38/631335538.db2.gz UFNUMZBJJJWZQX-CRAIPNDOSA-N 2 0 289.467 2.950 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086484 631336013 /nfs/dbraw/zinc/33/60/13/631336013.db2.gz JNPZJDZFRCUXIA-GOEBONIOSA-N 2 0 274.408 2.665 20 10 CFCDRP C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000842211891 631566477 /nfs/dbraw/zinc/56/64/77/631566477.db2.gz ZOPYMTHANWGWNJ-IDTUSYRASA-N 2 0 275.440 2.553 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c(Cl)c1 ZINC000843046742 631813953 /nfs/dbraw/zinc/81/39/53/631813953.db2.gz AGUPXOWARJLJKM-NSHDSACASA-N 2 0 268.788 2.525 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1O ZINC000843051430 631814865 /nfs/dbraw/zinc/81/48/65/631814865.db2.gz HNMVGJHASHZZOT-GXFFZTMASA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c1O ZINC000843048621 631814898 /nfs/dbraw/zinc/81/48/98/631814898.db2.gz LJODPOYNRNRVHJ-LLVKDONJSA-N 2 0 282.815 2.913 20 10 CFCDRP C[NH2+]CC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000843049963 631815182 /nfs/dbraw/zinc/81/51/82/631815182.db2.gz WTYYWVNABZYXNF-UHFFFAOYSA-N 2 0 282.815 2.785 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843058264 631822389 /nfs/dbraw/zinc/82/23/89/631822389.db2.gz QPIGQROYMWVDRT-DOTOQJQBSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1O ZINC000843060186 631823620 /nfs/dbraw/zinc/82/36/20/631823620.db2.gz XLBRRPPJYSONIE-TUKIKUTGSA-N 2 0 294.826 2.913 20 10 CFCDRP CC1([NH3+])CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000843104952 631836494 /nfs/dbraw/zinc/83/64/94/631836494.db2.gz NUXSLLOFWZHPBW-UHFFFAOYSA-N 2 0 287.451 2.990 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000843105635 631836958 /nfs/dbraw/zinc/83/69/58/631836958.db2.gz ZMUCNWIHBXEDED-ARJAWSKDSA-N 2 0 273.424 2.625 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000843121033 631841921 /nfs/dbraw/zinc/84/19/21/631841921.db2.gz YPIOVCXXWNXPOV-SFHVURJKSA-N 2 0 287.451 2.718 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126311 631845749 /nfs/dbraw/zinc/84/57/49/631845749.db2.gz ISJYEKJJLHKBDN-ZIAGYGMSSA-N 2 0 292.398 2.743 20 10 CFCDRP C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000813877316 631971583 /nfs/dbraw/zinc/97/15/83/631971583.db2.gz RPVITWCJTXQAFZ-MNOVXSKESA-N 2 0 270.804 2.894 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])cc1C ZINC000844902291 632330965 /nfs/dbraw/zinc/33/09/65/632330965.db2.gz OUDBFODJYIUSRL-WBMJQRKESA-N 2 0 276.424 2.958 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846137364 632643626 /nfs/dbraw/zinc/64/36/26/632643626.db2.gz OLBFHGWQMUNKDS-ZDUSSCGKSA-N 2 0 292.423 2.926 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000846139475 632643785 /nfs/dbraw/zinc/64/37/85/632643785.db2.gz NVNVXWSZMQHTGX-OLZOCXBDSA-N 2 0 290.407 2.536 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1 ZINC000817865153 632714406 /nfs/dbraw/zinc/71/44/06/632714406.db2.gz JJUWSTVTQFPSDA-IPYPFGDCSA-N 2 0 292.423 2.596 20 10 CFCDRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817896382 632720499 /nfs/dbraw/zinc/72/04/99/632720499.db2.gz IACVITYYTSPTKY-BEFAXECRSA-N 2 0 297.446 2.801 20 10 CFCDRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817942438 632745361 /nfs/dbraw/zinc/74/53/61/632745361.db2.gz YOKRAZSKXRUSIX-QGZVFWFLSA-N 2 0 275.440 2.793 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(O)c1C ZINC000817946178 632748529 /nfs/dbraw/zinc/74/85/29/632748529.db2.gz TYWDYWQCGMKWDC-UONOGXRCSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH2+]C(C)C)c1ccccc1O ZINC000817954284 632753360 /nfs/dbraw/zinc/75/33/60/632753360.db2.gz WZUUFXYMKUKNSK-CQSZACIVSA-N 2 0 250.386 2.821 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000817956686 632755983 /nfs/dbraw/zinc/75/59/83/632755983.db2.gz AOLCCLWYVDTAGU-RCCFBDPRSA-N 2 0 287.451 2.712 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c(O)c1 ZINC000817960731 632759223 /nfs/dbraw/zinc/75/92/23/632759223.db2.gz QRIYPDSORRSPKF-GZBFAFLISA-N 2 0 262.397 2.869 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])c(O)c1 ZINC000817960733 632759381 /nfs/dbraw/zinc/75/93/81/632759381.db2.gz QRIYPDSORRSPKF-YDHLFZDLSA-N 2 0 262.397 2.869 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cc(F)ccc1O ZINC000817961303 632760249 /nfs/dbraw/zinc/76/02/49/632760249.db2.gz WWCYXVZGOUTSIZ-MJVIPROJSA-N 2 0 266.360 2.699 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817962284 632761722 /nfs/dbraw/zinc/76/17/22/632761722.db2.gz KXIUMXFZAFVEKV-CABCVRRESA-N 2 0 275.440 2.922 20 10 CFCDRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817966059 632764228 /nfs/dbraw/zinc/76/42/28/632764228.db2.gz ZYTJSRYYDDVVOM-AWEZNQCLSA-N 2 0 273.424 2.547 20 10 CFCDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817965396 632764595 /nfs/dbraw/zinc/76/45/95/632764595.db2.gz TZCJMUGHEBLMIJ-PBHICJAKSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817966269 632765057 /nfs/dbraw/zinc/76/50/57/632765057.db2.gz KAEWWOOWOITZPL-IAQYHMDHSA-N 2 0 266.360 2.572 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000817967669 632766187 /nfs/dbraw/zinc/76/61/87/632766187.db2.gz AKGJXTCEEDDSFJ-INIZCTEOSA-N 2 0 280.371 2.773 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972465 632771649 /nfs/dbraw/zinc/77/16/49/632771649.db2.gz XUMDGJPQVIEHTK-NFAWXSAZSA-N 2 0 261.413 2.544 20 10 CFCDRP C[C@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)c2c1c(F)ccc2O ZINC000817972654 632771948 /nfs/dbraw/zinc/77/19/48/632771948.db2.gz ZGPUXVHWJDTIFZ-WGBDABJCSA-N 2 0 278.371 2.810 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000817979000 632776350 /nfs/dbraw/zinc/77/63/50/632776350.db2.gz GHJJQXXGHYVDDQ-ONGXEEELSA-N 2 0 256.777 2.742 20 10 CFCDRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000846698425 632777550 /nfs/dbraw/zinc/77/75/50/632777550.db2.gz GYWQLBUPYXWEGD-WBVHZDCISA-N 2 0 287.451 2.989 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000846698996 632777564 /nfs/dbraw/zinc/77/75/64/632777564.db2.gz OCZHUXKCRNRLKB-GOEBONIOSA-N 2 0 275.440 2.844 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000817981428 632778121 /nfs/dbraw/zinc/77/81/21/632778121.db2.gz JFUSBLYDDCYHEA-OFQRWUPVSA-N 2 0 275.440 2.921 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[NH2+]C2CC2)c(O)c1C ZINC000817984669 632781079 /nfs/dbraw/zinc/78/10/79/632781079.db2.gz XFHPHRFGNCJIDU-CYBMUJFWSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1cc(Cl)ccc1O ZINC000817984273 632781274 /nfs/dbraw/zinc/78/12/74/632781274.db2.gz PPDBSHIRIBAYOG-SNVBAGLBSA-N 2 0 268.788 2.838 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000817987134 632781789 /nfs/dbraw/zinc/78/17/89/632781789.db2.gz WOOUPFUVMYNYDU-CHWSQXEVSA-N 2 0 290.407 2.726 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]3C3CCC3)cc2)CC1 ZINC000818230622 632816761 /nfs/dbraw/zinc/81/67/61/632816761.db2.gz QKEBVYBXZXFXAT-RBUKOAKNSA-N 2 0 299.462 2.717 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000818431140 632843679 /nfs/dbraw/zinc/84/36/79/632843679.db2.gz GNTILBKJPYOQTB-IAGOWNOFSA-N 2 0 275.440 2.892 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(N(C)C)cc1 ZINC000848559693 633289143 /nfs/dbraw/zinc/28/91/43/633289143.db2.gz XVPKJTXLCYHJHN-GRDNDAEWSA-N 2 0 275.440 2.743 20 10 CFCDRP CCc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](CC)C2)c1O ZINC000848894503 633381163 /nfs/dbraw/zinc/38/11/63/633381163.db2.gz JLIALOYUWLYHPC-CQSZACIVSA-N 2 0 276.424 2.776 20 10 CFCDRP CC[C@H](C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850356677 633952558 /nfs/dbraw/zinc/95/25/58/633952558.db2.gz ZCDASOSFHSGOIE-INIZCTEOSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)c2c1c(F)ccc2O ZINC000854224473 635262840 /nfs/dbraw/zinc/26/28/40/635262840.db2.gz XRIFTJCMELUFLD-ZYHUDNBSSA-N 2 0 278.371 2.941 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1O ZINC000157344452 650215640 /nfs/dbraw/zinc/21/56/40/650215640.db2.gz VTXBHWDOLNNYHU-MGPQQGTHSA-N 2 0 260.381 2.670 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000872254179 641719027 /nfs/dbraw/zinc/71/90/27/641719027.db2.gz VEZFGTLGNJXOOL-MRXNPFEDSA-N 2 0 289.467 2.929 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(F)ccc1O ZINC000873244207 642092239 /nfs/dbraw/zinc/09/22/39/642092239.db2.gz KEINSAVXSOTIIF-DGCLKSJQSA-N 2 0 280.387 2.960 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000873253079 642099080 /nfs/dbraw/zinc/09/90/80/642099080.db2.gz YXLPKCLRKAFIAC-NDMJEZRESA-N 2 0 268.788 2.824 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873257461 642102639 /nfs/dbraw/zinc/10/26/39/642102639.db2.gz SKHFHADEKOHLPN-YDHLFZDLSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(F)ccc1O ZINC000873271053 642112884 /nfs/dbraw/zinc/11/28/84/642112884.db2.gz DHLFTXSZCYFJSZ-WDEREUQCSA-N 2 0 266.360 2.570 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(C)cccc2O)[C@H](C)C1 ZINC000876763677 643000607 /nfs/dbraw/zinc/00/06/07/643000607.db2.gz LZEFUNYXDLZPAD-GDBMZVCRSA-N 2 0 276.424 2.863 20 10 CFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2c(C)cccc2O)C1 ZINC000876988545 643095550 /nfs/dbraw/zinc/09/55/50/643095550.db2.gz GDOXVUCYYZQJTJ-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000877113756 643157622 /nfs/dbraw/zinc/15/76/22/643157622.db2.gz FLTKAWVDVNQXEY-UHFFFAOYSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000877643928 643428757 /nfs/dbraw/zinc/42/87/57/643428757.db2.gz PHMUDWKGOXIXJD-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC000877740617 643508468 /nfs/dbraw/zinc/50/84/68/643508468.db2.gz KMQQNYABTNXXAQ-AEFFLSMTSA-N 2 0 287.451 2.587 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000247156181 650898781 /nfs/dbraw/zinc/89/87/81/650898781.db2.gz XMSWNYHWDYXNQO-DOTOQJQBSA-N 2 0 288.435 2.925 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CC[C@H]1[NH3+] ZINC000251848356 650995895 /nfs/dbraw/zinc/99/58/95/650995895.db2.gz RNAKRWFNTSVJBU-GXFFZTMASA-N 2 0 268.788 2.605 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CCCSc2nccs2)CC[N@@H+]1C ZINC000132157947 645884907 /nfs/dbraw/zinc/88/49/07/645884907.db2.gz IAMYZGZJMCFDPA-NEPJUHHUSA-N 2 0 285.482 2.698 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@H]4C[C@H]4C3)cc2)CC1 ZINC000886308789 646962457 /nfs/dbraw/zinc/96/24/57/646962457.db2.gz LKASFHHILFHAFE-BCDXTJNWSA-N 2 0 299.462 2.574 20 10 CFCDRP [NH3+]C1CCC([NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000220817244 647158524 /nfs/dbraw/zinc/15/85/24/647158524.db2.gz LEDLLPHXSONEHC-UHFFFAOYSA-N 2 0 299.212 2.514 20 10 CFCDRP CC1(C)C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@@H]([NH3+])C1 ZINC000925559438 648216422 /nfs/dbraw/zinc/21/64/22/648216422.db2.gz UIQZQJNDXOZTPZ-CABCVRRESA-N 2 0 274.408 2.617 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])c2c1c(F)ccc2O ZINC000925737500 648304186 /nfs/dbraw/zinc/30/41/86/648304186.db2.gz JMUWERAKFZADPE-ONGXEEELSA-N 2 0 266.360 2.797 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925785633 648323647 /nfs/dbraw/zinc/32/36/47/648323647.db2.gz OJCWYPYCBBCLOM-SUNKGSAMSA-N 2 0 282.815 2.942 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000925791157 648326021 /nfs/dbraw/zinc/32/60/21/648326021.db2.gz OETNHHNGYLYGLP-FMKPAKJESA-N 2 0 275.440 2.649 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000925799968 648327356 /nfs/dbraw/zinc/32/73/56/648327356.db2.gz QMLWNAKYJFPQKW-IIAWOOMASA-N 2 0 275.440 2.649 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000925800369 648327521 /nfs/dbraw/zinc/32/75/21/648327521.db2.gz QMLWNAKYJFPQKW-IJEWVQPXSA-N 2 0 275.440 2.649 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c1 ZINC000925845095 648342907 /nfs/dbraw/zinc/34/29/07/648342907.db2.gz KBXPEMTZTKMSFN-CSMYWGQOSA-N 2 0 290.407 2.584 20 10 CFCDRP CCN(C)c1ccc(CN2CCc3[nH+]ccc(N)c3C2)cc1 ZINC000931517106 649445533 /nfs/dbraw/zinc/44/55/33/649445533.db2.gz FREBRCNFQPEUGQ-UHFFFAOYSA-N 2 0 296.418 2.678 20 10 CFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](C)C1 ZINC001235821040 778567121 /nfs/dbraw/zinc/56/71/21/778567121.db2.gz XTYCBTOLVFMALW-CVEARBPZSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1c(CN2CC[NH2+][C@@H](C)CC2)c2ccccc2n1C ZINC001210476953 770293691 /nfs/dbraw/zinc/29/36/91/770293691.db2.gz ZLZUKQMLDHRMNC-ZDUSSCGKSA-N 2 0 271.408 2.671 20 10 CFCDRP CC(C)(C)c1ccc(CN2CC[C@@](C)([NH3+])C2)c(O)c1 ZINC001204800812 777981499 /nfs/dbraw/zinc/98/14/99/777981499.db2.gz HBXXASOLPDKONB-MRXNPFEDSA-N 2 0 262.397 2.613 20 10 CFCDRP Nc1ccc(C[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001235161734 778399848 /nfs/dbraw/zinc/39/98/48/778399848.db2.gz URSXJJVDYHRUGT-QGZVFWFLSA-N 2 0 273.424 2.623 20 10 CFCDRP Cc1c(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c2ccccc2n1C ZINC001235951744 778624225 /nfs/dbraw/zinc/62/42/25/778624225.db2.gz SCLSJNDPHBORQQ-HNNXBMFYSA-N 2 0 285.435 2.918 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC1CCCC1 ZINC001235958644 778628787 /nfs/dbraw/zinc/62/87/87/778628787.db2.gz OTQNHOCGPHUXJU-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP CN1CCCc2cc(C[N@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)ccc21 ZINC001236314426 778774656 /nfs/dbraw/zinc/77/46/56/778774656.db2.gz DXZAQLURRSTFIT-HDICACEKSA-N 2 0 299.462 2.500 20 10 CFCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(CC)cc3O)C[C@@H]2C1 ZINC001236788759 778937513 /nfs/dbraw/zinc/93/75/13/778937513.db2.gz QDCLHDBOXJZHRZ-IRXDYDNUSA-N 2 0 288.435 2.728 20 10 CFCDRP C[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236929178 778982539 /nfs/dbraw/zinc/98/25/39/778982539.db2.gz AHAZHGWSBTVKHG-AWEZNQCLSA-N 2 0 291.414 2.562 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)ccc1N(C)C ZINC001237386788 779090637 /nfs/dbraw/zinc/09/06/37/779090637.db2.gz AHJGWQBPACCMMO-DLBZAZTESA-N 2 0 287.451 2.635 20 10 CFCDRP CN1CCCc2cc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)ccc21 ZINC001237391298 779093489 /nfs/dbraw/zinc/09/34/89/779093489.db2.gz KRVRMILKNVXTQS-ROUUACIJSA-N 2 0 299.462 2.643 20 10 CFCDRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1O ZINC001237395598 779095366 /nfs/dbraw/zinc/09/53/66/779095366.db2.gz YBLMZDDCDUJCQT-HOCLYGCPSA-N 2 0 274.408 2.583 20 10 CFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000700811326 780724533 /nfs/dbraw/zinc/72/45/33/780724533.db2.gz BVVNCYHHNUGHAO-DZGCQCFKSA-N 2 0 274.408 2.701 20 10 CFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC001119090651 781748616 /nfs/dbraw/zinc/74/86/16/781748616.db2.gz IPXMSGBISXFPCB-ZDEQEGDKSA-N 2 0 260.381 2.576 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c(O)c1 ZINC000020087885 372227064 /nfs/dbraw/zinc/22/70/64/372227064.db2.gz YGROXHUSFCGIGN-ZDUSSCGKSA-N 2 0 264.413 2.939 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(OC)c2O)[C@H](C)C1 ZINC000093639353 375275913 /nfs/dbraw/zinc/27/59/13/375275913.db2.gz KWTWKZRCDDELQE-HIFRSBDPSA-N 2 0 292.423 2.563 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000185112776 381539272 /nfs/dbraw/zinc/53/92/72/381539272.db2.gz KBEXTNOYDXOSFR-STQMWFEESA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 ZINC000185672492 381699606 /nfs/dbraw/zinc/69/96/06/381699606.db2.gz CYJZYHSHYBENRF-MJBXVCDLSA-N 2 0 274.408 2.976 20 10 CFCDRP C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000185672133 381699632 /nfs/dbraw/zinc/69/96/32/381699632.db2.gz WUQZEWOTZKHRAH-GMXVVIOVSA-N 2 0 278.371 2.807 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185671993 381699944 /nfs/dbraw/zinc/69/99/44/381699944.db2.gz JULNFZHBOKVGFW-BFHYXJOUSA-N 2 0 274.408 2.976 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(C)ccc2O)C1 ZINC000249378535 383342565 /nfs/dbraw/zinc/34/25/65/383342565.db2.gz OCPRUPXQDXCWMO-ZIAGYGMSSA-N 2 0 262.397 2.693 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000272469382 385544951 /nfs/dbraw/zinc/54/49/51/385544951.db2.gz RPOKDFGUQKNOJA-UHFFFAOYSA-N 2 0 278.371 2.638 20 10 CFCDRP CC[C@@H](c1ccccc1O)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000312704256 393522158 /nfs/dbraw/zinc/52/21/58/393522158.db2.gz OIFPIWUPZYYZIK-DOTOQJQBSA-N 2 0 274.408 2.871 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC[N@@H+]1C ZINC000122917591 393973631 /nfs/dbraw/zinc/97/36/31/393973631.db2.gz AYXCWQUETSEMEI-PBHICJAKSA-N 2 0 287.451 2.641 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cccc(OC)c1O ZINC000290447338 394229186 /nfs/dbraw/zinc/22/91/86/394229186.db2.gz MDYMVQPDSXXLGI-UHFFFAOYSA-N 2 0 280.412 2.565 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1N(C)C ZINC000293950755 394286796 /nfs/dbraw/zinc/28/67/96/394286796.db2.gz BSFTZCWAZSLKHM-KRWDZBQOSA-N 2 0 289.467 2.977 20 10 CFCDRP C[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)C[NH+]1CCCCC1 ZINC000038042068 174044590 /nfs/dbraw/zinc/04/45/90/174044590.db2.gz WXCFIVIDFDRUGD-HNNXBMFYSA-N 2 0 288.435 2.833 20 10 CFCDRP CCOc1cccc(C[NH2+]CCC[N@H+](C)C(C)C)c1O ZINC000227436364 276380329 /nfs/dbraw/zinc/38/03/29/276380329.db2.gz XEPDSOVPRDDUMY-UHFFFAOYSA-N 2 0 280.412 2.611 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649233 522616523 /nfs/dbraw/zinc/61/65/23/522616523.db2.gz JRAAACJKTCWZNW-BBRMVZONSA-N 2 0 274.408 2.917 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1O ZINC000158035898 524403779 /nfs/dbraw/zinc/40/37/79/524403779.db2.gz DNGLCSNTEOFYGO-GDBMZVCRSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1cccc(C[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000227520892 524430170 /nfs/dbraw/zinc/43/01/70/524430170.db2.gz ZLIKTRNDNYPQFZ-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1O ZINC000278616327 524432562 /nfs/dbraw/zinc/43/25/62/524432562.db2.gz GXFBQMRWERCBKK-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC000742369268 574278375 /nfs/dbraw/zinc/27/83/75/574278375.db2.gz QUYGVEQWZJNQOK-OAHLLOKOSA-N 2 0 276.424 2.829 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1O ZINC000894193391 618435773 /nfs/dbraw/zinc/43/57/73/618435773.db2.gz PYKGBRJPZSPKJL-CQSZACIVSA-N 2 0 292.423 2.531 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000070188767 625280430 /nfs/dbraw/zinc/28/04/30/625280430.db2.gz MALFUMBADNUDQG-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000925692569 618937778 /nfs/dbraw/zinc/93/77/78/618937778.db2.gz MWNJGNDBUAMJCZ-SFHVURJKSA-N 2 0 283.419 2.881 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccccc1O ZINC000925787223 619112301 /nfs/dbraw/zinc/11/23/01/619112301.db2.gz ZGQUAXDETOTFFZ-WCQYABFASA-N 2 0 284.350 2.678 20 10 CFCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781981 619466079 /nfs/dbraw/zinc/46/60/79/619466079.db2.gz IHHJEAPZASDMHS-ABAIWWIYSA-N 2 0 296.361 2.587 20 10 CFCDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000903979138 621494223 /nfs/dbraw/zinc/49/42/23/621494223.db2.gz WMALEASPMBGWJX-XQJUWPJRSA-N 2 0 287.451 2.601 20 10 CFCDRP CCOc1cccc(CN2CC[C@]3(C2)CCCC[NH2+]3)c1O ZINC000904431565 621595306 /nfs/dbraw/zinc/59/53/06/621595306.db2.gz WRAQGMUEPXLCHW-KRWDZBQOSA-N 2 0 290.407 2.509 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1C ZINC000841089626 622349731 /nfs/dbraw/zinc/34/97/31/622349731.db2.gz PGGQNPWCVSCPPE-OAHLLOKOSA-N 2 0 274.408 2.773 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c1O ZINC000841101603 623052161 /nfs/dbraw/zinc/05/21/61/623052161.db2.gz WKHSIZFNKNBNHL-MFKMUULPSA-N 2 0 282.815 2.771 20 10 CFCDRP C[N@@H+](Cc1cc2c(cc1O)CCC2)CC1CC[NH+](C)CC1 ZINC000171604557 623233543 /nfs/dbraw/zinc/23/35/43/623233543.db2.gz GHHFJFANEPQTNK-UHFFFAOYSA-N 2 0 288.435 2.655 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1Cl ZINC000825101277 623629726 /nfs/dbraw/zinc/62/97/26/623629726.db2.gz AXGLYGKCWCEUMA-GFCCVEGCSA-N 2 0 294.826 2.928 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1 ZINC000834909834 625920129 /nfs/dbraw/zinc/92/01/29/625920129.db2.gz UQEXHCPCKBQTAV-ZDUSSCGKSA-N 2 0 292.423 2.926 20 10 CFCDRP c1[nH+]cn2cc(C[NH2+]Cc3ccc4c(c3)CCCO4)ccc12 ZINC000922177811 626231405 /nfs/dbraw/zinc/23/14/05/626231405.db2.gz KMHFGBCRDGGUPX-UHFFFAOYSA-N 2 0 293.370 2.949 20 10 CFCDRP CCC(C)(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771819982 627633612 /nfs/dbraw/zinc/63/36/12/627633612.db2.gz ZODWMNQTESRNHI-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP CC(C)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775649846 628050465 /nfs/dbraw/zinc/05/04/65/628050465.db2.gz TZFBOWHKBYYDRF-UHFFFAOYSA-N 2 0 275.440 2.526 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)ccc2O)C[C@@H]1C ZINC000775715466 628058144 /nfs/dbraw/zinc/05/81/44/628058144.db2.gz FQQGBWOAPPOCPQ-DZGCQCFKSA-N 2 0 292.423 2.705 20 10 CFCDRP CC(C)[C@@H]1CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775766379 628064474 /nfs/dbraw/zinc/06/44/74/628064474.db2.gz XGJHIPHRQKQOLY-SFHVURJKSA-N 2 0 287.451 2.669 20 10 CFCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccccc2O)C1 ZINC000779024651 628346302 /nfs/dbraw/zinc/34/63/02/628346302.db2.gz IKWXKRCLBJLCCF-OAHLLOKOSA-N 2 0 274.408 2.556 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2O)C[C@@H]1C ZINC000779027976 628346570 /nfs/dbraw/zinc/34/65/70/628346570.db2.gz UKODJLYYVSNVTF-ZFWWWQNUSA-N 2 0 262.397 2.697 20 10 CFCDRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000780575616 628479124 /nfs/dbraw/zinc/47/91/24/628479124.db2.gz FSLKSLHUPKLSQE-DOTOQJQBSA-N 2 0 287.451 2.717 20 10 CFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000040621671 649985602 /nfs/dbraw/zinc/98/56/02/649985602.db2.gz KBKZSSFDZYGFPX-GFCCVEGCSA-N 2 0 282.815 2.866 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC3(C)C)cc2)CC1 ZINC000808421671 630989386 /nfs/dbraw/zinc/98/93/86/630989386.db2.gz PLXJXNBBAHUCPS-KRWDZBQOSA-N 2 0 287.451 2.717 20 10 CFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000840808427 631227676 /nfs/dbraw/zinc/22/76/76/631227676.db2.gz CDKBLBYCQQYCIP-DZGCQCFKSA-N 2 0 274.408 2.701 20 10 CFCDRP CCN(CC)c1ccc(CNC[C@H]([NH3+])C(C)C)cc1 ZINC000841028490 631308927 /nfs/dbraw/zinc/30/89/27/631308927.db2.gz HOIZCTASOCEVIL-INIZCTEOSA-N 2 0 263.429 2.606 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031504 631311663 /nfs/dbraw/zinc/31/16/63/631311663.db2.gz STZCTTLGGIFDED-SMDDNHRTSA-N 2 0 282.815 2.961 20 10 CFCDRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@H]1CCC[NH2+]C1 ZINC000841032591 631312424 /nfs/dbraw/zinc/31/24/24/631312424.db2.gz FENZQYUDFNEWEX-MNOVXSKESA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]([NH2+]Cc1cccc(Cl)c1[O-])[C@@H]1CCC[NH2+]C1 ZINC000841033712 631314048 /nfs/dbraw/zinc/31/40/48/631314048.db2.gz USNGCHWZTFHRLY-GHMZBOCLSA-N 2 0 268.788 2.523 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000841034307 631315076 /nfs/dbraw/zinc/31/50/76/631315076.db2.gz CHODSDXOOGKYKB-MRXNPFEDSA-N 2 0 275.440 2.622 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c(Cl)c1 ZINC000841057430 631324597 /nfs/dbraw/zinc/32/45/97/631324597.db2.gz MNLGAHBIWQZUHB-OAHLLOKOSA-N 2 0 282.815 2.833 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000841057374 631324632 /nfs/dbraw/zinc/32/46/32/631324632.db2.gz JTYXYVZCLRQIKR-CGFBPQRUSA-N 2 0 273.424 2.625 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841060673 631326442 /nfs/dbraw/zinc/32/64/42/631326442.db2.gz AQYGRCHVUBGBEW-WBVHZDCISA-N 2 0 287.451 2.907 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c1O ZINC000841058580 631326641 /nfs/dbraw/zinc/32/66/41/631326641.db2.gz YESQLIRMKUAADO-OAHLLOKOSA-N 2 0 298.814 2.534 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000841058129 631326652 /nfs/dbraw/zinc/32/66/52/631326652.db2.gz PXBNOWMEYIOWPR-INIZCTEOSA-N 2 0 275.440 2.765 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000841072432 631330278 /nfs/dbraw/zinc/33/02/78/631330278.db2.gz KEPFETVWVBUNBB-GFCCVEGCSA-N 2 0 282.815 2.976 20 10 CFCDRP COc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1C ZINC000841072104 631330947 /nfs/dbraw/zinc/33/09/47/631330947.db2.gz GOWDTFLVVBXZGM-HNNXBMFYSA-N 2 0 262.397 2.625 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000841077669 631332339 /nfs/dbraw/zinc/33/23/39/631332339.db2.gz AHTMEKYBZJOBJB-VFADXPBXSA-N 2 0 275.440 2.873 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000841089513 631337224 /nfs/dbraw/zinc/33/72/24/631337224.db2.gz NZFQVZOCYZHOKB-OAHLLOKOSA-N 2 0 273.424 2.517 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2C)CC[C@@H]1[NH3+] ZINC000843050787 631815510 /nfs/dbraw/zinc/81/55/10/631815510.db2.gz PHHJIQJKZJFMGC-YOEHRIQHSA-N 2 0 275.440 2.620 20 10 CFCDRP CC[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000843050211 631815540 /nfs/dbraw/zinc/81/55/40/631815540.db2.gz BUDAEFNTNCHFKG-WXFDERKXSA-N 2 0 287.451 2.825 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c1O ZINC000843051946 631816869 /nfs/dbraw/zinc/81/68/69/631816869.db2.gz NANOZDUCRREYRP-NWDGAFQWSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000843059158 631822263 /nfs/dbraw/zinc/82/22/63/631822263.db2.gz DYPALZCMSFOZME-CGTJXYLNSA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000843113559 631838755 /nfs/dbraw/zinc/83/87/55/631838755.db2.gz XCEUIUASRQRJAP-HNNXBMFYSA-N 2 0 275.440 2.622 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000843120335 631841475 /nfs/dbraw/zinc/84/14/75/631841475.db2.gz FTTSMDLOABHKLI-IBGZPJMESA-N 2 0 299.462 2.862 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1O ZINC000843126304 631845014 /nfs/dbraw/zinc/84/50/14/631845014.db2.gz ILYFOOWVMJXGMM-BETUJISGSA-N 2 0 294.826 2.785 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCCCCC[NH3+])cc1F ZINC000843127975 631848002 /nfs/dbraw/zinc/84/80/02/631848002.db2.gz SJDXLDQXCHFGDB-UHFFFAOYSA-N 2 0 267.392 2.500 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1O ZINC000843130163 631848857 /nfs/dbraw/zinc/84/88/57/631848857.db2.gz ZBLYNDSPCRLOME-UWVGGRQHSA-N 2 0 256.777 2.569 20 10 CFCDRP CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000844924600 632338608 /nfs/dbraw/zinc/33/86/08/632338608.db2.gz YVYGUWGKZFGADS-MRXNPFEDSA-N 2 0 275.440 2.922 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000817865742 632715337 /nfs/dbraw/zinc/71/53/37/632715337.db2.gz XYLOYCVKNPTNKO-LXZKKBNFSA-N 2 0 289.467 2.866 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000817894372 632719863 /nfs/dbraw/zinc/71/98/63/632719863.db2.gz MGXZOJOLZXKJRI-IAGOWNOFSA-N 2 0 275.440 2.811 20 10 CFCDRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899744 632724382 /nfs/dbraw/zinc/72/43/82/632724382.db2.gz PDMCBIPADXSSOL-QAPCUYQASA-N 2 0 287.451 2.765 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1C[NH2+]C1 ZINC000817902024 632725747 /nfs/dbraw/zinc/72/57/47/632725747.db2.gz GVKIMTNVCAFDOD-OAHLLOKOSA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000817901278 632726016 /nfs/dbraw/zinc/72/60/16/632726016.db2.gz ANKSNLHMBWUOBQ-GFCCVEGCSA-N 2 0 297.402 2.634 20 10 CFCDRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(C)cc1O ZINC000817940083 632744096 /nfs/dbraw/zinc/74/40/96/632744096.db2.gz DPJXLJGAVOHUFS-HNNXBMFYSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000817943631 632746033 /nfs/dbraw/zinc/74/60/33/632746033.db2.gz QBBMHBYZWKGEJT-ZDUSSCGKSA-N 2 0 250.386 2.659 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000817942746 632746160 /nfs/dbraw/zinc/74/61/60/632746160.db2.gz DFXHXWQYHPVPQF-CMPLNLGQSA-N 2 0 266.360 2.669 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000817946553 632748362 /nfs/dbraw/zinc/74/83/62/632748362.db2.gz ZBCGOYIHMVRCRH-GJZGRUSLSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1cc(Cl)ccc1O ZINC000817954309 632753268 /nfs/dbraw/zinc/75/32/68/632753268.db2.gz YKIAXLJIVHVLBD-CABZTGNLSA-N 2 0 256.777 2.824 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817954399 632753592 /nfs/dbraw/zinc/75/35/92/632753592.db2.gz CJULBLZJCNZEFL-WMLDXEAASA-N 2 0 275.440 2.793 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(O)c1 ZINC000817954702 632754755 /nfs/dbraw/zinc/75/47/55/632754755.db2.gz HHGMQCWWRRTNRB-KBPBESRZSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c(O)c1C ZINC000817957635 632755726 /nfs/dbraw/zinc/75/57/26/632755726.db2.gz DLGZNSKITGEOEG-GXTWGEPZSA-N 2 0 250.386 2.643 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cc(F)ccc1O ZINC000817961302 632760622 /nfs/dbraw/zinc/76/06/22/632760622.db2.gz WWCYXVZGOUTSIZ-MISXGVKJSA-N 2 0 266.360 2.699 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC2([NH3+])CCC2)c2c1c(F)ccc2O ZINC000817965056 632764181 /nfs/dbraw/zinc/76/41/81/632764181.db2.gz ODXMKZITXVHQHJ-ONGXEEELSA-N 2 0 264.344 2.551 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc(Br)ccc1O ZINC000817965120 632764515 /nfs/dbraw/zinc/76/45/15/632764515.db2.gz LYFYGKPJOPEVMG-QPUJVOFHSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c(O)c1 ZINC000817966854 632766139 /nfs/dbraw/zinc/76/61/39/632766139.db2.gz XAQKDFLXECYISC-XJKSGUPXSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(O)c1C ZINC000817967709 632766467 /nfs/dbraw/zinc/76/64/67/632766467.db2.gz BFXSEXHKEFWADB-UONOGXRCSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817968683 632767514 /nfs/dbraw/zinc/76/75/14/632767514.db2.gz VUOSXCHUGZGEQK-CYBMUJFWSA-N 2 0 286.419 2.841 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972369 632771966 /nfs/dbraw/zinc/77/19/66/632771966.db2.gz WBAHXHKKUMFHFN-LXZKKBNFSA-N 2 0 275.440 2.934 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000817972466 632772002 /nfs/dbraw/zinc/77/20/02/632772002.db2.gz XUMDGJPQVIEHTK-UMVBOHGHSA-N 2 0 261.413 2.544 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000817972290 632772138 /nfs/dbraw/zinc/77/21/38/632772138.db2.gz VXPYIEKGKFERCJ-DZKIICNBSA-N 2 0 275.440 2.934 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H](C)[NH3+])c1cc(Br)ccc1O ZINC000817973950 632773820 /nfs/dbraw/zinc/77/38/20/632773820.db2.gz WYQMVEMIPSGLGS-GZMMTYOYSA-N 2 0 287.201 2.543 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000817978050 632775377 /nfs/dbraw/zinc/77/53/77/632775377.db2.gz USPSTHDDCYOXCN-KGLIPLIRSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817977941 632775411 /nfs/dbraw/zinc/77/54/11/632775411.db2.gz RVBIUDJBNBOGOF-HLTSFMKQSA-N 2 0 287.201 2.541 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCCN3CCCC[C@@H]23)cc1 ZINC000848574339 633293808 /nfs/dbraw/zinc/29/38/08/633293808.db2.gz CQRGGKSDTGIVAP-MSOLQXFVSA-N 2 0 287.451 2.859 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000848721409 633324909 /nfs/dbraw/zinc/32/49/09/633324909.db2.gz COOKPYBXJMGQJA-BHYGNILZSA-N 2 0 289.467 2.852 20 10 CFCDRP CCc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c1O ZINC000848889213 633363424 /nfs/dbraw/zinc/36/34/24/633363424.db2.gz GUSDTWDOHLWOAE-WBVHZDCISA-N 2 0 288.435 2.871 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@]3(C)CC3(C)C)cc2)CC1 ZINC000850399977 633977970 /nfs/dbraw/zinc/97/79/70/633977970.db2.gz WPEDIZSBVZFQIP-GOSISDBHSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000854230698 635265940 /nfs/dbraw/zinc/26/59/40/635265940.db2.gz WYMHLNQMVJQRBH-TZMCWYRMSA-N 2 0 250.386 2.725 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1 ZINC000858491197 636270479 /nfs/dbraw/zinc/27/04/79/636270479.db2.gz ZXJHELKEJIAUTL-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1ccc([C@H](C)N[C@H]2CC[C@@H](C)[NH2+]C2)c(O)c1C ZINC000863547037 637693761 /nfs/dbraw/zinc/69/37/61/637693761.db2.gz OEKIZSXSWRYNLJ-XBFCOCLRSA-N 2 0 262.397 2.800 20 10 CFCDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccccc2O)CC1 ZINC000865716696 638531670 /nfs/dbraw/zinc/53/16/70/638531670.db2.gz DGIBIUJTIJVMRG-UHFFFAOYSA-N 2 0 276.424 2.992 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CC[NH+](C)CC1 ZINC000122483967 639107507 /nfs/dbraw/zinc/10/75/07/639107507.db2.gz YIEITURRYYHVSS-CYBMUJFWSA-N 2 0 293.430 2.712 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1C ZINC000872251511 641717829 /nfs/dbraw/zinc/71/78/29/641717829.db2.gz LGGVFERBIGEQEF-OAHLLOKOSA-N 2 0 276.424 2.877 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc1C ZINC000872725578 641913685 /nfs/dbraw/zinc/91/36/85/641913685.db2.gz URFICMOMJJRURD-GOEBONIOSA-N 2 0 274.408 2.535 20 10 CFCDRP C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CC[NH2+]CC1 ZINC000873219964 642072962 /nfs/dbraw/zinc/07/29/62/642072962.db2.gz HXTGGNPVBNMRLZ-XVWMLYKFSA-N 2 0 287.451 2.744 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)C2CC[NH2+]CC2)c(Cl)c1 ZINC000873220378 642074040 /nfs/dbraw/zinc/07/40/40/642074040.db2.gz LSCAMFMNFYLEMY-LLVKDONJSA-N 2 0 282.815 2.832 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223832 642077841 /nfs/dbraw/zinc/07/78/41/642077841.db2.gz SYCNQHJLFIDVER-QGZVFWFLSA-N 2 0 276.424 2.898 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(F)ccc1O ZINC000873244208 642092072 /nfs/dbraw/zinc/09/20/72/642092072.db2.gz KEINSAVXSOTIIF-WCQYABFASA-N 2 0 280.387 2.960 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1O ZINC000873254839 642101196 /nfs/dbraw/zinc/10/11/96/642101196.db2.gz ADARCEUJNAQTBM-NHCYSSNCSA-N 2 0 268.788 2.742 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C1CC[NH2+]CC1 ZINC000873268441 642110937 /nfs/dbraw/zinc/11/09/37/642110937.db2.gz DHLFTXSZCYFJSZ-MNOVXSKESA-N 2 0 266.360 2.570 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c(O)c1 ZINC000876945654 643075016 /nfs/dbraw/zinc/07/50/16/643075016.db2.gz IHIHIEOOROSFHE-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c(O)c1 ZINC000876945655 643075639 /nfs/dbraw/zinc/07/56/39/643075639.db2.gz IHIHIEOOROSFHE-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2c(C)cccc2O)CC1 ZINC000877019005 643106076 /nfs/dbraw/zinc/10/60/76/643106076.db2.gz DKEOIOKRYUXUIN-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000877073715 643136717 /nfs/dbraw/zinc/13/67/17/643136717.db2.gz RAINGMVQYNSDPW-KBPBESRZSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000877492082 643306449 /nfs/dbraw/zinc/30/64/49/643306449.db2.gz QRACQSBZKJTTRO-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cccc(O)c1C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000877528658 643333220 /nfs/dbraw/zinc/33/32/20/643333220.db2.gz HFKKIDKVPNWNGD-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1O ZINC000877755666 643535355 /nfs/dbraw/zinc/53/53/55/643535355.db2.gz KUEUYKHNWONHDH-OLZOCXBDSA-N 2 0 262.397 2.916 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093451373 650939853 /nfs/dbraw/zinc/93/98/53/650939853.db2.gz RWLKYKQVGMHHCR-FGTMMUONSA-N 2 0 287.451 2.763 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+](C)CC[C@@H]([NH3+])C(C)C)c1 ZINC000133367444 646077626 /nfs/dbraw/zinc/07/76/26/646077626.db2.gz KYNXRBSNPRNTSJ-CQSZACIVSA-N 2 0 250.386 2.506 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CC2 ZINC000313193783 776236502 /nfs/dbraw/zinc/23/65/02/776236502.db2.gz MRUKYGANZKTCEU-RBSFLKMASA-N 2 0 272.392 2.596 20 10 CFCDRP Cc1cc(C)c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC001231842908 777346394 /nfs/dbraw/zinc/34/63/94/777346394.db2.gz YSOGVZHDMOVMJQ-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(O)c1 ZINC001235267746 778440180 /nfs/dbraw/zinc/44/01/80/778440180.db2.gz IJCLXENVALDYKW-CJNGLKHVSA-N 2 0 288.435 2.874 20 10 CFCDRP CCN(CC)c1ccc(CN(C)[C@@H]2CCC[NH2+]C2)cc1 ZINC001235342045 778460661 /nfs/dbraw/zinc/46/06/61/778460661.db2.gz GXYALMJXRXORQS-QGZVFWFLSA-N 2 0 275.440 2.717 20 10 CFCDRP CCCC[N@H+](CCC)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235663025 778530636 /nfs/dbraw/zinc/53/06/36/778530636.db2.gz OUASUNAXTQHVQW-UHFFFAOYSA-N 2 0 292.423 2.886 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CC(CC[NH3+])C2)cc1 ZINC001235918700 778608857 /nfs/dbraw/zinc/60/88/57/778608857.db2.gz ITWCIDMIACMLOB-UHFFFAOYSA-N 2 0 283.419 2.875 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001236188962 778730965 /nfs/dbraw/zinc/73/09/65/778730965.db2.gz GGCRJEUHAGQTFF-INIZCTEOSA-N 2 0 275.440 2.717 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314744 778774251 /nfs/dbraw/zinc/77/42/51/778774251.db2.gz GMRTZJPFFZRXQB-HDICACEKSA-N 2 0 299.462 2.718 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237405483 779098481 /nfs/dbraw/zinc/09/84/81/779098481.db2.gz QTADSORATFSDOU-FZMZJTMJSA-N 2 0 280.799 2.620 20 10 CFCDRP C[N@@H+](Cc1ccccc1O)Cc1cccc2c[nH+]cn21 ZINC001238109765 779256892 /nfs/dbraw/zinc/25/68/92/779256892.db2.gz JUZNNKDBNWJKLV-UHFFFAOYSA-N 2 0 267.332 2.672 20 10 CFCDRP COc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1C ZINC000700817236 780726979 /nfs/dbraw/zinc/72/69/79/780726979.db2.gz ALHCHAPXWSFLJW-INIZCTEOSA-N 2 0 276.424 2.825 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccccc1O ZINC000705991760 781151714 /nfs/dbraw/zinc/15/17/14/781151714.db2.gz VTVLEGRRPLFKAZ-ZIAGYGMSSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC001119090650 781748911 /nfs/dbraw/zinc/74/89/11/781748911.db2.gz IPXMSGBISXFPCB-LPWJVIDDSA-N 2 0 260.381 2.576 20 10 CFCDRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000293734418 296130943 /nfs/dbraw/zinc/13/09/43/296130943.db2.gz QIIJEGWWDAHAHE-UONOGXRCSA-N 2 0 263.429 2.601 20 10 CFCDRP CCC[NH+]1CCC([N@H+](C)Cc2cccc(OC)c2O)CC1 ZINC000092165710 375093497 /nfs/dbraw/zinc/09/34/97/375093497.db2.gz HOGOIOQUDXUPPJ-UHFFFAOYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)c1 ZINC000093770615 375310200 /nfs/dbraw/zinc/31/02/00/375310200.db2.gz PSXUHKPHWZFOIX-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3O)[C@H]2C1 ZINC000359909362 381672564 /nfs/dbraw/zinc/67/25/64/381672564.db2.gz YXXNKVGQUCWZQB-FZMZJTMJSA-N 2 0 280.799 2.572 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)c1 ZINC000185672156 381699578 /nfs/dbraw/zinc/69/95/78/381699578.db2.gz GYXVUFZSAMXEHD-AGIUHOORSA-N 2 0 290.407 2.677 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CCCC23CC[NH+](C)CC3)c1 ZINC000375470437 382089532 /nfs/dbraw/zinc/08/95/32/382089532.db2.gz DTPSQCKNXIBOKG-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP CN1CC[C@@H](C[NH2+]Cc2ccccc2O)[C@@H]1c1cccnc1 ZINC000364672521 382352142 /nfs/dbraw/zinc/35/21/42/382352142.db2.gz JNWRPKVWQPPWLC-WMZOPIPTSA-N 2 0 297.402 2.570 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)c(O)c1C ZINC000273562991 385688017 /nfs/dbraw/zinc/68/80/17/385688017.db2.gz IRANUBBEIBKAAB-TZMCWYRMSA-N 2 0 264.413 3.000 20 10 CFCDRP C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000057993874 278283575 /nfs/dbraw/zinc/28/35/75/278283575.db2.gz FBRGKOQJYIIXFE-HNNXBMFYSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)C[NH+]1CCCC1 ZINC000296066694 279353914 /nfs/dbraw/zinc/35/39/14/279353914.db2.gz RYUFOQMRQPTBSY-HIFRSBDPSA-N 2 0 274.408 2.701 20 10 CFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1cccc(OC)c1O ZINC000289556629 521013491 /nfs/dbraw/zinc/01/34/91/521013491.db2.gz YDEXZSPKDCJYCP-UHFFFAOYSA-N 2 0 292.423 2.709 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000290575993 522175905 /nfs/dbraw/zinc/17/59/05/522175905.db2.gz UEIKCESYHUMVCR-SJLPKXTDSA-N 2 0 287.451 2.669 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649235 522633522 /nfs/dbraw/zinc/63/35/22/522633522.db2.gz JRAAACJKTCWZNW-CJNGLKHVSA-N 2 0 274.408 2.917 20 10 CFCDRP CN1CCc2cc(C[NH2+]C3C[C@H]4CCC[C@@H](C3)[N@H+]4C)ccc21 ZINC000316003176 523997221 /nfs/dbraw/zinc/99/72/21/523997221.db2.gz QUQPZLPJWUTBGQ-AYHJJNSGSA-N 2 0 299.462 2.784 20 10 CFCDRP Cc1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1O ZINC000224492513 524403715 /nfs/dbraw/zinc/40/37/15/524403715.db2.gz DNGLCSNTEOFYGO-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649272 524763828 /nfs/dbraw/zinc/76/38/28/524763828.db2.gz MQFWPARJOBDXRJ-OLZOCXBDSA-N 2 0 290.407 2.536 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c(O)c1 ZINC000049553635 525739751 /nfs/dbraw/zinc/73/97/51/525739751.db2.gz DIVKWVHBQWDJEY-QWHCGFSZSA-N 2 0 250.386 2.691 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1 ZINC000293613924 525923126 /nfs/dbraw/zinc/92/31/26/525923126.db2.gz JHNAXOJDXNTMSI-OLZOCXBDSA-N 2 0 250.386 2.549 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCC[NH+](C)C)c2c1c(F)ccc2O ZINC000756342547 574227279 /nfs/dbraw/zinc/22/72/79/574227279.db2.gz KOXPZVASGJFXGB-PWSUYJOCSA-N 2 0 266.360 2.621 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000044533195 618027329 /nfs/dbraw/zinc/02/73/29/618027329.db2.gz GDYKDDBKSUIOHR-GJZGRUSLSA-N 2 0 275.440 2.745 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000051693157 618050185 /nfs/dbraw/zinc/05/01/85/618050185.db2.gz MDYYFRQYJCIWRE-UHFFFAOYSA-N 2 0 275.440 2.892 20 10 CFCDRP Oc1cccc(Cl)c1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000841072114 620805289 /nfs/dbraw/zinc/80/52/89/620805289.db2.gz HBUPMKRVNXVBAW-NSHDSACASA-N 2 0 268.788 2.667 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(C)cc(OC)c2O)C1 ZINC000894200668 618440896 /nfs/dbraw/zinc/44/08/96/618440896.db2.gz QGIFGVMVYDXGKY-AWEZNQCLSA-N 2 0 292.423 2.531 20 10 CFCDRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C12CCC2 ZINC000925542699 618902771 /nfs/dbraw/zinc/90/27/71/618902771.db2.gz IORRWGGJVAWGIZ-IRXDYDNUSA-N 2 0 285.435 2.646 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C(C)(C)CCC[NH+](C)C)c1O ZINC000894904593 619508778 /nfs/dbraw/zinc/50/87/78/619508778.db2.gz KBSMABLYZVPQTN-UHFFFAOYSA-N 2 0 294.439 2.919 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)c1O ZINC000895556539 619554923 /nfs/dbraw/zinc/55/49/23/619554923.db2.gz JQMPZZUJULNKOT-HNNXBMFYSA-N 2 0 297.402 2.806 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1 ZINC000841027641 620255349 /nfs/dbraw/zinc/25/53/49/620255349.db2.gz DODTYNRMJNHMMA-GOVFWEMJSA-N 2 0 287.451 2.873 20 10 CFCDRP Cc1cc(C)c([C@H](C)N[C@H]2C[NH2+]CC2(C)C)c(O)c1 ZINC000902441181 621081220 /nfs/dbraw/zinc/08/12/20/621081220.db2.gz CNHITVAEOMQACZ-JSGCOSHPSA-N 2 0 262.397 2.658 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1 ZINC000841077620 621418595 /nfs/dbraw/zinc/41/85/95/621418595.db2.gz ABDYOBMUEWNKNN-SHTZXODSSA-N 2 0 275.440 2.607 20 10 CFCDRP c1cc2c(cc1C[NH2+]CCC[C@@H]1CCC[NH2+]1)CCCO2 ZINC000904354150 621581658 /nfs/dbraw/zinc/58/16/58/621581658.db2.gz BKTAUVMYJKHHBR-MRXNPFEDSA-N 2 0 274.408 2.633 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000904359015 621582295 /nfs/dbraw/zinc/58/22/95/621582295.db2.gz VZODRFOWFGRDST-MRXNPFEDSA-N 2 0 286.419 2.776 20 10 CFCDRP [NH3+]CCCCCC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000904374780 621584876 /nfs/dbraw/zinc/58/48/76/621584876.db2.gz WRTDSADNTIDBJF-UHFFFAOYSA-N 2 0 262.397 2.620 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](CC[NH3+])C2)c(Cl)c1 ZINC000904406222 621590948 /nfs/dbraw/zinc/59/09/48/621590948.db2.gz UWHGQQJHHHKXGK-NSHDSACASA-N 2 0 268.788 2.525 20 10 CFCDRP [NH3+]C1(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC000904448630 621599279 /nfs/dbraw/zinc/59/92/79/621599279.db2.gz CWJPBNYELCYASU-UHFFFAOYSA-N 2 0 298.386 2.552 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1F ZINC000841085242 622220224 /nfs/dbraw/zinc/22/02/24/622220224.db2.gz XJIWBZRHRCIKRM-ZFWWWQNUSA-N 2 0 293.430 2.889 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000164517861 622958024 /nfs/dbraw/zinc/95/80/24/622958024.db2.gz JDGKOANHJCWGMI-WBVHZDCISA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1Cl ZINC000825101279 623629554 /nfs/dbraw/zinc/62/95/54/623629554.db2.gz AXGLYGKCWCEUMA-LBPRGKRZSA-N 2 0 294.826 2.928 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825126920 623634930 /nfs/dbraw/zinc/63/49/30/623634930.db2.gz UGJHXTRGUCXTED-LBPRGKRZSA-N 2 0 282.815 2.785 20 10 CFCDRP c1cc2c(cc1C[NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000921526495 625977994 /nfs/dbraw/zinc/97/79/94/625977994.db2.gz FBCYADKLAMITOL-HNNXBMFYSA-N 2 0 286.419 2.586 20 10 CFCDRP Cc1cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)ccc1N(C)C ZINC000923284570 626462485 /nfs/dbraw/zinc/46/24/85/626462485.db2.gz PLIZVAWCQSMLOB-AWEZNQCLSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(C[NH+]2CCC3(CC[NH2+]C3)CC2)ccc1N(C)C ZINC000923359301 626469023 /nfs/dbraw/zinc/46/90/23/626469023.db2.gz PNGGWHJUMBJJOG-UHFFFAOYSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)cc1C ZINC000843052746 626548259 /nfs/dbraw/zinc/54/82/59/626548259.db2.gz WANFKSAXZIHCAV-UONOGXRCSA-N 2 0 262.397 2.568 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)c1 ZINC000843056534 626549578 /nfs/dbraw/zinc/54/95/78/626549578.db2.gz PJLMVZORZUOYPO-OAHLLOKOSA-N 2 0 280.412 2.596 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)CC[C@H]([NH3+])C(C)C)c1 ZINC000843056533 626549604 /nfs/dbraw/zinc/54/96/04/626549604.db2.gz PJLMVZORZUOYPO-HNNXBMFYSA-N 2 0 280.412 2.596 20 10 CFCDRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccccc2O)CC1 ZINC000770509398 627526613 /nfs/dbraw/zinc/52/66/13/627526613.db2.gz LZFRLZXJTRFDRP-UHFFFAOYSA-N 2 0 262.397 2.697 20 10 CFCDRP C[C@@H](CC1CC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000776174466 628111005 /nfs/dbraw/zinc/11/10/05/628111005.db2.gz ATJIDZSGKTYGPH-HNNXBMFYSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCC1 ZINC000776252310 628122166 /nfs/dbraw/zinc/12/21/66/628122166.db2.gz BHZHYCFSADMXMV-HNNXBMFYSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC[N@@H+]1C ZINC000835042021 629336693 /nfs/dbraw/zinc/33/66/93/629336693.db2.gz FYLKZSLUOPMPCZ-BZOVTKSESA-N 2 0 287.451 2.838 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]4C[C@H]43)cc2)CC1 ZINC000800890334 630414602 /nfs/dbraw/zinc/41/46/02/630414602.db2.gz LAUYPBCKSCTNIR-QXAKKESOSA-N 2 0 299.462 2.717 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCCC[NH+](C)C)c(Cl)c1 ZINC000840888096 631253818 /nfs/dbraw/zinc/25/38/18/631253818.db2.gz YAYBKEDPTIKHDO-UHFFFAOYSA-N 2 0 270.804 2.785 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000840929425 631266412 /nfs/dbraw/zinc/26/64/12/631266412.db2.gz LECATAIOGNPOBK-HNNXBMFYSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000840929428 631266593 /nfs/dbraw/zinc/26/65/93/631266593.db2.gz LECATAIOGNPOBK-OAHLLOKOSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000840952518 631280285 /nfs/dbraw/zinc/28/02/85/631280285.db2.gz CQPZMRFBNFPDNC-UHFFFAOYSA-N 2 0 294.402 2.999 20 10 CFCDRP COc1ccc(O)c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000841030229 631310722 /nfs/dbraw/zinc/31/07/22/631310722.db2.gz VBUBDJTZEXOVNU-LBPRGKRZSA-N 2 0 286.375 2.710 20 10 CFCDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841029048 631310764 /nfs/dbraw/zinc/31/07/64/631310764.db2.gz DYVIWDHBUUOAFE-AEFFLSMTSA-N 2 0 287.451 2.894 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1C ZINC000841029544 631311082 /nfs/dbraw/zinc/31/10/82/631311082.db2.gz IFRBODCMUATJSF-DZGCQCFKSA-N 2 0 262.397 2.616 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1F ZINC000841037761 631316555 /nfs/dbraw/zinc/31/65/55/631316555.db2.gz WYMMEWFSKDGTLT-CQSZACIVSA-N 2 0 293.430 2.761 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC2([NH3+])CCCCC2)cc1 ZINC000841039198 631316906 /nfs/dbraw/zinc/31/69/06/631316906.db2.gz FFIAYHVZPXAVOO-UHFFFAOYSA-N 2 0 261.413 2.504 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000841057524 631324789 /nfs/dbraw/zinc/32/47/89/631324789.db2.gz OMDPXJAMBPNLDQ-UHFFFAOYSA-N 2 0 275.440 2.540 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CC2(C)CC[NH2+]CC2)c1O ZINC000841057930 631325582 /nfs/dbraw/zinc/32/55/82/631325582.db2.gz SJLKOYWJYNFXKE-UHFFFAOYSA-N 2 0 298.814 2.534 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1F ZINC000841073740 631330743 /nfs/dbraw/zinc/33/07/43/631330743.db2.gz XDTLEQWKOLJGQO-AWEZNQCLSA-N 2 0 279.403 2.514 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC000841072979 631331162 /nfs/dbraw/zinc/33/11/62/631331162.db2.gz OLQUOQGYTICOEJ-FUTAKVPZSA-N 2 0 287.451 2.744 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1C ZINC000841079324 631333110 /nfs/dbraw/zinc/33/31/10/631333110.db2.gz MCWOSPWPJFWUKV-SHTZXODSSA-N 2 0 276.424 2.858 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000841080899 631333410 /nfs/dbraw/zinc/33/34/10/631333410.db2.gz WTPTUQUNBXWQTE-HDJSIYSDSA-N 2 0 292.423 2.646 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c(Cl)c1 ZINC000841083393 631333817 /nfs/dbraw/zinc/33/38/17/631333817.db2.gz BVPMOZQSCJHGRM-GHMZBOCLSA-N 2 0 268.788 2.571 20 10 CFCDRP CSC1(C[NH2+]Cc2cc(C)ccc2O)CC[NH+](C)CC1 ZINC000810169881 631338235 /nfs/dbraw/zinc/33/82/35/631338235.db2.gz BNGYDCSUXPYNMT-UHFFFAOYSA-N 2 0 294.464 2.618 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(C)c(C)cc2O)CC[C@H]1[NH3+] ZINC000843051320 631815334 /nfs/dbraw/zinc/81/53/34/631815334.db2.gz CXXFJWXYKLOHNU-UKRRQHHQSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1O ZINC000843057793 631820414 /nfs/dbraw/zinc/82/04/14/631820414.db2.gz LCHCZVMGLASKRH-GHMZBOCLSA-N 2 0 268.788 2.523 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2ccc(N(C)C)cc2C)CC1 ZINC000843057393 631820676 /nfs/dbraw/zinc/82/06/76/631820676.db2.gz JYABDXMZHWAAFI-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000843056156 631820851 /nfs/dbraw/zinc/82/08/51/631820851.db2.gz VQNZWOLRWRJVOI-UHFFFAOYSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000843059161 631821733 /nfs/dbraw/zinc/82/17/33/631821733.db2.gz DYPALZCMSFOZME-SZMVWBNQSA-N 2 0 287.451 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@]2(C)CC[NH2+]C2)cc1 ZINC000843060439 631822907 /nfs/dbraw/zinc/82/29/07/631822907.db2.gz IYDDKIYVWAQRGB-SFHVURJKSA-N 2 0 289.467 2.964 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1 ZINC000843113637 631838982 /nfs/dbraw/zinc/83/89/82/631838982.db2.gz ZUJMDUYJXRFWBI-NJELEJDNSA-N 2 0 287.451 2.827 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c(Cl)c1 ZINC000843112623 631839180 /nfs/dbraw/zinc/83/91/80/631839180.db2.gz JKLXTWAOJABFAV-GFCCVEGCSA-N 2 0 282.815 2.915 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1O ZINC000843116322 631840562 /nfs/dbraw/zinc/84/05/62/631840562.db2.gz KLDMYVNAUSHJHM-AWEZNQCLSA-N 2 0 268.788 2.525 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000843125900 631844634 /nfs/dbraw/zinc/84/46/34/631844634.db2.gz CGHADMQDPRDSTB-UHFFFAOYSA-N 2 0 287.451 2.637 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1 ZINC000843125530 631845230 /nfs/dbraw/zinc/84/52/30/631845230.db2.gz BAXZTEHLCIARMC-IAGOWNOFSA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1C ZINC000843125824 631845805 /nfs/dbraw/zinc/84/58/05/631845805.db2.gz AIPDULVTTHQRRB-UHFFFAOYSA-N 2 0 274.408 2.585 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCCCCC[NH3+])c1 ZINC000843340669 631931142 /nfs/dbraw/zinc/93/11/42/631931142.db2.gz DIQBGQMEETYEGB-ZDUSSCGKSA-N 2 0 250.386 2.870 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000843342178 631932561 /nfs/dbraw/zinc/93/25/61/631932561.db2.gz KPLMITKWSHBGOX-IXDOHACOSA-N 2 0 287.451 2.539 20 10 CFCDRP C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000813877315 631971392 /nfs/dbraw/zinc/97/13/92/631971392.db2.gz RPVITWCJTXQAFZ-GHMZBOCLSA-N 2 0 270.804 2.894 20 10 CFCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(F)c1 ZINC000844905013 632332213 /nfs/dbraw/zinc/33/22/13/632332213.db2.gz RMDYQEQSSMTRPH-UHFFFAOYSA-N 2 0 286.350 2.509 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccccc1O ZINC000844924328 632338977 /nfs/dbraw/zinc/33/89/77/632338977.db2.gz ONYIIQNHRSZSFQ-NSHDSACASA-N 2 0 274.339 2.841 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000846141795 632644832 /nfs/dbraw/zinc/64/48/32/632644832.db2.gz SYZJKYIOWOHYAH-MJBXVCDLSA-N 2 0 290.407 2.678 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000817887700 632717140 /nfs/dbraw/zinc/71/71/40/632717140.db2.gz CHQNICCLLNMQRA-UONOGXRCSA-N 2 0 263.429 2.748 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000817944025 632746793 /nfs/dbraw/zinc/74/67/93/632746793.db2.gz WECOWFAQHHBRRF-ZDUSSCGKSA-N 2 0 250.386 2.659 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C2CCC([NH3+])CC2)c(O)c1C ZINC000817948276 632749574 /nfs/dbraw/zinc/74/95/74/632749574.db2.gz WKXGLEICSPXRAA-HSBZDZAISA-N 2 0 262.397 2.930 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(C)cc1O ZINC000817954429 632753405 /nfs/dbraw/zinc/75/34/05/632753405.db2.gz CWJXZGNBNBBOEO-UKRRQHHQSA-N 2 0 262.397 2.741 20 10 CFCDRP CC(C)[NH2+]CCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000817953975 632754097 /nfs/dbraw/zinc/75/40/97/632754097.db2.gz UFSXRIMABXDYOQ-CQSZACIVSA-N 2 0 263.429 2.791 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000817960340 632758933 /nfs/dbraw/zinc/75/89/33/632758933.db2.gz MFCUZARFODHKDE-GZBFAFLISA-N 2 0 262.397 2.869 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2([NH3+])CCC2)c1O ZINC000817965366 632764478 /nfs/dbraw/zinc/76/44/78/632764478.db2.gz SUXACSXYVZEZJE-SNVBAGLBSA-N 2 0 268.788 2.886 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)c2c1c(F)ccc2O ZINC000817970454 632769841 /nfs/dbraw/zinc/76/98/41/632769841.db2.gz VZMJJIJNLUPTGH-DCQANWLSSA-N 2 0 278.371 2.939 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817970432 632769935 /nfs/dbraw/zinc/76/99/35/632769935.db2.gz VFRRDWBDRMEKGY-CFVMTHIKSA-N 2 0 261.413 2.673 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c2c1c(F)ccc2O ZINC000817970455 632770099 /nfs/dbraw/zinc/77/00/99/632770099.db2.gz VZMJJIJNLUPTGH-UZWSLXQKSA-N 2 0 278.371 2.939 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C)cc1O ZINC000817976756 632774460 /nfs/dbraw/zinc/77/44/60/632774460.db2.gz SVHLPXJMEHDMNE-GOEBONIOSA-N 2 0 274.408 2.883 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C)cc1O ZINC000817976758 632774659 /nfs/dbraw/zinc/77/46/59/632774659.db2.gz SVHLPXJMEHDMNE-ZBFHGGJFSA-N 2 0 274.408 2.883 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000817978049 632775336 /nfs/dbraw/zinc/77/53/36/632775336.db2.gz USPSTHDDCYOXCN-KBPBESRZSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000846698424 632777313 /nfs/dbraw/zinc/77/73/13/632777313.db2.gz GYWQLBUPYXWEGD-RDJZCZTQSA-N 2 0 287.451 2.989 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c(O)c1 ZINC000817981883 632778884 /nfs/dbraw/zinc/77/88/84/632778884.db2.gz WPGRVKHEZNDKBO-KGLIPLIRSA-N 2 0 262.397 2.883 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c(O)c1 ZINC000817981884 632778992 /nfs/dbraw/zinc/77/89/92/632778992.db2.gz WPGRVKHEZNDKBO-UONOGXRCSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817983898 632779651 /nfs/dbraw/zinc/77/96/51/632779651.db2.gz KZOROGVXJQRXHV-CQSZACIVSA-N 2 0 273.424 2.713 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1C ZINC000817985850 632782010 /nfs/dbraw/zinc/78/20/10/632782010.db2.gz NJNOJDAMSAIPCD-CQSZACIVSA-N 2 0 274.408 2.969 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1 ZINC000817986681 632782203 /nfs/dbraw/zinc/78/22/03/632782203.db2.gz STEXXNIBIIYOCS-CYBMUJFWSA-N 2 0 260.381 2.661 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(O)c1 ZINC000817985104 632782342 /nfs/dbraw/zinc/78/23/42/632782342.db2.gz AHIVDBSISZMXHZ-LJISPDSOSA-N 2 0 274.408 2.739 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000818614879 632879915 /nfs/dbraw/zinc/87/99/15/632879915.db2.gz IDLKMFFXVONLCW-WKSBVSIWSA-N 2 0 278.371 2.939 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000818614876 632880083 /nfs/dbraw/zinc/88/00/83/632880083.db2.gz IDLKMFFXVONLCW-JHEVNIALSA-N 2 0 278.371 2.939 20 10 CFCDRP C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000818614878 632880182 /nfs/dbraw/zinc/88/01/82/632880182.db2.gz IDLKMFFXVONLCW-SQNXGDPESA-N 2 0 278.371 2.939 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(Cl)c1 ZINC000848561912 633290077 /nfs/dbraw/zinc/29/00/77/633290077.db2.gz DIKLQVPBGUVCSZ-TXEJJXNPSA-N 2 0 282.815 2.784 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1cc(Cl)ccc1O ZINC000854222051 635262961 /nfs/dbraw/zinc/26/29/61/635262961.db2.gz BXYOPAFBZPSUQL-SNVBAGLBSA-N 2 0 268.788 2.968 20 10 CFCDRP Cc1cccc(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)c1O ZINC000873223900 642078007 /nfs/dbraw/zinc/07/80/07/642078007.db2.gz UIWOZWWMDBEGDD-QGZVFWFLSA-N 2 0 276.424 2.898 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(F)ccc1O ZINC000873244209 642092313 /nfs/dbraw/zinc/09/23/13/642092313.db2.gz KEINSAVXSOTIIF-YPMHNXCESA-N 2 0 280.387 2.960 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000873253080 642099355 /nfs/dbraw/zinc/09/93/55/642099355.db2.gz YXLPKCLRKAFIAC-SUZMYJTESA-N 2 0 268.788 2.824 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000873268980 642111303 /nfs/dbraw/zinc/11/13/03/642111303.db2.gz JGENCYVNDYPSFS-OLZOCXBDSA-N 2 0 262.397 2.739 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2cccc(OCC)c2O)CC1 ZINC000020189702 642316727 /nfs/dbraw/zinc/31/67/27/642316727.db2.gz VWUXFTAWCKWIHQ-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP Cc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c(O)c1 ZINC000876631927 642951329 /nfs/dbraw/zinc/95/13/29/642951329.db2.gz ODHAWMRGNZZGRA-UHFFFAOYSA-N 2 0 276.424 2.864 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)cc2O)[C@H](C)C1 ZINC000876763596 642999649 /nfs/dbraw/zinc/99/96/49/642999649.db2.gz LCHHFCJLJKPNNG-GDBMZVCRSA-N 2 0 276.424 2.863 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CCC[NH+]1CCCCC1 ZINC000876900898 643056975 /nfs/dbraw/zinc/05/69/75/643056975.db2.gz TWVYPEMWAAKPEH-UHFFFAOYSA-N 2 0 262.397 2.666 20 10 CFCDRP Cc1cccc(O)c1C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000877479631 643297499 /nfs/dbraw/zinc/29/74/99/643297499.db2.gz XFKASLKZOKDWKX-CQSZACIVSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+](C)CC[C@H]([NH3+])C(C)C)c1 ZINC000133367225 646077831 /nfs/dbraw/zinc/07/78/31/646077831.db2.gz KYNXRBSNPRNTSJ-AWEZNQCLSA-N 2 0 250.386 2.506 20 10 CFCDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000925559442 648216570 /nfs/dbraw/zinc/21/65/70/648216570.db2.gz UIQZQJNDXOZTPZ-HUUCEWRRSA-N 2 0 274.408 2.617 20 10 CFCDRP CC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(N(C)C)cc1 ZINC000925742509 648306666 /nfs/dbraw/zinc/30/66/66/648306666.db2.gz UYOXXFOEEZVVBX-OAHLLOKOSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cc(F)cc(F)c1[O-] ZINC000925839889 648340255 /nfs/dbraw/zinc/34/02/55/648340255.db2.gz FRODDRKDPCFNRU-DRZCJDIDSA-N 2 0 296.361 2.853 20 10 CFCDRP [NH3+]CC[C@@H]1CCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001235924897 778611562 /nfs/dbraw/zinc/61/15/62/778611562.db2.gz ANJOLRYZLKHURC-SFHVURJKSA-N 2 0 299.462 2.699 20 10 CFCDRP C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@H]1C[NH3+] ZINC000708854533 775522721 /nfs/dbraw/zinc/52/27/21/775522721.db2.gz YPOMSYQIHAMLIZ-GXTWGEPZSA-N 2 0 270.376 2.572 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)c(Cl)c1 ZINC001222539348 776169261 /nfs/dbraw/zinc/16/92/61/776169261.db2.gz YCSPVBUXBFUHPR-UHFFFAOYSA-N 2 0 299.821 2.669 20 10 CFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@H]2C1 ZINC001231589144 777269615 /nfs/dbraw/zinc/26/96/15/777269615.db2.gz CRZQIEWKIZUERH-HZPDHXFCSA-N 2 0 296.414 2.929 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)c1O ZINC001231592030 777271354 /nfs/dbraw/zinc/27/13/54/777271354.db2.gz AFLGQHIVZAMFRP-UHFFFAOYSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1cc(C)c(C[N@@H+]2C[C@H]3[C@H](C2)CCCN3C)c(O)c1 ZINC001231847980 777347790 /nfs/dbraw/zinc/34/77/90/777347790.db2.gz GOSKCBLFHMUZQN-HOCLYGCPSA-N 2 0 274.408 2.535 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)cc1Cl ZINC001231870215 777359975 /nfs/dbraw/zinc/35/99/75/777359975.db2.gz OCNWHVPJBQUMQX-UHFFFAOYSA-N 2 0 294.826 2.882 20 10 CFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC001231883687 777367114 /nfs/dbraw/zinc/36/71/14/777367114.db2.gz NDAMANLPJULYAQ-IRXDYDNUSA-N 2 0 296.414 2.929 20 10 CFCDRP Cc1cc(O)c(CN2CCC[C@@]3(CC[NH2+]C3)C2)cc1Cl ZINC001234997358 778349582 /nfs/dbraw/zinc/34/95/82/778349582.db2.gz BQXYIIKKQXQTDC-INIZCTEOSA-N 2 0 294.826 2.930 20 10 CFCDRP CCN(CC)c1ccc(CN2CCC[C@]23CC[NH2+]C3)cc1 ZINC001235111788 778383603 /nfs/dbraw/zinc/38/36/03/778383603.db2.gz VSLNRSYDYKGRPN-GOSISDBHSA-N 2 0 287.451 2.861 20 10 CFCDRP CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236113965 778699324 /nfs/dbraw/zinc/69/93/24/778699324.db2.gz WXPFYUMWLASRKE-GOSISDBHSA-N 2 0 287.451 2.717 20 10 CFCDRP Nc1ccc(C[N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236550385 778875794 /nfs/dbraw/zinc/87/57/94/778875794.db2.gz GYQACRDMECHAFJ-QAQDUYKDSA-N 2 0 273.424 2.751 20 10 CFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C(C)(C)C ZINC001236938950 778982477 /nfs/dbraw/zinc/98/24/77/778982477.db2.gz NRXCQJNPNNTNJZ-UHFFFAOYSA-N 2 0 293.430 2.808 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c(O)c1 ZINC001205109686 779234155 /nfs/dbraw/zinc/23/41/55/779234155.db2.gz JHRONVNCEPTQGS-OAHLLOKOSA-N 2 0 291.439 2.552 20 10 CFCDRP CCc1cccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c1O ZINC000705213646 781135552 /nfs/dbraw/zinc/13/55/52/781135552.db2.gz ZNCPYFDQXNABHX-CQSZACIVSA-N 2 0 276.424 2.728 20 10 CFCDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000045664002 299288299 /nfs/dbraw/zinc/28/82/99/299288299.db2.gz OZGQOKBPDIKTQU-AWEZNQCLSA-N 2 0 263.429 2.745 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC(CC[NH+](C)C)CC2)c1 ZINC000092381283 375106436 /nfs/dbraw/zinc/10/64/36/375106436.db2.gz RCWDPWREGFLFTK-UHFFFAOYSA-N 2 0 276.424 2.864 20 10 CFCDRP C[NH+]1CCC(CC[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000113336189 376011483 /nfs/dbraw/zinc/01/14/83/376011483.db2.gz XTYPCSNRNLLFCR-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000179580293 380561147 /nfs/dbraw/zinc/56/11/47/380561147.db2.gz YWOZKPHBRISNET-OAHLLOKOSA-N 2 0 274.408 2.700 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CC2 ZINC000296031225 381220482 /nfs/dbraw/zinc/22/04/82/381220482.db2.gz QCGYXQXYCHPWMU-MRXNPFEDSA-N 2 0 286.419 2.844 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251148564 383385960 /nfs/dbraw/zinc/38/59/60/383385960.db2.gz GYWCQFKSRNUHLK-KKUMJFAQSA-N 2 0 274.408 2.978 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185671361 286198568 /nfs/dbraw/zinc/19/85/68/286198568.db2.gz QMIMAGXBMQCRSX-CABCVRRESA-N 2 0 294.439 2.708 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000020128809 171016334 /nfs/dbraw/zinc/01/63/34/171016334.db2.gz VIGLEUDTWMPFKP-CQSZACIVSA-N 2 0 292.423 2.927 20 10 CFCDRP CC1CC[NH+](CCC[NH2+]Cc2ccccc2O)CC1 ZINC000020146257 171032493 /nfs/dbraw/zinc/03/24/93/171032493.db2.gz KRFNFQPORSCQLC-UHFFFAOYSA-N 2 0 262.397 2.604 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccccc1O ZINC000037643961 173590450 /nfs/dbraw/zinc/59/04/50/173590450.db2.gz WIOIGWIIPLFCEA-HIFRSBDPSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC[N@@H+]1C ZINC000090720475 260261519 /nfs/dbraw/zinc/26/15/19/260261519.db2.gz OVFPYUOOXPRFKQ-WBVHZDCISA-N 2 0 287.451 2.859 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185670820 279898504 /nfs/dbraw/zinc/89/85/04/279898504.db2.gz NBMZKOBCKUGEKW-HUUCEWRRSA-N 2 0 294.439 2.708 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@@H]1CC[NH2+]C1 ZINC000423088567 330169239 /nfs/dbraw/zinc/16/92/39/330169239.db2.gz SGJYWOIHYAJWCB-UONOGXRCSA-N 2 0 271.408 2.574 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)cc1 ZINC000194540411 520895003 /nfs/dbraw/zinc/89/50/03/520895003.db2.gz YAWWTBNBRQBQLC-CALCHBBNSA-N 2 0 287.451 2.526 20 10 CFCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000277521495 521335617 /nfs/dbraw/zinc/33/56/17/521335617.db2.gz PIAIJZPLYGGVPV-HNNXBMFYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCOc1cccc(C[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000227330700 521362155 /nfs/dbraw/zinc/36/21/55/521362155.db2.gz PCYKMFOXGAUQCY-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(C)ccc2O)C1 ZINC000037644334 521710476 /nfs/dbraw/zinc/71/04/76/521710476.db2.gz OCPRUPXQDXCWMO-KBPBESRZSA-N 2 0 262.397 2.693 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000290575992 522181046 /nfs/dbraw/zinc/18/10/46/522181046.db2.gz UEIKCESYHUMVCR-FUHWJXTLSA-N 2 0 287.451 2.669 20 10 CFCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(O)cccc3Cl)CC[C@@H]21 ZINC000156094036 523856599 /nfs/dbraw/zinc/85/65/99/523856599.db2.gz CHXVLGSODXCNKG-WFASDCNBSA-N 2 0 294.826 2.962 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000020088839 524751041 /nfs/dbraw/zinc/75/10/41/524751041.db2.gz HJQPTXREMICIAR-CQSZACIVSA-N 2 0 292.423 2.755 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649271 524771655 /nfs/dbraw/zinc/77/16/55/524771655.db2.gz MQFWPARJOBDXRJ-STQMWFEESA-N 2 0 290.407 2.536 20 10 CFCDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N(C)C)cc1 ZINC000037229449 525334902 /nfs/dbraw/zinc/33/49/02/525334902.db2.gz PMPKRTHGJGBEGH-HNNXBMFYSA-N 2 0 275.440 2.889 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1C ZINC000293266335 525924609 /nfs/dbraw/zinc/92/46/09/525924609.db2.gz CFDXFAPKNSZTIK-FZMZJTMJSA-N 2 0 264.413 2.857 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)c(O)c1 ZINC000049553636 525933134 /nfs/dbraw/zinc/93/31/34/525933134.db2.gz DIVKWVHBQWDJEY-STQMWFEESA-N 2 0 250.386 2.691 20 10 CFCDRP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(O)c1 ZINC000725845996 574327811 /nfs/dbraw/zinc/32/78/11/574327811.db2.gz TYCSMOSOXRJKBP-HUUCEWRRSA-N 2 0 290.407 2.507 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000083552433 618025262 /nfs/dbraw/zinc/02/52/62/618025262.db2.gz GTDDKLOOKKHZBF-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000044516312 618026973 /nfs/dbraw/zinc/02/69/73/618026973.db2.gz WPTDGWDHGLDEED-CYBMUJFWSA-N 2 0 262.397 2.693 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)cc1 ZINC000925511885 618850681 /nfs/dbraw/zinc/85/06/81/618850681.db2.gz WCPXIWDAEPQTKY-LSDHHAIUSA-N 2 0 275.440 2.748 20 10 CFCDRP CCN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[NH+](C)C[C@@H]3C2)cc1 ZINC000931436751 618975200 /nfs/dbraw/zinc/97/52/00/618975200.db2.gz LGLIFTRAQBZIGW-DLBZAZTESA-N 2 0 287.451 2.526 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000063197636 619162729 /nfs/dbraw/zinc/16/27/29/619162729.db2.gz FFEIVNNOTVHYNE-GOSISDBHSA-N 2 0 287.451 2.717 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1 ZINC000925876467 619196985 /nfs/dbraw/zinc/19/69/85/619196985.db2.gz ZEAREFODZGRVKR-FMKPAKJESA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(C)cc1O ZINC000925879528 619199975 /nfs/dbraw/zinc/19/99/75/619199975.db2.gz HCSWFGSQCOKFPC-IPYPFGDCSA-N 2 0 262.397 2.869 20 10 CFCDRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c1O ZINC000894315010 619329791 /nfs/dbraw/zinc/32/97/91/619329791.db2.gz ANZRDQGJDZEMFY-CABCVRRESA-N 2 0 292.423 2.672 20 10 CFCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781984 619465971 /nfs/dbraw/zinc/46/59/71/619465971.db2.gz IHHJEAPZASDMHS-IAQYHMDHSA-N 2 0 296.361 2.587 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1C ZINC000841028532 620255836 /nfs/dbraw/zinc/25/58/36/620255836.db2.gz AVZCNGXBZVIKBT-HUUCEWRRSA-N 2 0 262.397 2.611 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000841038575 620375049 /nfs/dbraw/zinc/37/50/49/620375049.db2.gz ZBYRMNNRRHABKT-KRWDZBQOSA-N 2 0 287.451 2.766 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2(C)CC[NH2+]CC2)c(Cl)c1 ZINC000841058384 620422824 /nfs/dbraw/zinc/42/28/24/620422824.db2.gz WVZXYRXKSQVQQG-UHFFFAOYSA-N 2 0 282.815 2.833 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]([NH3+])CC(F)F ZINC000903889092 621460127 /nfs/dbraw/zinc/46/01/27/621460127.db2.gz ONKNQOJUFQDFIP-GFCCVEGCSA-N 2 0 272.339 2.587 20 10 CFCDRP CCC1([NH3+])CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000903946040 621483767 /nfs/dbraw/zinc/48/37/67/621483767.db2.gz GNTPTMIZFZBUMG-AATRIKPKSA-N 2 0 287.451 2.969 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903974232 621492375 /nfs/dbraw/zinc/49/23/75/621492375.db2.gz MQSCBMKSRSPPNN-NVXWUHKLSA-N 2 0 289.467 2.868 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@H]1CC[NH3+] ZINC000903978508 621494176 /nfs/dbraw/zinc/49/41/76/621494176.db2.gz OPXVCVSMWHIPDT-GWOVIKRFSA-N 2 0 287.451 2.683 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000044533403 622918221 /nfs/dbraw/zinc/91/82/21/622918221.db2.gz LSKKBZANAMIRDA-ZIAGYGMSSA-N 2 0 262.397 2.693 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(OC)ccc2O)CC1 ZINC000044517464 622918564 /nfs/dbraw/zinc/91/85/64/622918564.db2.gz YVKWYQUPQUSSNO-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070171452 625278905 /nfs/dbraw/zinc/27/89/05/625278905.db2.gz WHFPGBGPZBOMQO-GHMZBOCLSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)c(O)c1 ZINC000817959130 625964282 /nfs/dbraw/zinc/96/42/82/625964282.db2.gz PLIMIACKFIYONX-QWHCGFSZSA-N 2 0 250.386 2.643 20 10 CFCDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccccc2O)CC1 ZINC000922848023 626380225 /nfs/dbraw/zinc/38/02/25/626380225.db2.gz KDKPOTNKYAGJBD-UHFFFAOYSA-N 2 0 274.408 2.889 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CCN(C2CC2)CC1 ZINC000838947633 626515221 /nfs/dbraw/zinc/51/52/21/626515221.db2.gz CGTCWRPWHVKJAQ-UHFFFAOYSA-N 2 0 287.451 2.777 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000843056763 626550246 /nfs/dbraw/zinc/55/02/46/626550246.db2.gz ZJDUFOILCIWZOR-VOTSOKGWSA-N 2 0 275.440 2.683 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(OC)c2O)C[C@H]1C ZINC000769469697 627444500 /nfs/dbraw/zinc/44/45/00/627444500.db2.gz CSCTUTHIJHBVFN-UKRRQHHQSA-N 2 0 292.423 2.705 20 10 CFCDRP CC(C)[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652213 628049955 /nfs/dbraw/zinc/04/99/55/628049955.db2.gz ILPJDOYELJCOCU-MRXNPFEDSA-N 2 0 289.467 2.915 20 10 CFCDRP C[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737529 628061467 /nfs/dbraw/zinc/06/14/67/628061467.db2.gz OGROOFYMKKRCTP-IYBDPMFKSA-N 2 0 287.451 2.811 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000835039676 629334004 /nfs/dbraw/zinc/33/40/04/629334004.db2.gz KBKSUEGQCJUQCX-AATOQMJSSA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000835043243 629338539 /nfs/dbraw/zinc/33/85/39/629338539.db2.gz RIFWPRNOXOUVSR-PLNGDYQASA-N 2 0 285.435 2.617 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000835043454 629339837 /nfs/dbraw/zinc/33/98/37/629339837.db2.gz UMUKJBQRISRXAJ-ALCCZGGFSA-N 2 0 287.451 2.841 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000796673390 629949000 /nfs/dbraw/zinc/94/90/00/629949000.db2.gz CIOMAUFTALAOBT-RCCFBDPRSA-N 2 0 287.451 2.715 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000841007981 631304360 /nfs/dbraw/zinc/30/43/60/631304360.db2.gz VZYGNYILEDGKPF-LSDHHAIUSA-N 2 0 276.424 2.992 20 10 CFCDRP [NH3+]CCc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000841031976 631311908 /nfs/dbraw/zinc/31/19/08/631311908.db2.gz FHYQZNOHWCNOTL-UHFFFAOYSA-N 2 0 290.794 2.837 20 10 CFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841030984 631312207 /nfs/dbraw/zinc/31/22/07/631312207.db2.gz QNYJTPOSAWJIEE-RDJZCZTQSA-N 2 0 273.424 2.504 20 10 CFCDRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC000841032588 631312373 /nfs/dbraw/zinc/31/23/73/631312373.db2.gz FENZQYUDFNEWEX-GHMZBOCLSA-N 2 0 268.788 2.523 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1O ZINC000841035277 631315102 /nfs/dbraw/zinc/31/51/02/631315102.db2.gz ZLPQSOUECWEEGO-GHMZBOCLSA-N 2 0 298.814 2.532 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC000841057410 631323555 /nfs/dbraw/zinc/32/35/55/631323555.db2.gz GYLHVGCCSLSCNO-NSHDSACASA-N 2 0 268.788 2.586 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000841058073 631325710 /nfs/dbraw/zinc/32/57/10/631325710.db2.gz OZYJPDPZDPOWDJ-QGZVFWFLSA-N 2 0 287.451 2.909 20 10 CFCDRP C[C@@]1(C[NH2+]Cc2c(O)cccc2Cl)CCC[NH2+]C1 ZINC000841058382 631325910 /nfs/dbraw/zinc/32/59/10/631325910.db2.gz WUPJMGAXTZSCHJ-CQSZACIVSA-N 2 0 268.788 2.525 20 10 CFCDRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841064909 631328184 /nfs/dbraw/zinc/32/81/84/631328184.db2.gz VVFZPKXBBVJQJU-MAUKXSAKSA-N 2 0 287.451 2.765 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H](C)CCCC[NH3+])c1O ZINC000841079386 631333353 /nfs/dbraw/zinc/33/33/53/631333353.db2.gz LTVSEDBUUJIEOR-LLVKDONJSA-N 2 0 270.804 2.961 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1C ZINC000841086761 631335399 /nfs/dbraw/zinc/33/53/99/631335399.db2.gz LLVCDEGIHNYLMD-NVXWUHKLSA-N 2 0 288.435 2.973 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2C)CC[C@H]1[NH3+] ZINC000843050786 631814871 /nfs/dbraw/zinc/81/48/71/631814871.db2.gz PHHJIQJKZJFMGC-WMLDXEAASA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1O ZINC000843051431 631815567 /nfs/dbraw/zinc/81/55/67/631815567.db2.gz HNMVGJHASHZZOT-MFKMUULPSA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1[NH3+] ZINC000843051942 631816824 /nfs/dbraw/zinc/81/68/24/631816824.db2.gz MYUGFGNSRWFQJA-QAPCUYQASA-N 2 0 287.451 2.846 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000843056710 631819996 /nfs/dbraw/zinc/81/99/96/631819996.db2.gz XIJYZXQFMWYXHV-OAHLLOKOSA-N 2 0 281.419 2.697 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc1C ZINC000843059056 631821966 /nfs/dbraw/zinc/82/19/66/631821966.db2.gz DULBQMYCOMWMEP-CWRNSKLLSA-N 2 0 274.408 2.568 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843119750 631841215 /nfs/dbraw/zinc/84/12/15/631841215.db2.gz HQQBDXRSWBBPJY-UHFFFAOYSA-N 2 0 287.451 2.637 20 10 CFCDRP CCCC[N@H+](Cc1ccccc1O)C[C@]1(C)CC[NH2+]C1 ZINC000843119582 631841244 /nfs/dbraw/zinc/84/12/44/631841244.db2.gz UCHIVLVCHMMWEH-QGZVFWFLSA-N 2 0 276.424 2.994 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126310 631845243 /nfs/dbraw/zinc/84/52/43/631845243.db2.gz ISJYEKJJLHKBDN-UONOGXRCSA-N 2 0 292.398 2.743 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC000843126250 631845354 /nfs/dbraw/zinc/84/53/54/631845354.db2.gz GXYYHCUQTHSLEE-HZPDHXFCSA-N 2 0 288.435 2.912 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126354 631845703 /nfs/dbraw/zinc/84/57/03/631845703.db2.gz JOXKWGVBANQEHP-CABCVRRESA-N 2 0 274.408 2.604 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)c1 ZINC000843344041 631933608 /nfs/dbraw/zinc/93/36/08/631933608.db2.gz NITGUVLQLXUJOW-GFCCVEGCSA-N 2 0 286.375 2.710 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CC[NH2+]C1 ZINC000844220740 632136766 /nfs/dbraw/zinc/13/67/66/632136766.db2.gz MEHXYFGIXGEDOT-KRWDZBQOSA-N 2 0 287.451 2.718 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC(CC[NH3+])CC2)c(Cl)c1 ZINC000844911553 632329889 /nfs/dbraw/zinc/32/98/89/632329889.db2.gz OTKZHVUMUDRJEH-UHFFFAOYSA-N 2 0 282.815 2.915 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c(O)c1 ZINC000844903064 632331920 /nfs/dbraw/zinc/33/19/20/632331920.db2.gz ZJTIJMBESWIBFG-XJKSGUPXSA-N 2 0 292.423 2.740 20 10 CFCDRP CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(C)cc1O ZINC000844922042 632337131 /nfs/dbraw/zinc/33/71/31/632337131.db2.gz ZMEQVDSUBCZBPP-CQSZACIVSA-N 2 0 262.397 2.870 20 10 CFCDRP Cc1cccc(C[NH2+]CCC[N@@H+](C)CC(C)C)c1O ZINC000845997364 632611139 /nfs/dbraw/zinc/61/11/39/632611139.db2.gz XRSWVVQMZAQSNQ-UHFFFAOYSA-N 2 0 264.413 2.768 20 10 CFCDRP CC[C@@H](C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000817411198 632623295 /nfs/dbraw/zinc/62/32/95/632623295.db2.gz OVWSQGAGVDFTQM-OAHLLOKOSA-N 2 0 275.440 2.574 20 10 CFCDRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000846175985 632654235 /nfs/dbraw/zinc/65/42/35/632654235.db2.gz AXSGDGDUUAFTNJ-HNNXBMFYSA-N 2 0 276.424 2.947 20 10 CFCDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000817894291 632719841 /nfs/dbraw/zinc/71/98/41/632719841.db2.gz CXBXDJMTVLEJKX-ZDUSSCGKSA-N 2 0 298.434 2.766 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000817894862 632720595 /nfs/dbraw/zinc/72/05/95/632720595.db2.gz RLQVHVCOXGOTHG-CXAGYDPISA-N 2 0 275.440 2.539 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])cc1 ZINC000817896918 632720676 /nfs/dbraw/zinc/72/06/76/632720676.db2.gz ZDNVXPMSWVRUHZ-HOTGVXAUSA-N 2 0 261.413 2.502 20 10 CFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899476 632722930 /nfs/dbraw/zinc/72/29/30/632722930.db2.gz OXUTUTROLWKCMI-UONOGXRCSA-N 2 0 261.413 2.502 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2c1c(F)ccc2O ZINC000817946073 632748059 /nfs/dbraw/zinc/74/80/59/632748059.db2.gz QVWVXGJVDVXABQ-NQBHXWOUSA-N 2 0 278.371 2.669 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(O)c1C ZINC000817946180 632748211 /nfs/dbraw/zinc/74/82/11/632748211.db2.gz TYWDYWQCGMKWDC-ZIAGYGMSSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817947798 632749829 /nfs/dbraw/zinc/74/98/29/632749829.db2.gz RHLCMFPDZQGEOI-NFAWXSAZSA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817951087 632751979 /nfs/dbraw/zinc/75/19/79/632751979.db2.gz AYOVIQCNUCQJDX-NWDGAFQWSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c1O ZINC000817958933 632756983 /nfs/dbraw/zinc/75/69/83/632756983.db2.gz MZZPPRMWKKPEJQ-MFKMUULPSA-N 2 0 270.804 2.988 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCC1)c1cc2c(cc1O)CCCC2 ZINC000817965072 632764449 /nfs/dbraw/zinc/76/44/49/632764449.db2.gz OXWBAHCVQGTNQV-LBPRGKRZSA-N 2 0 274.408 2.803 20 10 CFCDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817966270 632764986 /nfs/dbraw/zinc/76/49/86/632764986.db2.gz KAEWWOOWOITZPL-NHYWBVRUSA-N 2 0 266.360 2.572 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817968493 632767341 /nfs/dbraw/zinc/76/73/41/632767341.db2.gz KFLJBRHJXIKWRF-MDZLAQPJSA-N 2 0 278.371 2.811 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000817968200 632767677 /nfs/dbraw/zinc/76/76/77/632767677.db2.gz HJZZBIGZMWKFKP-GOEBONIOSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000817970833 632770050 /nfs/dbraw/zinc/77/00/50/632770050.db2.gz FTZLZTZYPWMHGD-WFFHOREQSA-N 2 0 278.371 2.667 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cc(Cl)ccc1O ZINC000817972213 632771952 /nfs/dbraw/zinc/77/19/52/632771952.db2.gz VFAMPBNZRXEXGC-KWBADKCTSA-N 2 0 268.788 2.694 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000817972650 632772060 /nfs/dbraw/zinc/77/20/60/632772060.db2.gz ZGFOHJTYSXDXKS-XOKHGSTOSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)c2c1c(F)ccc2O ZINC000817972651 632772545 /nfs/dbraw/zinc/77/25/45/632772545.db2.gz ZGPUXVHWJDTIFZ-PRULPYPASA-N 2 0 278.371 2.810 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000817976230 632774523 /nfs/dbraw/zinc/77/45/23/632774523.db2.gz ILHDKGFVNMFOBI-QWRGUYRKSA-N 2 0 254.349 2.699 20 10 CFCDRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(N(C)C)cc1 ZINC000817977275 632774901 /nfs/dbraw/zinc/77/49/01/632774901.db2.gz FZBSWOVBEWQXKA-XJKSGUPXSA-N 2 0 263.429 2.921 20 10 CFCDRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(C)cc1O ZINC000817978170 632774928 /nfs/dbraw/zinc/77/49/28/632774928.db2.gz XUFYZVXOOIJHRV-TZMCWYRMSA-N 2 0 250.386 2.869 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000817978052 632775060 /nfs/dbraw/zinc/77/50/60/632775060.db2.gz USPSTHDDCYOXCN-ZIAGYGMSSA-N 2 0 263.429 2.921 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000817982157 632778637 /nfs/dbraw/zinc/77/86/37/632778637.db2.gz YOJKUQVEKHUVDK-CHWSQXEVSA-N 2 0 278.396 2.584 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000817982226 632778995 /nfs/dbraw/zinc/77/89/95/632778995.db2.gz PQDFLXIIGUYQQC-UMNHJUIQSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2c1c(F)ccc2O ZINC000817982465 632779006 /nfs/dbraw/zinc/77/90/06/632779006.db2.gz SQKRFEJEPPUEER-XZUYRWCXSA-N 2 0 278.371 2.797 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CCC[NH2+]C2CC2)c(O)c1 ZINC000817983386 632779662 /nfs/dbraw/zinc/77/96/62/632779662.db2.gz BPBGKDHWNNVLAC-CYBMUJFWSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N(C)C)cc1)CC[NH2+]CC2 ZINC000818431825 632843200 /nfs/dbraw/zinc/84/32/00/632843200.db2.gz URZZVYVTFZLALP-OAHLLOKOSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(N(C)C)cc1 ZINC000818617771 632880974 /nfs/dbraw/zinc/88/09/74/632880974.db2.gz JGFCLUAGXAJDSV-DAXOMENPSA-N 2 0 261.413 2.673 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000848557451 633288791 /nfs/dbraw/zinc/28/87/91/633288791.db2.gz IEBRPJWMNFZMLD-MCIONIFRSA-N 2 0 262.397 2.691 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1O ZINC000849349492 633625559 /nfs/dbraw/zinc/62/55/59/633625559.db2.gz AYJJXMAQEOPMHQ-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1 ZINC000849350539 633625930 /nfs/dbraw/zinc/62/59/30/633625930.db2.gz PSOIVKMYYIBWAZ-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP CC[C@@H](C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000850356685 633953205 /nfs/dbraw/zinc/95/32/05/633953205.db2.gz ZCDASOSFHSGOIE-MRXNPFEDSA-N 2 0 289.467 2.964 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C)(C)C3)cc2)CC1 ZINC000850415709 633982907 /nfs/dbraw/zinc/98/29/07/633982907.db2.gz PTBIWYSPTYARCK-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP c1cc(N2CCCCC2)ccc1CNCC12CC(C1)C[NH2+]2 ZINC000853247458 634950517 /nfs/dbraw/zinc/95/05/17/634950517.db2.gz QCNAJECVWDHFHM-UHFFFAOYSA-N 2 0 285.435 2.519 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)c2c1c(F)ccc2O ZINC000854224469 635262725 /nfs/dbraw/zinc/26/27/25/635262725.db2.gz XRIFTJCMELUFLD-JQWIXIFHSA-N 2 0 278.371 2.941 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@]34C[C@@H]3CCCC4)cc2)CC1 ZINC000865702926 638524281 /nfs/dbraw/zinc/52/42/81/638524281.db2.gz AJYXODVDRANMMG-HKUYNNGSSA-N 2 0 299.462 2.861 20 10 CFCDRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1O ZINC000872250792 641717666 /nfs/dbraw/zinc/71/76/66/641717666.db2.gz BRRWMJVEUYSKIG-CQSZACIVSA-N 2 0 262.397 2.568 20 10 CFCDRP COc1cccc(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1O ZINC000873223070 642076017 /nfs/dbraw/zinc/07/60/17/642076017.db2.gz HPDAEMWLKMWXRI-KRWDZBQOSA-N 2 0 292.423 2.598 20 10 CFCDRP COc1cccc(O)c1C[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000873223141 642076550 /nfs/dbraw/zinc/07/65/50/642076550.db2.gz IGBJOFGJPAOQEQ-KRWDZBQOSA-N 2 0 292.423 2.598 20 10 CFCDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000873224186 642078492 /nfs/dbraw/zinc/07/84/92/642078492.db2.gz XIQXXHDYFXCWGU-INIZCTEOSA-N 2 0 280.387 2.728 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c(O)c1 ZINC000873241452 642090857 /nfs/dbraw/zinc/09/08/57/642090857.db2.gz XBSCHRXOGUZLJO-MGPQQGTHSA-N 2 0 262.397 2.869 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873257459 642102651 /nfs/dbraw/zinc/10/26/51/642102651.db2.gz SKHFHADEKOHLPN-UMVBOHGHSA-N 2 0 261.413 2.531 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c(O)c1 ZINC000873266013 642108951 /nfs/dbraw/zinc/10/89/51/642108951.db2.gz YQXPFEUNIDWHAP-XQLPTFJDSA-N 2 0 274.408 2.882 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccccc1O ZINC000019942925 642231649 /nfs/dbraw/zinc/23/16/49/642231649.db2.gz XKYLZXUDODQBAJ-ZDUSSCGKSA-N 2 0 250.386 2.775 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000876812358 643019935 /nfs/dbraw/zinc/01/99/35/643019935.db2.gz LISHYJNQJLFFRF-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH2+]CCC[NH+]2CCC(C)CC2)c(O)c1 ZINC000876898948 643056908 /nfs/dbraw/zinc/05/69/08/643056908.db2.gz QSIAHXQIXMVFSL-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CCC[N@@H+](C)C(C)C ZINC000876917045 643064339 /nfs/dbraw/zinc/06/43/39/643064339.db2.gz MPXFSOWFNAMVGX-UHFFFAOYSA-N 2 0 250.386 2.521 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000877477381 643294416 /nfs/dbraw/zinc/29/44/16/643294416.db2.gz CCLHQOCHBKRFSC-RHSMWYFYSA-N 2 0 275.440 2.844 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000877577973 643375829 /nfs/dbraw/zinc/37/58/29/643375829.db2.gz PLSPGQVTYLUATI-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP Cc1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c(O)c1 ZINC000877585250 643379862 /nfs/dbraw/zinc/37/98/62/643379862.db2.gz QOUQMABFQLJWJO-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c(O)c1 ZINC000877585249 643379942 /nfs/dbraw/zinc/37/99/42/643379942.db2.gz QOUQMABFQLJWJO-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000877642671 643427196 /nfs/dbraw/zinc/42/71/96/643427196.db2.gz QGLZGQNTPSVXIW-UHFFFAOYSA-N 2 0 288.435 2.912 20 10 CFCDRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128332716 644641282 /nfs/dbraw/zinc/64/12/82/644641282.db2.gz CYVULEUVHOJIID-GHMZBOCLSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1nccn1CCCC[N@@H+](C)Cc1ccccc1O ZINC000128393604 644681815 /nfs/dbraw/zinc/68/18/15/644681815.db2.gz UNUSFUOUHYVPET-UHFFFAOYSA-N 2 0 273.380 2.809 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000252675272 651016108 /nfs/dbraw/zinc/01/61/08/651016108.db2.gz ZCQVVWPNYWXETH-CVEARBPZSA-N 2 0 274.408 2.720 20 10 CFCDRP Cc1coc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000886186261 646911858 /nfs/dbraw/zinc/91/18/58/646911858.db2.gz UAUWRGJEJYDJEM-UHFFFAOYSA-N 2 0 299.418 2.630 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925785900 648323313 /nfs/dbraw/zinc/32/33/13/648323313.db2.gz QEPUUSSCKHFHRQ-MCIONIFRSA-N 2 0 262.397 2.515 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000925791158 648325423 /nfs/dbraw/zinc/32/54/23/648325423.db2.gz OETNHHNGYLYGLP-YCPHGPKFSA-N 2 0 275.440 2.649 20 10 CFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@@H]2C1 ZINC001231589145 777268555 /nfs/dbraw/zinc/26/85/55/777268555.db2.gz CRZQIEWKIZUERH-IYBDPMFKSA-N 2 0 296.414 2.929 20 10 CFCDRP Oc1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167961679 777322804 /nfs/dbraw/zinc/32/28/04/777322804.db2.gz MUOBMUPMKUNIDM-ALOPSCKCSA-N 2 0 286.419 2.887 20 10 CFCDRP Oc1cccc2c1C[N@H+](Cc1cc3c[nH+]ccc3[nH]1)CC2 ZINC001232017189 777415014 /nfs/dbraw/zinc/41/50/14/777415014.db2.gz MPQKTYKJVOBKSV-UHFFFAOYSA-N 2 0 279.343 2.827 20 10 CFCDRP Cc1c(CN2CCC[C@@]23CC[NH2+]C3)c2ccccc2n1C ZINC001235110687 778383787 /nfs/dbraw/zinc/38/37/87/778383787.db2.gz LOTMXYGBISFHLC-SFHVURJKSA-N 2 0 283.419 2.815 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235265713 778439127 /nfs/dbraw/zinc/43/91/27/778439127.db2.gz DOAWWXRRGIWVEG-CZUORRHYSA-N 2 0 288.435 2.874 20 10 CFCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001235677642 778534481 /nfs/dbraw/zinc/53/44/81/778534481.db2.gz GHNRPAKFCYVTFP-GASCZTMLSA-N 2 0 288.435 2.683 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC001235941650 778619632 /nfs/dbraw/zinc/61/96/32/778619632.db2.gz WQFVPNNZNKPNNC-DZGCQCFKSA-N 2 0 288.435 2.731 20 10 CFCDRP CC[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235949449 778623966 /nfs/dbraw/zinc/62/39/66/778623966.db2.gz LELXWGVJKFHFHN-MRXNPFEDSA-N 2 0 287.451 2.718 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CC2(C1)CCCCC2 ZINC001235994725 778645127 /nfs/dbraw/zinc/64/51/27/778645127.db2.gz VWUXBYLYJUAPMC-UHFFFAOYSA-N 2 0 299.462 2.862 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CC2CCC(CC2)C1 ZINC001236089344 778686826 /nfs/dbraw/zinc/68/68/26/778686826.db2.gz QUAMQKHBEBURSV-UHFFFAOYSA-N 2 0 299.462 2.718 20 10 CFCDRP CCc1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236218365 778742964 /nfs/dbraw/zinc/74/29/64/778742964.db2.gz SOCCERXYVLTZNJ-GJZGRUSLSA-N 2 0 262.397 2.656 20 10 CFCDRP Cc1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c2ccccc2n1C ZINC001236317364 778776505 /nfs/dbraw/zinc/77/65/05/778776505.db2.gz WOQVDDBEOHOFRK-IYBDPMFKSA-N 2 0 297.446 2.918 20 10 CFCDRP Oc1ccc2ccccc2c1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321621 778779612 /nfs/dbraw/zinc/77/96/12/778779612.db2.gz JWVGFXGWCYQSJP-IYBDPMFKSA-N 2 0 296.414 2.977 20 10 CFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@@H]2C1 ZINC001236836163 778961249 /nfs/dbraw/zinc/96/12/49/778961249.db2.gz YTNZGVUSBMJJFO-ROUUACIJSA-N 2 0 296.414 2.929 20 10 CFCDRP CN1CCCc2cc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)ccc21 ZINC001237391297 779093731 /nfs/dbraw/zinc/09/37/31/779093731.db2.gz KRVRMILKNVXTQS-QZTJIDSGSA-N 2 0 299.462 2.643 20 10 CFCDRP Cc1cc(F)cc(C[NH+]2CCC(C[NH+](C)C)CC2)c1O ZINC001238062298 779242943 /nfs/dbraw/zinc/24/29/43/779242943.db2.gz OKLVUICQJWEMMT-UHFFFAOYSA-N 2 0 280.387 2.613 20 10 CFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000700798936 780721057 /nfs/dbraw/zinc/72/10/57/780721057.db2.gz DPIHWVAUVVKSEU-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1 ZINC000705991436 781151753 /nfs/dbraw/zinc/15/17/53/781151753.db2.gz RZYDWMQRJHWZSB-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000049554088 373310498 /nfs/dbraw/zinc/31/04/98/373310498.db2.gz ZNMRKVDZCLYOFO-KGLIPLIRSA-N 2 0 263.429 2.743 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000093088567 375184984 /nfs/dbraw/zinc/18/49/84/375184984.db2.gz DSFSRRGFPNDHAD-UHFFFAOYSA-N 2 0 275.440 2.526 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000093638550 375276999 /nfs/dbraw/zinc/27/69/99/375276999.db2.gz SSMFKHVUPDFOQM-CRAIPNDOSA-N 2 0 289.467 2.915 20 10 CFCDRP C[N@H+](Cc1ccc(-n2ccnc2)nc1)Cc1ccccc1O ZINC000177153946 380309896 /nfs/dbraw/zinc/30/98/96/380309896.db2.gz QWIDZDAHLWWJEH-UHFFFAOYSA-N 2 0 294.358 2.605 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC000179580847 380560606 /nfs/dbraw/zinc/56/06/06/380560606.db2.gz PDHHGBQJXGSTPV-AWEZNQCLSA-N 2 0 262.397 2.556 20 10 CFCDRP C[C@H]1CC[N@H+](Cc2cc(F)ccc2O)C[C@@H]1n1ccnc1 ZINC000180271791 380642419 /nfs/dbraw/zinc/64/24/19/380642419.db2.gz GRBNEPKIYCUAFB-WFASDCNBSA-N 2 0 289.354 2.811 20 10 CFCDRP C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3O)[C@H]2C1 ZINC000359909366 381672056 /nfs/dbraw/zinc/67/20/56/381672056.db2.gz YXXNKVGQUCWZQB-RISCZKNCSA-N 2 0 280.799 2.572 20 10 CFCDRP C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1cc(F)ccc1O ZINC000185672738 381700081 /nfs/dbraw/zinc/70/00/81/381700081.db2.gz SZWNYUYLTWINGZ-NTZNESFSSA-N 2 0 278.371 2.807 20 10 CFCDRP Cc1cccc(C[N@H+]2CCCC23CC[NH+](C)CC3)c1O ZINC000375475828 382088067 /nfs/dbraw/zinc/08/80/67/382088067.db2.gz XSUVINBCVQPUEA-UHFFFAOYSA-N 2 0 274.408 2.761 20 10 CFCDRP C[C@@H](Cn1ccnc1)[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000294140681 382431820 /nfs/dbraw/zinc/43/18/20/382431820.db2.gz HLPAIWLLMYTSCY-VIFPVBQESA-N 2 0 283.734 2.560 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000363168341 267078883 /nfs/dbraw/zinc/07/88/83/267078883.db2.gz XFOLWUCWIUHMMF-HZPDHXFCSA-N 2 0 274.408 2.725 20 10 CFCDRP CC(C)(C[NH2+]Cc1ccccc1O)C[NH+]1CCCC1 ZINC000276679717 519268303 /nfs/dbraw/zinc/26/83/03/519268303.db2.gz HJGSOHAAVVDGME-UHFFFAOYSA-N 2 0 262.397 2.604 20 10 CFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccccc3O)C2)CC1 ZINC000290301442 523785282 /nfs/dbraw/zinc/78/52/82/523785282.db2.gz BITDSIWXMJVQLN-OAHLLOKOSA-N 2 0 274.408 2.556 20 10 CFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cc(F)ccc3O)C2)CC1 ZINC000290647514 523785332 /nfs/dbraw/zinc/78/53/32/523785332.db2.gz YYGZWDKAZMGMNP-AWEZNQCLSA-N 2 0 292.398 2.695 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000290421434 525341294 /nfs/dbraw/zinc/34/12/94/525341294.db2.gz KRRKHXFLXUUZRM-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1 ZINC000290466527 525343164 /nfs/dbraw/zinc/34/31/64/525343164.db2.gz NHXURKKLUXEPNQ-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N(C)C)cc1 ZINC000037229451 525435317 /nfs/dbraw/zinc/43/53/17/525435317.db2.gz PMPKRTHGJGBEGH-OAHLLOKOSA-N 2 0 275.440 2.889 20 10 CFCDRP Oc1ccccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000292987490 526372067 /nfs/dbraw/zinc/37/20/67/526372067.db2.gz LVYCWFZXEMAWGV-UHFFFAOYSA-N 2 0 262.397 2.748 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000754794293 574120943 /nfs/dbraw/zinc/12/09/43/574120943.db2.gz IRZKPMVNGJAQEO-AEFFLSMTSA-N 2 0 287.451 2.777 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000049553586 617611036 /nfs/dbraw/zinc/61/10/36/617611036.db2.gz AJNANXQBNXZJAK-OAHLLOKOSA-N 2 0 277.456 2.963 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000894152860 618401162 /nfs/dbraw/zinc/40/11/62/618401162.db2.gz FMLHAXFXYWJZNH-UHFFFAOYSA-N 2 0 292.423 2.675 20 10 CFCDRP Oc1cccc(Cl)c1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000841072113 620804618 /nfs/dbraw/zinc/80/46/18/620804618.db2.gz HBUPMKRVNXVBAW-LLVKDONJSA-N 2 0 268.788 2.667 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1cc(Cl)ccc1O ZINC000019943086 618797645 /nfs/dbraw/zinc/79/76/45/618797645.db2.gz PPPFFWBASNLECI-UHFFFAOYSA-N 2 0 270.804 2.867 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000035628549 618834160 /nfs/dbraw/zinc/83/41/60/618834160.db2.gz ZYWPIPGEELQRCS-CYBMUJFWSA-N 2 0 264.413 2.939 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925781366 619103674 /nfs/dbraw/zinc/10/36/74/619103674.db2.gz YHCCCRBNPCLDSR-JSGCOSHPSA-N 2 0 297.393 2.648 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094616715 619132459 /nfs/dbraw/zinc/13/24/59/619132459.db2.gz AHJCAXNOEGYFMI-LBPRGKRZSA-N 2 0 268.376 2.914 20 10 CFCDRP CC[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccccc1O ZINC000925845609 619177615 /nfs/dbraw/zinc/17/76/15/619177615.db2.gz MOHUQAFKCMTVDS-USXIJHARSA-N 2 0 274.408 2.965 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1 ZINC000925876468 619196710 /nfs/dbraw/zinc/19/67/10/619196710.db2.gz ZEAREFODZGRVKR-LZWOXQAQSA-N 2 0 275.440 2.921 20 10 CFCDRP Cc1cccc(O)c1C[N@@H+](C)CC(C)(C)C[NH+](C)C ZINC000898307439 620369672 /nfs/dbraw/zinc/36/96/72/620369672.db2.gz CAQDJVIBZXKUNR-UHFFFAOYSA-N 2 0 264.413 2.720 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+](C)CC(C)(C)C[NH+](C)C)c1 ZINC000898308242 620370119 /nfs/dbraw/zinc/37/01/19/620370119.db2.gz UTZYQKILYSKDAD-UHFFFAOYSA-N 2 0 264.413 2.720 20 10 CFCDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc(N)cc1 ZINC000841038845 620379693 /nfs/dbraw/zinc/37/96/93/620379693.db2.gz RKNSVVJVMXLRGW-WMLDXEAASA-N 2 0 275.440 2.712 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Br)cc1O ZINC000902487379 621112761 /nfs/dbraw/zinc/11/27/61/621112761.db2.gz UFJOPOFUEOIFDU-QXEWZRGKSA-N 2 0 299.212 2.543 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902488771 621113217 /nfs/dbraw/zinc/11/32/17/621113217.db2.gz NTGHNBFZCUKXPI-UMVBOHGHSA-N 2 0 261.413 2.531 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000841073312 621123892 /nfs/dbraw/zinc/12/38/92/621123892.db2.gz RJZZAYDGRIFZDJ-CYBMUJFWSA-N 2 0 268.788 2.667 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC(C)(C)[NH3+])c(Cl)c1 ZINC000903940085 621481783 /nfs/dbraw/zinc/48/17/83/621481783.db2.gz VWVNLWCSQCOYQQ-UHFFFAOYSA-N 2 0 256.777 2.571 20 10 CFCDRP CCC1([NH3+])CC[NH+](Cc2ccc(N(C)C)cc2C)CC1 ZINC000903948787 621486169 /nfs/dbraw/zinc/48/61/69/621486169.db2.gz UOSVNLCXUJNNLN-UHFFFAOYSA-N 2 0 275.440 2.764 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000904301673 621568972 /nfs/dbraw/zinc/56/89/72/621568972.db2.gz OJNCLMTYOWNUBC-KRWDZBQOSA-N 2 0 275.440 2.574 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)c(Cl)c1 ZINC000904412028 621593088 /nfs/dbraw/zinc/59/30/88/621593088.db2.gz ZTWHAHXQPCFMLS-NWDGAFQWSA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1 ZINC000071409536 625515611 /nfs/dbraw/zinc/51/56/11/625515611.db2.gz DXHXXKCZQRCVEH-MRXNPFEDSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000071408265 625515651 /nfs/dbraw/zinc/51/56/51/625515651.db2.gz VFXSPFFDFOWZEO-AWEZNQCLSA-N 2 0 262.397 2.521 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000044534816 622918033 /nfs/dbraw/zinc/91/80/33/622918033.db2.gz BQGJYDUWDJBZSE-DZGCQCFKSA-N 2 0 262.397 2.775 20 10 CFCDRP CC[NH+](CC)CCC[N@H+](CC)Cc1cc(OC)ccc1O ZINC000230744963 623295586 /nfs/dbraw/zinc/29/55/86/623295586.db2.gz PISSWKTWTINSGN-UHFFFAOYSA-N 2 0 294.439 2.955 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCC1)c1cc(Cl)ccc1O ZINC000817965777 625967645 /nfs/dbraw/zinc/96/76/45/625967645.db2.gz ZXJPKCKHMAPVOC-VIFPVBQESA-N 2 0 254.761 2.578 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)[C@H](C)[NH3+])c1O ZINC000817979220 625972772 /nfs/dbraw/zinc/97/27/72/625972772.db2.gz IVAAUJNMDYEXJU-GUBZILKMSA-N 2 0 256.777 2.740 20 10 CFCDRP c1cc2c(cc1CN[C@@H]1CC[N@@H+]3CCCC[C@@H]13)CCCO2 ZINC000921539060 625980501 /nfs/dbraw/zinc/98/05/01/625980501.db2.gz SZSCZPFHOMZGAN-SJORKVTESA-N 2 0 286.419 2.728 20 10 CFCDRP c1cn2c(n1)CC[C@@H](C[NH2+]Cc1ccc3c(c1)CCCO3)C2 ZINC000922027099 626198254 /nfs/dbraw/zinc/19/82/54/626198254.db2.gz ZMYJOCIKDDQQFI-HNNXBMFYSA-N 2 0 297.402 2.560 20 10 CFCDRP Cc1cc(C[N@H+](C)C2CCC([NH3+])CC2)ccc1N(C)C ZINC000923293795 626463552 /nfs/dbraw/zinc/46/35/52/626463552.db2.gz BRLGDNXYJXEZKX-UHFFFAOYSA-N 2 0 275.440 2.763 20 10 CFCDRP CCC[N@H+](CCC[NH2+]C1CC1)Cc1ccccc1O ZINC000923310287 626465732 /nfs/dbraw/zinc/46/57/32/626465732.db2.gz DMZFVRXYAUZNMU-UHFFFAOYSA-N 2 0 262.397 2.746 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CC[C@H]1[NH3+] ZINC000843051047 626547752 /nfs/dbraw/zinc/54/77/52/626547752.db2.gz ACSWRMKLFURGEJ-BXUZGUMPSA-N 2 0 282.815 2.913 20 10 CFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@]1(C)CC[NH2+]C1 ZINC000843059948 626553085 /nfs/dbraw/zinc/55/30/85/626553085.db2.gz VYJJRDCAJZBINX-QGZVFWFLSA-N 2 0 275.440 2.574 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000757673374 626557516 /nfs/dbraw/zinc/55/75/16/626557516.db2.gz FMZBFMOUYQAMNY-HNNXBMFYSA-N 2 0 294.439 2.710 20 10 CFCDRP CCOc1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c(O)c1 ZINC000768546985 627352492 /nfs/dbraw/zinc/35/24/92/627352492.db2.gz LUXFBBCROSTZKD-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(OC)c2O)C[C@H]1C ZINC000769469696 627443877 /nfs/dbraw/zinc/44/38/77/627443877.db2.gz CSCTUTHIJHBVFN-HIFRSBDPSA-N 2 0 292.423 2.705 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCCCC3)cc2)CC1 ZINC000771823381 627634403 /nfs/dbraw/zinc/63/44/03/627634403.db2.gz MVTHKHKNURKBOG-UHFFFAOYSA-N 2 0 287.451 2.861 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccco1 ZINC000771822751 627634465 /nfs/dbraw/zinc/63/44/65/627634465.db2.gz IIWYQLSBVRTTLX-HNNXBMFYSA-N 2 0 299.418 2.882 20 10 CFCDRP CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771824957 627634541 /nfs/dbraw/zinc/63/45/41/627634541.db2.gz UFQPJBXLHOWMHF-CVEARBPZSA-N 2 0 289.467 2.963 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2O)C[C@H]1C ZINC000779027967 628346970 /nfs/dbraw/zinc/34/69/70/628346970.db2.gz UKODJLYYVSNVTF-HIFRSBDPSA-N 2 0 262.397 2.697 20 10 CFCDRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000780575619 628478824 /nfs/dbraw/zinc/47/88/24/628478824.db2.gz FSLKSLHUPKLSQE-WBVHZDCISA-N 2 0 287.451 2.717 20 10 CFCDRP COc1cccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1O ZINC000791010634 629280542 /nfs/dbraw/zinc/28/05/42/629280542.db2.gz GRNFVZWHWJAGRP-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000835036926 629331813 /nfs/dbraw/zinc/33/18/13/629331813.db2.gz RTGCTZMPTRIOPN-CWIOURORSA-N 2 0 299.462 2.840 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CCCC[N@@H+](C)C2CC2)c1 ZINC000835061543 629363012 /nfs/dbraw/zinc/36/30/12/629363012.db2.gz HZRXLHNPMLSWIH-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000040621419 649985728 /nfs/dbraw/zinc/98/57/28/649985728.db2.gz ULOIZHPMPLDUQN-AWEZNQCLSA-N 2 0 292.423 2.611 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000840910080 631261443 /nfs/dbraw/zinc/26/14/43/631261443.db2.gz KQFITPRGCLMEFI-MRXNPFEDSA-N 2 0 289.467 2.835 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000840953478 631280555 /nfs/dbraw/zinc/28/05/55/631280555.db2.gz SCMIUIWODJEVDN-MRXNPFEDSA-N 2 0 289.467 2.883 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000841027996 631309304 /nfs/dbraw/zinc/30/93/04/631309304.db2.gz IURSXYIEHZFKTH-WMLDXEAASA-N 2 0 275.440 2.668 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031503 631311725 /nfs/dbraw/zinc/31/17/25/631311725.db2.gz STZCTTLGGIFDED-RISCZKNCSA-N 2 0 282.815 2.961 20 10 CFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841031683 631312179 /nfs/dbraw/zinc/31/21/79/631312179.db2.gz VKYSBRWPFBAPEW-FUHWJXTLSA-N 2 0 287.451 2.894 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031010 631312709 /nfs/dbraw/zinc/31/27/09/631312709.db2.gz QTTQJDBQHNCAJN-GWCFXTLKSA-N 2 0 298.814 2.661 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000841056926 631324138 /nfs/dbraw/zinc/32/41/38/631324138.db2.gz JZTILQMPQQUNHS-SUZKBHRPSA-N 2 0 287.451 2.745 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000841057377 631324409 /nfs/dbraw/zinc/32/44/09/631324409.db2.gz JTYXYVZCLRQIKR-XETQRACLSA-N 2 0 273.424 2.625 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1F ZINC000841062811 631327138 /nfs/dbraw/zinc/32/71/38/631327138.db2.gz CRPOBDRTOMGBRS-BBRMVZONSA-N 2 0 293.430 2.760 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)c1O ZINC000841073409 631330502 /nfs/dbraw/zinc/33/05/02/631330502.db2.gz STOARMOQWWMATG-CYBMUJFWSA-N 2 0 298.814 2.532 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000841072574 631330677 /nfs/dbraw/zinc/33/06/77/631330677.db2.gz KVTNFSBUSLOLAT-MRXNPFEDSA-N 2 0 275.440 2.683 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000841079794 631333163 /nfs/dbraw/zinc/33/31/63/631333163.db2.gz OKTTWKIPFLTVAR-HAQNSBGRSA-N 2 0 282.815 2.900 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)CCCC[NH3+])cc1C ZINC000841079366 631333295 /nfs/dbraw/zinc/33/32/95/631333295.db2.gz KUFHBVFMBYZWPU-ZDUSSCGKSA-N 2 0 250.386 2.616 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1C ZINC000841084012 631334211 /nfs/dbraw/zinc/33/42/11/631334211.db2.gz WDLLTJGYRCIROC-SHTZXODSSA-N 2 0 276.424 2.864 20 10 CFCDRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1O ZINC000841089289 631337338 /nfs/dbraw/zinc/33/73/38/631337338.db2.gz KWPLUMXIUYUMPJ-AWEZNQCLSA-N 2 0 290.407 2.555 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c(Cl)c1 ZINC000841099667 631339335 /nfs/dbraw/zinc/33/93/35/631339335.db2.gz NCZMUEWWVZQDGE-NWDGAFQWSA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c(Cl)c1 ZINC000841099668 631340346 /nfs/dbraw/zinc/34/03/46/631340346.db2.gz NCZMUEWWVZQDGE-RYUDHWBXSA-N 2 0 282.815 2.771 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@H](C)[NH3+])cc1C ZINC000843046690 631813524 /nfs/dbraw/zinc/81/35/24/631813524.db2.gz ZEYKELVPJZMMDS-DZGCQCFKSA-N 2 0 262.397 2.711 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1O ZINC000843051429 631814814 /nfs/dbraw/zinc/81/48/14/631814814.db2.gz HNMVGJHASHZZOT-GWCFXTLKSA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1O ZINC000843057556 631819695 /nfs/dbraw/zinc/81/96/95/631819695.db2.gz KAFBJFYPCZCXCD-MNOVXSKESA-N 2 0 268.788 2.523 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000843109551 631839169 /nfs/dbraw/zinc/83/91/69/631839169.db2.gz YBNYSYJXMGCJFT-PLNGDYQASA-N 2 0 273.424 2.579 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c(Cl)c1 ZINC000843119738 631841926 /nfs/dbraw/zinc/84/19/26/631841926.db2.gz GFRWWOIWTNORCX-UHFFFAOYSA-N 2 0 294.826 2.930 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843124424 631842733 /nfs/dbraw/zinc/84/27/33/631842733.db2.gz ASFCNJXSUDLWPX-LSDHHAIUSA-N 2 0 274.408 2.522 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1 ZINC000843124568 631843155 /nfs/dbraw/zinc/84/31/55/631843155.db2.gz CDBDRGYMGJQGRL-LSDHHAIUSA-N 2 0 274.408 2.522 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126360 631845132 /nfs/dbraw/zinc/84/51/32/631845132.db2.gz JOXKWGVBANQEHP-LSDHHAIUSA-N 2 0 274.408 2.604 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000843126255 631845188 /nfs/dbraw/zinc/84/51/88/631845188.db2.gz HAFCPTHIUUOXSD-IEBWSBKVSA-N 2 0 299.462 2.861 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c(Cl)c1 ZINC000843128178 631847674 /nfs/dbraw/zinc/84/76/74/631847674.db2.gz IKZMFPQVLHTLDQ-NXEZZACHSA-N 2 0 256.777 2.569 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000843128280 631848052 /nfs/dbraw/zinc/84/80/52/631848052.db2.gz VMFJOQGIWORFOM-ZDUSSCGKSA-N 2 0 294.826 2.867 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000843128028 631848294 /nfs/dbraw/zinc/84/82/94/631848294.db2.gz VAAYYLJCXIWSFF-GEWVGOBGSA-N 2 0 299.462 2.697 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1 ZINC000815628124 632301967 /nfs/dbraw/zinc/30/19/67/632301967.db2.gz RSLLMVDAKIVUAG-OCCSQVGLSA-N 2 0 264.413 2.857 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1O ZINC000844900622 632330627 /nfs/dbraw/zinc/33/06/27/632330627.db2.gz BKQITRZWBPRRTP-SWLSCSKDSA-N 2 0 262.397 2.650 20 10 CFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c(F)c2)[C@@H]1CC[NH3+] ZINC000844900664 632330801 /nfs/dbraw/zinc/33/08/01/632330801.db2.gz CIODMKMWLINTNP-CZUORRHYSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1O ZINC000844900623 632331040 /nfs/dbraw/zinc/33/10/40/632331040.db2.gz BKQITRZWBPRRTP-WFASDCNBSA-N 2 0 262.397 2.650 20 10 CFCDRP COc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1C ZINC000844904214 632331983 /nfs/dbraw/zinc/33/19/83/632331983.db2.gz DRNMQFQWZGPFGC-UHFFFAOYSA-N 2 0 288.366 2.891 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000844921410 632336737 /nfs/dbraw/zinc/33/67/37/632336737.db2.gz IHEUXLNTHNPVTC-AWEZNQCLSA-N 2 0 275.440 2.922 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC2CC[NH2+]CC2)c1 ZINC000844923911 632338515 /nfs/dbraw/zinc/33/85/15/632338515.db2.gz IQDQEONZZFLTNW-ZDUSSCGKSA-N 2 0 262.397 2.741 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000844927022 632339426 /nfs/dbraw/zinc/33/94/26/632339426.db2.gz YPPWCTBHZJCQJT-ZDUSSCGKSA-N 2 0 270.376 2.962 20 10 CFCDRP Cc1cccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817865747 632715837 /nfs/dbraw/zinc/71/58/37/632715837.db2.gz NOBLHGCWSCOEPP-IPYPFGDCSA-N 2 0 262.397 2.506 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000817894863 632721135 /nfs/dbraw/zinc/72/11/35/632721135.db2.gz RLQVHVCOXGOTHG-DYVFJYSZSA-N 2 0 275.440 2.539 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CCCCC[C@H]3[NH3+])ccc21 ZINC000817901966 632726041 /nfs/dbraw/zinc/72/60/41/632726041.db2.gz ZZRMYXYUUSLVEB-IAGOWNOFSA-N 2 0 287.451 2.819 20 10 CFCDRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817942223 632745665 /nfs/dbraw/zinc/74/56/65/632745665.db2.gz ZGJYZGBORPTAIY-HNNXBMFYSA-N 2 0 275.440 2.937 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817943126 632746686 /nfs/dbraw/zinc/74/66/86/632746686.db2.gz IYCJXJVAYUELTE-CYBMUJFWSA-N 2 0 276.424 2.921 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817945456 632747373 /nfs/dbraw/zinc/74/73/73/632747373.db2.gz DDKDSCISMXIGOZ-HIFRSBDPSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000817946864 632748056 /nfs/dbraw/zinc/74/80/56/632748056.db2.gz GQFROLGHRNLLBH-RDBSUJKOSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC000817945704 632748433 /nfs/dbraw/zinc/74/84/33/632748433.db2.gz JZTOOASZEUJALZ-ZIAGYGMSSA-N 2 0 262.397 2.659 20 10 CFCDRP CC(C)[NH2+]CCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000817952970 632752834 /nfs/dbraw/zinc/75/28/34/632752834.db2.gz JXJVEVYCVWEHDW-LLVKDONJSA-N 2 0 254.349 2.570 20 10 CFCDRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817953138 632752949 /nfs/dbraw/zinc/75/29/49/632752949.db2.gz NNYZWHCWVFEYAQ-IUCAKERBSA-N 2 0 287.201 2.543 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c1O ZINC000817953682 632753469 /nfs/dbraw/zinc/75/34/69/632753469.db2.gz SMABDBNGOUMCBD-VHSXEESVSA-N 2 0 256.777 2.742 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)c1ccccc1O ZINC000817954282 632753836 /nfs/dbraw/zinc/75/38/36/632753836.db2.gz WZUUFXYMKUKNSK-AWEZNQCLSA-N 2 0 250.386 2.821 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817954707 632755016 /nfs/dbraw/zinc/75/50/16/632755016.db2.gz HHVVEXVUVZBUSU-MNOVXSKESA-N 2 0 268.788 2.696 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c(O)c1C ZINC000817957638 632755614 /nfs/dbraw/zinc/75/56/14/632755614.db2.gz DLGZNSKITGEOEG-JSGCOSHPSA-N 2 0 250.386 2.643 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000817956685 632755862 /nfs/dbraw/zinc/75/58/62/632755862.db2.gz AOLCCLWYVDTAGU-OKZBNKHCSA-N 2 0 287.451 2.712 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(N(C)C)cc1 ZINC000817960384 632759521 /nfs/dbraw/zinc/75/95/21/632759521.db2.gz YMNSDVULONDWRC-JKSUJKDBSA-N 2 0 263.429 2.777 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1 ZINC000817960342 632759745 /nfs/dbraw/zinc/75/97/45/632759745.db2.gz MFCUZARFODHKDE-YDHLFZDLSA-N 2 0 262.397 2.869 20 10 CFCDRP CC[C@H]([NH2+]CC1([NH3+])CCC1)c1ccc(N(C)C)cc1 ZINC000817964642 632763109 /nfs/dbraw/zinc/76/31/09/632763109.db2.gz HAHCDCVIIWGPIW-HNNXBMFYSA-N 2 0 261.413 2.675 20 10 CFCDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817966268 632765452 /nfs/dbraw/zinc/76/54/52/632765452.db2.gz KAEWWOOWOITZPL-ABAIWWIYSA-N 2 0 266.360 2.572 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1O ZINC000817968783 632767287 /nfs/dbraw/zinc/76/72/87/632767287.db2.gz MNUHHKSTJQPRNE-GFCCVEGCSA-N 2 0 268.360 2.846 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817968879 632767648 /nfs/dbraw/zinc/76/76/48/632767648.db2.gz OMQOVXDTMZQKJG-ZFWWWQNUSA-N 2 0 261.413 2.545 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(O)c1 ZINC000817970108 632768753 /nfs/dbraw/zinc/76/87/53/632768753.db2.gz LIGFPXPBXZTAIX-MJBXVCDLSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000817970531 632770162 /nfs/dbraw/zinc/77/01/62/632770162.db2.gz ZHNWGHZNDOEQIM-DLOVCJGASA-N 2 0 268.788 2.966 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c(O)c1 ZINC000817971399 632771286 /nfs/dbraw/zinc/77/12/86/632771286.db2.gz LWMWJISQEAZFSK-HZSPNIEDSA-N 2 0 262.397 2.800 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H](C)[NH3+])c1cc(Br)ccc1O ZINC000817973956 632773209 /nfs/dbraw/zinc/77/32/09/632773209.db2.gz WYQMVEMIPSGLGS-LDYMZIIASA-N 2 0 287.201 2.543 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c(O)c1 ZINC000817976579 632774468 /nfs/dbraw/zinc/77/44/68/632774468.db2.gz ODRAGNMYNQQYBT-ZFWWWQNUSA-N 2 0 274.408 2.802 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000817976536 632774474 /nfs/dbraw/zinc/77/44/74/632774474.db2.gz NDEQOKHXKJMTAC-QWHCGFSZSA-N 2 0 250.386 2.869 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cc(Cl)ccc1O ZINC000817978215 632775870 /nfs/dbraw/zinc/77/58/70/632775870.db2.gz YMUHJBLZEKHTHZ-VHSXEESVSA-N 2 0 256.777 2.824 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000817978998 632775876 /nfs/dbraw/zinc/77/58/76/632775876.db2.gz GHJJQXXGHYVDDQ-KOLCDFICSA-N 2 0 256.777 2.742 20 10 CFCDRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccc1O ZINC000817980271 632777065 /nfs/dbraw/zinc/77/70/65/632777065.db2.gz KKICVXQGCVDEPJ-HIFRSBDPSA-N 2 0 262.397 2.965 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817980856 632777733 /nfs/dbraw/zinc/77/77/33/632777733.db2.gz XQGNXGNERXCHGS-SCZZXKLOSA-N 2 0 287.201 2.543 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817981436 632778220 /nfs/dbraw/zinc/77/82/20/632778220.db2.gz JIDFYEYYPYCYCT-QRTARXTBSA-N 2 0 275.440 2.921 20 10 CFCDRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000846705040 632778532 /nfs/dbraw/zinc/77/85/32/632778532.db2.gz XLPHQVJBDCNNDR-ATQQARJTSA-N 2 0 273.424 2.577 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N(C)C)cc1 ZINC000817983589 632779492 /nfs/dbraw/zinc/77/94/92/632779492.db2.gz GURLGTDTLZOYGL-CYBMUJFWSA-N 2 0 261.413 2.545 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCC[NH2+]C2CC2)c2c1c(F)ccc2O ZINC000817983852 632779999 /nfs/dbraw/zinc/77/99/99/632779999.db2.gz JXPQYJHTUMKFGO-MFKMUULPSA-N 2 0 278.371 2.811 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(F)ccc1O ZINC000817984928 632781260 /nfs/dbraw/zinc/78/12/60/632781260.db2.gz CNKRZUPEZOLAHA-DGCLKSJQSA-N 2 0 278.371 2.857 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1C ZINC000817985848 632782381 /nfs/dbraw/zinc/78/23/81/632782381.db2.gz NJNOJDAMSAIPCD-AWEZNQCLSA-N 2 0 274.408 2.969 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1O ZINC000817987832 632782778 /nfs/dbraw/zinc/78/27/78/632782778.db2.gz YOAAWKALJHSSEG-CTASWTNQSA-N 2 0 274.408 2.821 20 10 CFCDRP CCc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c1O ZINC000848889206 633363007 /nfs/dbraw/zinc/36/30/07/633363007.db2.gz GUSDTWDOHLWOAE-DOTOQJQBSA-N 2 0 288.435 2.871 20 10 CFCDRP Oc1ccc(F)cc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849349541 633626286 /nfs/dbraw/zinc/62/62/86/633626286.db2.gz CKIKPHYZWNEDBN-CQSZACIVSA-N 2 0 292.398 2.743 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2([NH3+])CCCC2)c(O)c1 ZINC000854221931 635263164 /nfs/dbraw/zinc/26/31/64/635263164.db2.gz BATCMBNRJLTSJU-ZDUSSCGKSA-N 2 0 262.397 2.931 20 10 CFCDRP Oc1ccccc1C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873233043 642086400 /nfs/dbraw/zinc/08/64/00/642086400.db2.gz XHMSCKBEUMAGMX-INIZCTEOSA-N 2 0 274.408 2.794 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]Cc1cccc3c1CC[NH2+]C3)CC2 ZINC000873235748 642088010 /nfs/dbraw/zinc/08/80/10/642088010.db2.gz PTJWJANHSOLSMK-QGZVFWFLSA-N 2 0 294.398 2.815 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000873241820 642090590 /nfs/dbraw/zinc/09/05/90/642090590.db2.gz GFWZKIXKBSEVCZ-CHWSQXEVSA-N 2 0 292.423 2.830 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000873239900 642090747 /nfs/dbraw/zinc/09/07/47/642090747.db2.gz FYEVRGBWXKWSMI-DZKIICNBSA-N 2 0 275.440 2.921 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000873258666 642103372 /nfs/dbraw/zinc/10/33/72/642103372.db2.gz USUNGDOUESJJOV-FXPVBKGRSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c(O)c1 ZINC000873270022 642111915 /nfs/dbraw/zinc/11/19/15/642111915.db2.gz WFQZVKCUSLIJPP-OLZOCXBDSA-N 2 0 262.397 2.739 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(C)cccc2O)[C@@H](C)C1 ZINC000876763679 642999922 /nfs/dbraw/zinc/99/99/22/642999922.db2.gz LZEFUNYXDLZPAD-GOEBONIOSA-N 2 0 276.424 2.863 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C)cc2O)C1 ZINC000876771610 643004441 /nfs/dbraw/zinc/00/44/41/643004441.db2.gz VCLOWHRHOLMHLG-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2c(C)cccc2O)C1 ZINC000876775444 643006278 /nfs/dbraw/zinc/00/62/78/643006278.db2.gz WACBMQUXKYQZDR-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1cccc(O)c1C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000877479628 643297545 /nfs/dbraw/zinc/29/75/45/643297545.db2.gz XFKASLKZOKDWKX-AWEZNQCLSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)c(O)c1 ZINC000877656359 643436483 /nfs/dbraw/zinc/43/64/83/643436483.db2.gz FWZJUDOXQNCBGY-INIZCTEOSA-N 2 0 274.408 2.807 20 10 CFCDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(F)ccc1O)CC2 ZINC000877684306 643453480 /nfs/dbraw/zinc/45/34/80/643453480.db2.gz LDDHOALLYDRBQK-UHFFFAOYSA-N 2 0 292.398 2.839 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000246076504 650851684 /nfs/dbraw/zinc/85/16/84/650851684.db2.gz FLCOYASYLRYODY-BBRMVZONSA-N 2 0 293.430 2.712 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2cccc(C)c2O)CC1 ZINC000127871196 644342692 /nfs/dbraw/zinc/34/26/92/644342692.db2.gz MDDMNQHPKGNKHW-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c1O ZINC000252855365 651027483 /nfs/dbraw/zinc/02/74/83/651027483.db2.gz LIMHSQYLKMTMOT-WDEREUQCSA-N 2 0 298.814 2.613 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925785636 648323098 /nfs/dbraw/zinc/32/30/98/648323098.db2.gz OJCWYPYCBBCLOM-UHIISALHSA-N 2 0 282.815 2.942 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925785902 648323201 /nfs/dbraw/zinc/32/32/01/648323201.db2.gz QEPUUSSCKHFHRQ-RDBSUJKOSA-N 2 0 262.397 2.515 20 10 CFCDRP Nc1ccc(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001235161731 778399898 /nfs/dbraw/zinc/39/98/98/778399898.db2.gz URSXJJVDYHRUGT-KRWDZBQOSA-N 2 0 273.424 2.623 20 10 CFCDRP CCN(CC)c1ccc(CN2C[C@H]3CCC[NH2+][C@H]3C2)cc1 ZINC001235209815 778415410 /nfs/dbraw/zinc/41/54/10/778415410.db2.gz QWTCVCZWZRWBAY-AEFFLSMTSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H]1C ZINC001235695702 778540103 /nfs/dbraw/zinc/54/01/03/778540103.db2.gz ZTXLAVFZSCLFPI-HOTGVXAUSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1c(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c2ccccc2n1C ZINC001235711159 778544944 /nfs/dbraw/zinc/54/49/44/778544944.db2.gz KVMZXBSIUOHEBQ-UHFFFAOYSA-N 2 0 283.419 2.672 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c(O)c1 ZINC001235714247 778546196 /nfs/dbraw/zinc/54/61/96/778546196.db2.gz VHOQDQBDAFRWPO-UHFFFAOYSA-N 2 0 288.435 2.875 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1 ZINC001235958690 778628387 /nfs/dbraw/zinc/62/83/87/778628387.db2.gz IOROGTOMFUSAGQ-ALXJQNPVSA-N 2 0 287.451 2.702 20 10 CFCDRP CCc1cccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000700801949 780724497 /nfs/dbraw/zinc/72/44/97/780724497.db2.gz GPWNCPLCCFFFIK-AWEZNQCLSA-N 2 0 276.424 2.776 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1C ZINC000700817237 780727025 /nfs/dbraw/zinc/72/70/25/780727025.db2.gz ALHCHAPXWSFLJW-MRXNPFEDSA-N 2 0 276.424 2.825 20 10 CFCDRP C[NH+](C)CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000020091791 372229178 /nfs/dbraw/zinc/22/91/78/372229178.db2.gz NVUBYHAPHMFFQV-UHFFFAOYSA-N 2 0 275.440 2.718 20 10 CFCDRP COc1cccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1O ZINC000263650486 383685957 /nfs/dbraw/zinc/68/59/57/383685957.db2.gz DHWFHPBUWYNKFZ-UHFFFAOYSA-N 2 0 290.407 2.507 20 10 CFCDRP CCOc1cccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c1O ZINC000092253597 375098655 /nfs/dbraw/zinc/09/86/55/375098655.db2.gz RKSNWLRKSWBCID-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295986877 381198907 /nfs/dbraw/zinc/19/89/07/381198907.db2.gz NNXXPZJXEFLSAJ-AWEZNQCLSA-N 2 0 262.397 2.699 20 10 CFCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1[O-] ZINC000296625738 381477534 /nfs/dbraw/zinc/47/75/34/381477534.db2.gz XCDDNMPJFANVFK-NDNKKMJESA-N 2 0 278.371 2.807 20 10 CFCDRP C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000293734414 382256281 /nfs/dbraw/zinc/25/62/81/382256281.db2.gz QIIJEGWWDAHAHE-KGLIPLIRSA-N 2 0 263.429 2.601 20 10 CFCDRP c1cc(N2CCCCC2)ccc1CN1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000271210563 385376479 /nfs/dbraw/zinc/37/64/79/385376479.db2.gz YBNASVCNSMAVIY-PKOBYXMFSA-N 2 0 299.462 2.861 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(O)c1C ZINC000273476692 385685298 /nfs/dbraw/zinc/68/52/98/385685298.db2.gz KXSMVOPJHWMTLG-CQSZACIVSA-N 2 0 274.408 2.922 20 10 CFCDRP C[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)C[NH+]1CCCCC1 ZINC000038042069 174044138 /nfs/dbraw/zinc/04/41/38/174044138.db2.gz WXCFIVIDFDRUGD-OAHLLOKOSA-N 2 0 288.435 2.833 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000363168339 267078786 /nfs/dbraw/zinc/07/87/86/267078786.db2.gz XFOLWUCWIUHMMF-CVEARBPZSA-N 2 0 274.408 2.725 20 10 CFCDRP C[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C[NH+]1CCCC1 ZINC000296066695 279350823 /nfs/dbraw/zinc/35/08/23/279350823.db2.gz RYUFOQMRQPTBSY-UKRRQHHQSA-N 2 0 274.408 2.701 20 10 CFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(OC)ccc1O ZINC000289470456 521013229 /nfs/dbraw/zinc/01/32/29/521013229.db2.gz PLBDVRVZYAPTMJ-UHFFFAOYSA-N 2 0 292.423 2.709 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000037644484 521710687 /nfs/dbraw/zinc/71/06/87/521710687.db2.gz STCIYGMACBTKHJ-GJZGRUSLSA-N 2 0 275.440 2.745 20 10 CFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccccc3O)C2)CC1 ZINC000290301439 523785077 /nfs/dbraw/zinc/78/50/77/523785077.db2.gz BITDSIWXMJVQLN-HNNXBMFYSA-N 2 0 274.408 2.556 20 10 CFCDRP COc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1C ZINC000278465737 524069709 /nfs/dbraw/zinc/06/97/09/524069709.db2.gz GGIDSVPVGPDQMH-UHFFFAOYSA-N 2 0 288.435 2.968 20 10 CFCDRP Cc1cccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1O ZINC000290525281 524396320 /nfs/dbraw/zinc/39/63/20/524396320.db2.gz QFYFCRCDMVHHOZ-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276771943 524748799 /nfs/dbraw/zinc/74/87/99/524748799.db2.gz IDRWLCCQRYOBHB-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c1 ZINC000289821537 525339755 /nfs/dbraw/zinc/33/97/55/525339755.db2.gz TYVVENHEFUMIRC-XYPWUTKMSA-N 2 0 274.408 2.758 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1 ZINC000293613931 525730674 /nfs/dbraw/zinc/73/06/74/525730674.db2.gz JHNAXOJDXNTMSI-QWHCGFSZSA-N 2 0 250.386 2.549 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000049553585 617611251 /nfs/dbraw/zinc/61/12/51/617611251.db2.gz AJNANXQBNXZJAK-HNNXBMFYSA-N 2 0 277.456 2.963 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)c(O)c1 ZINC000044515912 618026871 /nfs/dbraw/zinc/02/68/71/618026871.db2.gz GNLLHQAMTVRABU-ZDUSSCGKSA-N 2 0 262.397 2.693 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000044533199 618026952 /nfs/dbraw/zinc/02/69/52/618026952.db2.gz GDYKDDBKSUIOHR-LSDHHAIUSA-N 2 0 275.440 2.745 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000044516314 618027323 /nfs/dbraw/zinc/02/73/23/618027323.db2.gz WPTDGWDHGLDEED-ZDUSSCGKSA-N 2 0 262.397 2.693 20 10 CFCDRP CCC[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775633805 618291853 /nfs/dbraw/zinc/29/18/53/618291853.db2.gz KUEKSWMSIBSKIU-UHFFFAOYSA-N 2 0 275.440 2.670 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C2CC[NH+](C(C)C)CC2)c1O ZINC000894162094 618405111 /nfs/dbraw/zinc/40/51/11/618405111.db2.gz XMZIXGZKJYPZJF-UHFFFAOYSA-N 2 0 292.423 2.672 20 10 CFCDRP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C12CCC2 ZINC000925542693 618902765 /nfs/dbraw/zinc/90/27/65/618902765.db2.gz IORRWGGJVAWGIZ-DLBZAZTESA-N 2 0 285.435 2.646 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c(O)c1C ZINC000925784301 619109014 /nfs/dbraw/zinc/10/90/14/619109014.db2.gz QOECSJCAZVDMIL-CHWSQXEVSA-N 2 0 298.377 2.904 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccccc1O ZINC000925787222 619112122 /nfs/dbraw/zinc/11/21/22/619112122.db2.gz ZGQUAXDETOTFFZ-DGCLKSJQSA-N 2 0 284.350 2.678 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925799468 619121091 /nfs/dbraw/zinc/12/10/91/619121091.db2.gz VCTUCYFMPGXTJG-IJLUTSLNSA-N 2 0 282.815 2.942 20 10 CFCDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cc(F)ccc1O ZINC000843340638 619210721 /nfs/dbraw/zinc/21/07/21/619210721.db2.gz CVXUBKCRYYSGOF-LLVKDONJSA-N 2 0 254.349 2.701 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2cc(C)cc(OC)c2O)CC1 ZINC000894384054 619361030 /nfs/dbraw/zinc/36/10/30/619361030.db2.gz KUOLVDFNQVAAGZ-UHFFFAOYSA-N 2 0 292.423 2.673 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)c1O ZINC000895556541 619554842 /nfs/dbraw/zinc/55/48/42/619554842.db2.gz JQMPZZUJULNKOT-OAHLLOKOSA-N 2 0 297.402 2.806 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000903874047 621462130 /nfs/dbraw/zinc/46/21/30/621462130.db2.gz REFBSMVGNCGGCO-ALOPSCKCSA-N 2 0 287.451 2.715 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000903959951 621480549 /nfs/dbraw/zinc/48/05/49/621480549.db2.gz SRVNATYJZZTGQG-GOSISDBHSA-N 2 0 287.451 2.718 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1F ZINC000903964515 621495947 /nfs/dbraw/zinc/49/59/47/621495947.db2.gz KLTQQNHXSWXRMC-HIFRSBDPSA-N 2 0 293.430 2.617 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1F ZINC000904404945 621590118 /nfs/dbraw/zinc/59/01/18/621590118.db2.gz BUYYCALVARFVTQ-AWEZNQCLSA-N 2 0 293.430 2.843 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000841084810 622201733 /nfs/dbraw/zinc/20/17/33/622201733.db2.gz PZXJRLHYYKPEML-HOTGVXAUSA-N 2 0 275.440 2.750 20 10 CFCDRP C[C@@H](C[NH2+]Cc1cc(Cl)ccc1O)C[NH+]1CCCC1 ZINC000060942122 623167359 /nfs/dbraw/zinc/16/73/59/623167359.db2.gz MVDSYCSDFZSORS-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000827843541 624108911 /nfs/dbraw/zinc/10/89/11/624108911.db2.gz FBGYGHRSPUPSNK-UHFFFAOYSA-N 2 0 292.398 2.743 20 10 CFCDRP C[N@H+](CCCC[NH2+][C@@H]1CCc2cccc(O)c21)C1CC1 ZINC000834909983 625919961 /nfs/dbraw/zinc/91/99/61/625919961.db2.gz VFEWKJKWOMWJOK-OAHLLOKOSA-N 2 0 274.408 2.844 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])c(O)c1 ZINC000817975725 625972625 /nfs/dbraw/zinc/97/26/25/625972625.db2.gz AAJBZQKTMDRKNV-CHWSQXEVSA-N 2 0 250.386 2.869 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)ccc1N(C)C ZINC000923365238 626468833 /nfs/dbraw/zinc/46/88/33/626468833.db2.gz DDYWKYBBFAOKHJ-GOSISDBHSA-N 2 0 287.451 2.637 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1F ZINC000839183146 626529957 /nfs/dbraw/zinc/52/99/57/626529957.db2.gz URTCNFANNYXUMH-AWEZNQCLSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)cc1C ZINC000843052737 626549365 /nfs/dbraw/zinc/54/93/65/626549365.db2.gz WANFKSAXZIHCAV-KGLIPLIRSA-N 2 0 262.397 2.568 20 10 CFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(C)(C)C ZINC000775660779 628051496 /nfs/dbraw/zinc/05/14/96/628051496.db2.gz YLOXPUXUUKGJHA-UHFFFAOYSA-N 2 0 289.467 2.916 20 10 CFCDRP CC1=CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775701002 628056705 /nfs/dbraw/zinc/05/67/05/628056705.db2.gz AEKLYYDAYYTVGV-UHFFFAOYSA-N 2 0 285.435 2.590 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000835035857 629327968 /nfs/dbraw/zinc/32/79/68/629327968.db2.gz MFVGSPCJJMPZEE-TUOCYHOTSA-N 2 0 299.462 2.982 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000835035853 629329276 /nfs/dbraw/zinc/32/92/76/629329276.db2.gz MFVGSPCJJMPZEE-MGDPNLISSA-N 2 0 299.462 2.982 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835038344 629332945 /nfs/dbraw/zinc/33/29/45/629332945.db2.gz WGAGWQMGEPCMJB-LQYUOIDQSA-N 2 0 275.440 2.696 20 10 CFCDRP C[C@H]([NH3+])C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000110644140 634765867 /nfs/dbraw/zinc/76/58/67/634765867.db2.gz KPRAXEQVKYPTEN-JTQLQIEISA-N 2 0 268.788 2.605 20 10 CFCDRP [NH3+]CCCCCC[NH2+]Cc1c(O)cccc1Cl ZINC000843126211 630804590 /nfs/dbraw/zinc/80/45/90/630804590.db2.gz CVBVAASYUWHROY-UHFFFAOYSA-N 2 0 256.777 2.654 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000840810365 631228132 /nfs/dbraw/zinc/22/81/32/631228132.db2.gz SOAFTDIGRQQMSZ-CHWSQXEVSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](C)CC2)c(Cl)c1 ZINC000840890572 631253321 /nfs/dbraw/zinc/25/33/21/631253321.db2.gz OMZJYPCOUDRNDT-UHFFFAOYSA-N 2 0 282.815 2.785 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(OCC)ccc1O ZINC000809756299 631283877 /nfs/dbraw/zinc/28/38/77/631283877.db2.gz NFWAJGIRLDZDMR-UHFFFAOYSA-N 2 0 294.439 2.955 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000841055722 631322480 /nfs/dbraw/zinc/32/24/80/631322480.db2.gz URKMFRQAEHIZQD-VXGBXAGGSA-N 2 0 299.212 2.514 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC23CC[NH2+]CC3)c1O ZINC000841078181 631332079 /nfs/dbraw/zinc/33/20/79/631332079.db2.gz FNXONBDOKUMUPM-ZDUSSCGKSA-N 2 0 280.799 2.586 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)ccc1O ZINC000841081195 631332763 /nfs/dbraw/zinc/33/27/63/631332763.db2.gz WCSWZPBJLXZPJC-SNVBAGLBSA-N 2 0 256.777 2.653 20 10 CFCDRP CCC[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1O ZINC000842471842 631639834 /nfs/dbraw/zinc/63/98/34/631639834.db2.gz COKPPDMLRMKFIR-CQSZACIVSA-N 2 0 262.397 2.604 20 10 CFCDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843046848 631813049 /nfs/dbraw/zinc/81/30/49/631813049.db2.gz CJESXVWMRUOGLE-KRWDZBQOSA-N 2 0 287.451 2.848 20 10 CFCDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843046850 631813845 /nfs/dbraw/zinc/81/38/45/631813845.db2.gz CJESXVWMRUOGLE-QGZVFWFLSA-N 2 0 287.451 2.848 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2c(O)cc(C)cc2Cl)CC[C@H]1[NH3+] ZINC000843050377 631814526 /nfs/dbraw/zinc/81/45/26/631814526.db2.gz FDIMQEKKKLSCJC-BXUZGUMPSA-N 2 0 282.815 2.913 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@H](C)[NH3+])CC2)cc1C ZINC000843051724 631816820 /nfs/dbraw/zinc/81/68/20/631816820.db2.gz CQKUKBVLIIFWDP-ZDUSSCGKSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1C ZINC000843111997 631838770 /nfs/dbraw/zinc/83/87/70/631838770.db2.gz BTDDNQYUCCOTSO-AWEZNQCLSA-N 2 0 262.397 2.570 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1O ZINC000843126249 631845328 /nfs/dbraw/zinc/84/53/28/631845328.db2.gz GXYYHCUQTHSLEE-HOTGVXAUSA-N 2 0 288.435 2.912 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CCCCCC[NH3+])cc1 ZINC000843129585 631849180 /nfs/dbraw/zinc/84/91/80/631849180.db2.gz PYVMDRRBJQOKHV-FPLPWBNLSA-N 2 0 275.440 2.875 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCCCC[NH3+])c1 ZINC000843342285 631932700 /nfs/dbraw/zinc/93/27/00/631932700.db2.gz PNNLISJTNDBCNQ-LBPRGKRZSA-N 2 0 266.385 2.571 20 10 CFCDRP CC[C@@H]([NH2+]CCCCCC[NH3+])c1ccccc1O ZINC000843343364 631933825 /nfs/dbraw/zinc/93/38/25/631933825.db2.gz ZTKBMWLVYWYRAO-CQSZACIVSA-N 2 0 250.386 2.952 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000813877523 631971307 /nfs/dbraw/zinc/97/13/07/631971307.db2.gz YNYQUSAXUOTKLR-WMLDXEAASA-N 2 0 277.456 2.991 20 10 CFCDRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000844924596 632338918 /nfs/dbraw/zinc/33/89/18/632338918.db2.gz YVYGUWGKZFGADS-INIZCTEOSA-N 2 0 275.440 2.922 20 10 CFCDRP C[NH+]1CCC(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816548405 632481378 /nfs/dbraw/zinc/48/13/78/632481378.db2.gz GNUXVYKQRUEZNT-UHFFFAOYSA-N 2 0 284.403 2.977 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000817416244 632626195 /nfs/dbraw/zinc/62/61/95/632626195.db2.gz UWMUADWRGOYCEN-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP CCOc1cccc(C[NH2+]C2CCC([NH+](C)C)CC2)c1O ZINC000817415994 632626590 /nfs/dbraw/zinc/62/65/90/632626590.db2.gz GLQFGCHSNDKNJT-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)c1O ZINC000846140894 632645306 /nfs/dbraw/zinc/64/53/06/632645306.db2.gz IHFIYYDYCLZNLU-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(OC)c2O)C1 ZINC000846145896 632647316 /nfs/dbraw/zinc/64/73/16/632647316.db2.gz QQCGEMCYKSEQDJ-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000817894864 632720932 /nfs/dbraw/zinc/72/09/32/632720932.db2.gz RLQVHVCOXGOTHG-GUYCJALGSA-N 2 0 275.440 2.539 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000817943410 632746408 /nfs/dbraw/zinc/74/64/08/632746408.db2.gz MZJMRHJYUDHKHN-CQSZACIVSA-N 2 0 250.386 2.741 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817945564 632747471 /nfs/dbraw/zinc/74/74/71/632747471.db2.gz GILADDOINPJGNX-MNOVXSKESA-N 2 0 268.788 2.696 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(O)c1C ZINC000817946176 632748806 /nfs/dbraw/zinc/74/88/06/632748806.db2.gz TYWDYWQCGMKWDC-KBPBESRZSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C2CCC([NH3+])CC2)c(O)c1 ZINC000817947747 632749652 /nfs/dbraw/zinc/74/96/52/632749652.db2.gz PXHZXZHOZVBHSV-HSBZDZAISA-N 2 0 262.397 2.930 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(C)cc1O ZINC000817954424 632753450 /nfs/dbraw/zinc/75/34/50/632753450.db2.gz CWJXZGNBNBBOEO-DZGCQCFKSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(O)c1C ZINC000817955087 632754471 /nfs/dbraw/zinc/75/44/71/632754471.db2.gz QCCYCGYILQJDLM-KBPBESRZSA-N 2 0 262.397 2.659 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccc(N(C)C)cc1 ZINC000817959032 632756814 /nfs/dbraw/zinc/75/68/14/632756814.db2.gz ANYFZPNDXSUDMN-QRTARXTBSA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(C)cc1O ZINC000817959185 632757068 /nfs/dbraw/zinc/75/70/68/632757068.db2.gz PZMXKUZXZYSRFK-KGLIPLIRSA-N 2 0 250.386 2.725 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817959897 632757605 /nfs/dbraw/zinc/75/76/05/632757605.db2.gz WKIXQPODQJYWED-JLLWLGSASA-N 2 0 266.360 2.653 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)[NH3+])c1ccc2ccccc2c1O ZINC000817960781 632759273 /nfs/dbraw/zinc/75/92/73/632759273.db2.gz PQVIAOAMRKEYPZ-LLVKDONJSA-N 2 0 258.365 2.933 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(N2CCCCC2)cc1 ZINC000817962387 632761662 /nfs/dbraw/zinc/76/16/62/632761662.db2.gz KXIUMXFZAFVEKV-LSDHHAIUSA-N 2 0 275.440 2.922 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c1O ZINC000817963333 632762193 /nfs/dbraw/zinc/76/21/93/632762193.db2.gz UGUZFDMRRLWSPN-SCZZXKLOSA-N 2 0 256.777 2.599 20 10 CFCDRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817963951 632762628 /nfs/dbraw/zinc/76/26/28/632762628.db2.gz ZCFXWHNHVMTNHR-RYUDHWBXSA-N 2 0 258.365 2.791 20 10 CFCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000817964907 632762843 /nfs/dbraw/zinc/76/28/43/632762843.db2.gz JCOPWBLRTACKTE-SFHVURJKSA-N 2 0 296.414 2.875 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c(O)c1 ZINC000817964630 632762880 /nfs/dbraw/zinc/76/28/80/632762880.db2.gz GMUUYMBMMKKHGF-CYBMUJFWSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(N(C)C)cc1 ZINC000817965724 632763796 /nfs/dbraw/zinc/76/37/96/632763796.db2.gz UMXWUEYGWCFZQP-JKSUJKDBSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000817972415 632771987 /nfs/dbraw/zinc/77/19/87/632771987.db2.gz XATXSYMXMCAXDM-GDZNZVCISA-N 2 0 288.435 2.920 20 10 CFCDRP CC[C@H]([NH2+]C[C@H](C)[NH3+])c1cc(Br)ccc1O ZINC000817973955 632773054 /nfs/dbraw/zinc/77/30/54/632773054.db2.gz WYQMVEMIPSGLGS-KWQFWETISA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976729 632774396 /nfs/dbraw/zinc/77/43/96/632774396.db2.gz SJKBPJYHPMRINI-XJKSGUPXSA-N 2 0 273.424 2.545 20 10 CFCDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N(C)C)cc1 ZINC000817979334 632775840 /nfs/dbraw/zinc/77/58/40/632775840.db2.gz AGUSNYLHAYYUAP-GDBMZVCRSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(F)ccc1O ZINC000817979800 632777130 /nfs/dbraw/zinc/77/71/30/632777130.db2.gz FJTGEEQQVAKXQX-YPMHNXCESA-N 2 0 266.360 2.714 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c(O)c1C ZINC000817981963 632779000 /nfs/dbraw/zinc/77/90/00/632779000.db2.gz OVRHPVUGSRKDCA-IHRRRGAJSA-N 2 0 262.397 2.787 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c(O)c1 ZINC000817981951 632779017 /nfs/dbraw/zinc/77/90/17/632779017.db2.gz OSXZRVOLFLRNRN-MJBXVCDLSA-N 2 0 262.397 2.787 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CCC[NH2+]C2CC2)c(O)c1 ZINC000817983387 632780395 /nfs/dbraw/zinc/78/03/95/632780395.db2.gz BPBGKDHWNNVLAC-ZDUSSCGKSA-N 2 0 262.397 2.802 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[NH2+]C2CC2)c(O)c1C ZINC000817984670 632781112 /nfs/dbraw/zinc/78/11/12/632781112.db2.gz XFHPHRFGNCJIDU-ZDUSSCGKSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000817986584 632781826 /nfs/dbraw/zinc/78/18/26/632781826.db2.gz RWSZHGUGGOYNMX-QMCVQRASSA-N 2 0 287.451 2.791 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1O ZINC000817987831 632782241 /nfs/dbraw/zinc/78/22/41/632782241.db2.gz YOAAWKALJHSSEG-AYDFFVQHSA-N 2 0 274.408 2.821 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(N(C)C)cc1 ZINC000818617769 632881145 /nfs/dbraw/zinc/88/11/45/632881145.db2.gz JGFCLUAGXAJDSV-APHBMKBZSA-N 2 0 261.413 2.673 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1ccccc1O ZINC000854230280 635266173 /nfs/dbraw/zinc/26/61/73/635266173.db2.gz LPJOGNOJHQFJTE-ZIAGYGMSSA-N 2 0 250.386 2.806 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000854230746 635267073 /nfs/dbraw/zinc/26/70/73/635267073.db2.gz XOICMUNZSJYOCM-XJKSGUPXSA-N 2 0 263.429 2.777 20 10 CFCDRP [NH3+][C@H](CC[NH2+][C@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000873235430 642088544 /nfs/dbraw/zinc/08/85/44/642088544.db2.gz OLQGPBRREXDWBF-SJORKVTESA-N 2 0 296.414 2.929 20 10 CFCDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1O ZINC000873237724 642089364 /nfs/dbraw/zinc/08/93/64/642089364.db2.gz PNNNVESBGPYQGM-ZDUSSCGKSA-N 2 0 282.387 2.889 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000873244812 642093340 /nfs/dbraw/zinc/09/33/40/642093340.db2.gz OFWIEXRHICUQOC-KGLIPLIRSA-N 2 0 274.408 2.747 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N(C)C)cc1 ZINC000873260333 642105423 /nfs/dbraw/zinc/10/54/23/642105423.db2.gz YPUKPJVLURWNAR-TXCZRRACSA-N 2 0 287.451 2.934 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1O ZINC000873262677 642106574 /nfs/dbraw/zinc/10/65/74/642106574.db2.gz BFLGBTDRJMFCFL-YIYPIFLZSA-N 2 0 260.381 2.573 20 10 CFCDRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(F)ccc1O ZINC000873268440 642111142 /nfs/dbraw/zinc/11/11/42/642111142.db2.gz DHLFTXSZCYFJSZ-GHMZBOCLSA-N 2 0 266.360 2.570 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c(O)c1 ZINC000873272666 642113266 /nfs/dbraw/zinc/11/32/66/642113266.db2.gz WFQZVKCUSLIJPP-STQMWFEESA-N 2 0 262.397 2.739 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccccc1O ZINC000019905766 642195965 /nfs/dbraw/zinc/19/59/65/642195965.db2.gz KUJQIVXKBTXHHN-GFCCVEGCSA-N 2 0 250.386 2.631 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000020189675 642317033 /nfs/dbraw/zinc/31/70/33/642317033.db2.gz GSOOLJXOLHGHLN-CYBMUJFWSA-N 2 0 262.397 2.917 20 10 CFCDRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(O)c1 ZINC000876761058 642998594 /nfs/dbraw/zinc/99/85/94/642998594.db2.gz YAXFKARYFIRUGV-HNNXBMFYSA-N 2 0 274.408 2.618 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(C)cc2O)CC1 ZINC000877143198 643176198 /nfs/dbraw/zinc/17/61/98/643176198.db2.gz HQJWOUFZEFBLET-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000877481426 643298391 /nfs/dbraw/zinc/29/83/91/643298391.db2.gz HDNDAIPOGKPUDE-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128333113 644640952 /nfs/dbraw/zinc/64/09/52/644640952.db2.gz CYVULEUVHOJIID-MNOVXSKESA-N 2 0 268.788 2.605 20 10 CFCDRP C=C/C=C\CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883260572 645704323 /nfs/dbraw/zinc/70/43/23/645704323.db2.gz ZKTTZHGHXYVPHF-PLNGDYQASA-N 2 0 285.435 2.660 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1c([O-])cccc1F ZINC000886641201 647083278 /nfs/dbraw/zinc/08/32/78/647083278.db2.gz CHTSVACWMJNVAQ-CHWSQXEVSA-N 2 0 280.387 2.914 20 10 CFCDRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000925803137 648328369 /nfs/dbraw/zinc/32/83/69/648328369.db2.gz MLDUEIDUWBMOGT-IIAWOOMASA-N 2 0 276.424 2.987 20 10 CFCDRP C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235821043 778567575 /nfs/dbraw/zinc/56/75/75/778567575.db2.gz XTYCBTOLVFMALW-JKSUJKDBSA-N 2 0 287.451 2.717 20 10 CFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3c(O)ccc4ccccc43)C[C@@H]2C1 ZINC001231589143 777268506 /nfs/dbraw/zinc/26/85/06/777268506.db2.gz CRZQIEWKIZUERH-HOTGVXAUSA-N 2 0 296.414 2.929 20 10 CFCDRP Oc1ccc(F)cc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235229523 778422983 /nfs/dbraw/zinc/42/29/83/778422983.db2.gz QCANLOKJWYZPMB-INIZCTEOSA-N 2 0 292.398 2.885 20 10 CFCDRP Nc1ccc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235240333 778427688 /nfs/dbraw/zinc/42/76/88/778427688.db2.gz MDRSXZHMZPWOHW-KRWDZBQOSA-N 2 0 273.424 2.623 20 10 CFCDRP CCN(CC)c1ccc(C[NH+]2CCC[NH2+]CCC2)cc1 ZINC001236240651 778750089 /nfs/dbraw/zinc/75/00/89/778750089.db2.gz RQCJMLYAOFRCIK-UHFFFAOYSA-N 2 0 275.440 2.718 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)c2ccccc21 ZINC001236412994 778807780 /nfs/dbraw/zinc/80/77/80/778807780.db2.gz MLKZVPVJHWCVNH-DZFIZOCASA-N 2 0 295.430 2.555 20 10 CFCDRP CC(C)C[N@H+](Cc1ccc(N)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551881 778875259 /nfs/dbraw/zinc/87/52/59/778875259.db2.gz NIUKMSVKZUZCJZ-QAQDUYKDSA-N 2 0 275.440 2.997 20 10 CFCDRP CCc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)c(O)c1 ZINC001236790822 778937709 /nfs/dbraw/zinc/93/77/09/778937709.db2.gz YEQIVJODDSNHPB-UHFFFAOYSA-N 2 0 276.424 2.728 20 10 CFCDRP CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236836196 778960836 /nfs/dbraw/zinc/96/08/36/778960836.db2.gz SSDADYNNNAAWON-QGZVFWFLSA-N 2 0 289.467 2.883 20 10 CFCDRP CC(C)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236933447 778982846 /nfs/dbraw/zinc/98/28/46/778982846.db2.gz XRNOXMIHAPLRNC-UHFFFAOYSA-N 2 0 293.430 2.665 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237405482 779099151 /nfs/dbraw/zinc/09/91/51/779099151.db2.gz QTADSORATFSDOU-BXUZGUMPSA-N 2 0 280.799 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c(O)c1 ZINC001205109685 779233479 /nfs/dbraw/zinc/23/34/79/779233479.db2.gz JHRONVNCEPTQGS-HNNXBMFYSA-N 2 0 291.439 2.552 20 10 CFCDRP CCc1cccc(C[N@H+](CC)CCC[NH+](C)C)c1O ZINC000709353406 781309668 /nfs/dbraw/zinc/30/96/68/781309668.db2.gz NSDAUMBVFNJXIP-UHFFFAOYSA-N 2 0 264.413 2.728 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000179578206 380560805 /nfs/dbraw/zinc/56/08/05/380560805.db2.gz RZUHZXVIYGDUDT-MRXNPFEDSA-N 2 0 274.408 2.843 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2O)C1 ZINC000179581514 380561119 /nfs/dbraw/zinc/56/11/19/380561119.db2.gz IFLKZXPRZDEVII-AWEZNQCLSA-N 2 0 262.397 2.556 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(C)c2O)C1 ZINC000180523998 380670359 /nfs/dbraw/zinc/67/03/59/380670359.db2.gz KOXKBQKXLFDVCA-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(OC)ccc2O)C1 ZINC000180524184 380671550 /nfs/dbraw/zinc/67/15/50/380671550.db2.gz NMFFDGSRCZBOHE-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(C)c2O)[C@H](C)C1 ZINC000180415414 380655541 /nfs/dbraw/zinc/65/55/41/380655541.db2.gz OAEDDICGDOKFFR-GDBMZVCRSA-N 2 0 276.424 2.863 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000296418799 381387453 /nfs/dbraw/zinc/38/74/53/381387453.db2.gz LJAATQSKKKXVQE-INIZCTEOSA-N 2 0 286.419 2.844 20 10 CFCDRP CN(C)c1ccc(C[N@H+](CCn2ccnc2)C2CC2)cc1 ZINC000270697723 385194994 /nfs/dbraw/zinc/19/49/94/385194994.db2.gz ZNHHBBGRIKQKKP-UHFFFAOYSA-N 2 0 284.407 2.614 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(O)c1 ZINC000285396352 385555341 /nfs/dbraw/zinc/55/53/41/385555341.db2.gz WZMMSXBDTBGOKB-AWEZNQCLSA-N 2 0 274.408 2.922 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH2+]CCC[NH+]1CCCC1 ZINC000020129072 171016465 /nfs/dbraw/zinc/01/64/65/171016465.db2.gz FWHLHMUAVZLSDB-UHFFFAOYSA-N 2 0 268.788 2.621 20 10 CFCDRP C[C@@H](C[NH2+]Cc1ccccc1O)C[NH+]1CCCCC1 ZINC000038041662 174043282 /nfs/dbraw/zinc/04/32/82/174043282.db2.gz SDQBRNMWWKZHCP-AWEZNQCLSA-N 2 0 262.397 2.604 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c1 ZINC000038041892 174044422 /nfs/dbraw/zinc/04/44/22/174044422.db2.gz KKTOONPXOURIPU-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)ccc2O)C1 ZINC000367709621 267112290 /nfs/dbraw/zinc/11/22/90/267112290.db2.gz XFKLNTHCHSLZDN-WFASDCNBSA-N 2 0 294.826 2.962 20 10 CFCDRP COc1cccc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1O ZINC000019913060 278011932 /nfs/dbraw/zinc/01/19/32/278011932.db2.gz WJYCUJVYHJFZNZ-AWEZNQCLSA-N 2 0 292.423 2.755 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC[N@@H+]1C ZINC000090720469 278027078 /nfs/dbraw/zinc/02/70/78/278027078.db2.gz OVFPYUOOXPRFKQ-NVXWUHKLSA-N 2 0 287.451 2.859 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(F)ccc2O)C1 ZINC000245916303 521717913 /nfs/dbraw/zinc/71/79/13/521717913.db2.gz YKSOLVQLMLLCKU-VXGBXAGGSA-N 2 0 266.360 2.524 20 10 CFCDRP CC[C@@H]([NH2+]CCC[N@H+](C)CCOC)c1ccc(C)cc1O ZINC000280065953 522826219 /nfs/dbraw/zinc/82/62/19/522826219.db2.gz KSGYNSDWXGCKQI-MRXNPFEDSA-N 2 0 294.439 2.710 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649234 522855812 /nfs/dbraw/zinc/85/58/12/522855812.db2.gz JRAAACJKTCWZNW-XJKSGUPXSA-N 2 0 274.408 2.917 20 10 CFCDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc(F)ccc1O ZINC000094616881 525335348 /nfs/dbraw/zinc/33/53/48/525335348.db2.gz JBKFAMFGUBDRIT-LBPRGKRZSA-N 2 0 266.360 2.668 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649020 525365458 /nfs/dbraw/zinc/36/54/58/525365458.db2.gz UQVBBUDVRYXAIR-KBPBESRZSA-N 2 0 274.408 2.836 20 10 CFCDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000230672036 525420017 /nfs/dbraw/zinc/42/00/17/525420017.db2.gz NPXPDFVSRYSINU-GFCCVEGCSA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000754794294 574120799 /nfs/dbraw/zinc/12/07/99/574120799.db2.gz IRZKPMVNGJAQEO-WMZOPIPTSA-N 2 0 287.451 2.777 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756788153 574262758 /nfs/dbraw/zinc/26/27/58/574262758.db2.gz BGHQHXMMTUQKHR-SMDDNHRTSA-N 2 0 290.382 2.931 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccccc1O ZINC000743870106 574374938 /nfs/dbraw/zinc/37/49/38/574374938.db2.gz HFLHRLSNVWXGBZ-UHFFFAOYSA-N 2 0 250.386 2.556 20 10 CFCDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000051694158 618049323 /nfs/dbraw/zinc/04/93/23/618049323.db2.gz RAXBAHJZTUFPLM-LRVUVFPRSA-N 2 0 261.413 2.673 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000895391771 618564382 /nfs/dbraw/zinc/56/43/82/618564382.db2.gz DWCLIOXURKNFJV-AWEZNQCLSA-N 2 0 292.423 2.531 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(O)c1C ZINC000925783818 619108578 /nfs/dbraw/zinc/10/85/78/619108578.db2.gz HFUGRHWBKLENHR-BNOWGMLFSA-N 2 0 262.397 2.515 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(O)c1C ZINC000925783823 619108636 /nfs/dbraw/zinc/10/86/36/619108636.db2.gz HFUGRHWBKLENHR-XBFCOCLRSA-N 2 0 262.397 2.515 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1C ZINC000925784302 619109081 /nfs/dbraw/zinc/10/90/81/619109081.db2.gz QOECSJCAZVDMIL-OLZOCXBDSA-N 2 0 298.377 2.904 20 10 CFCDRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c1O ZINC000894315014 619329706 /nfs/dbraw/zinc/32/97/06/619329706.db2.gz ANZRDQGJDZEMFY-GJZGRUSLSA-N 2 0 292.423 2.672 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894385254 619362191 /nfs/dbraw/zinc/36/21/91/619362191.db2.gz UGJJNSRCGZLLFD-UHFFFAOYSA-N 2 0 280.412 2.531 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000894984273 619522716 /nfs/dbraw/zinc/52/27/16/619522716.db2.gz KNFLEYKLUHJKBK-AWEZNQCLSA-N 2 0 292.423 2.531 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000322956137 620395211 /nfs/dbraw/zinc/39/52/11/620395211.db2.gz UPRZFCBAAPEBEI-RLAWYHOSSA-N 2 0 290.407 2.677 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000904359014 621582141 /nfs/dbraw/zinc/58/21/41/621582141.db2.gz VZODRFOWFGRDST-INIZCTEOSA-N 2 0 286.419 2.776 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000841084811 622201577 /nfs/dbraw/zinc/20/15/77/622201577.db2.gz PZXJRLHYYKPEML-HZPDHXFCSA-N 2 0 275.440 2.750 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000044533400 622918118 /nfs/dbraw/zinc/91/81/18/622918118.db2.gz LSKKBZANAMIRDA-KGLIPLIRSA-N 2 0 262.397 2.693 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@H]21 ZINC000228533542 623147886 /nfs/dbraw/zinc/14/78/86/623147886.db2.gz HIHLERHUJXRTGC-JTNHKYCSSA-N 2 0 280.799 2.605 20 10 CFCDRP CC[NH+](CC)CCC[N@H+](CC)Cc1ccccc1O ZINC000230744959 623296277 /nfs/dbraw/zinc/29/62/77/623296277.db2.gz DJMRWFBRTCUSRT-UHFFFAOYSA-N 2 0 264.413 2.946 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CCCN1C)c1ccc(N(C)C)cc1 ZINC000154578473 624396709 /nfs/dbraw/zinc/39/67/09/624396709.db2.gz NFZWZTVKJYAHDU-SJORKVTESA-N 2 0 275.440 2.888 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1ccc(C)cc1O ZINC000083383764 625839181 /nfs/dbraw/zinc/83/91/81/625839181.db2.gz UUAPPCDUULNMOQ-UHFFFAOYSA-N 2 0 250.386 2.522 20 10 CFCDRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccccc1O ZINC000834910442 625919893 /nfs/dbraw/zinc/91/98/93/625919893.db2.gz TWCJKXCYPFHDOO-ZDUSSCGKSA-N 2 0 262.397 2.917 20 10 CFCDRP c1cc2c(cc1C[NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000921546504 625981819 /nfs/dbraw/zinc/98/18/19/625981819.db2.gz DYYJPFDZKBVRGU-SJORKVTESA-N 2 0 286.419 2.728 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1C ZINC000839183505 626530066 /nfs/dbraw/zinc/53/00/66/626530066.db2.gz XLHXTUYFFIYLTA-HNNXBMFYSA-N 2 0 276.424 2.831 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(OC)c2O)C[C@@H]1C ZINC000769469695 627444169 /nfs/dbraw/zinc/44/41/69/627444169.db2.gz CSCTUTHIJHBVFN-DZGCQCFKSA-N 2 0 292.423 2.705 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C4CC4)C3)cc2)CC1 ZINC000775725690 628059322 /nfs/dbraw/zinc/05/93/22/628059322.db2.gz LMYGZWQVMDUDDX-SFHVURJKSA-N 2 0 299.462 2.670 20 10 CFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC000775736229 628061254 /nfs/dbraw/zinc/06/12/54/628061254.db2.gz AFZMBUUUNPUJMA-HZPDHXFCSA-N 2 0 287.451 2.669 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000788732261 629095468 /nfs/dbraw/zinc/09/54/68/629095468.db2.gz ILCWMCKJZAEKCW-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835035829 629328635 /nfs/dbraw/zinc/32/86/35/629328635.db2.gz MFLPELNTDZZRBI-FUTAKVPZSA-N 2 0 287.451 2.697 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000835036928 629332382 /nfs/dbraw/zinc/33/23/82/629332382.db2.gz RTGCTZMPTRIOPN-LIMHQNJXSA-N 2 0 299.462 2.840 20 10 CFCDRP CCOc1ccc(C[N@H+](C)CCC[NH+]2CCCC2)c(O)c1 ZINC000798958401 630263984 /nfs/dbraw/zinc/26/39/84/630263984.db2.gz XJRBTXKIJIXFHG-UHFFFAOYSA-N 2 0 292.423 2.709 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1F ZINC000841030654 631310690 /nfs/dbraw/zinc/31/06/90/631310690.db2.gz OBSWAOZPZJOLJM-GOEBONIOSA-N 2 0 293.430 2.889 20 10 CFCDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841029593 631310704 /nfs/dbraw/zinc/31/07/04/631310704.db2.gz ILBKPIAXMXRZDA-GXFFZTMASA-N 2 0 268.788 2.653 20 10 CFCDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841029051 631310892 /nfs/dbraw/zinc/31/08/92/631310892.db2.gz DYVIWDHBUUOAFE-WMZOPIPTSA-N 2 0 287.451 2.894 20 10 CFCDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841029596 631310992 /nfs/dbraw/zinc/31/09/92/631310992.db2.gz ILBKPIAXMXRZDA-MFKMUULPSA-N 2 0 268.788 2.653 20 10 CFCDRP COc1cccc(O)c1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000841030315 631311114 /nfs/dbraw/zinc/31/11/14/631311114.db2.gz WOFNFFQTWCSISJ-GFCCVEGCSA-N 2 0 286.375 2.710 20 10 CFCDRP COc1cccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1O ZINC000841028754 631311306 /nfs/dbraw/zinc/31/13/06/631311306.db2.gz ICJMXGJXTYXORN-LBPRGKRZSA-N 2 0 286.375 2.710 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000841030850 631311886 /nfs/dbraw/zinc/31/18/86/631311886.db2.gz MDBJQIUKOWGJBL-UHFFFAOYSA-N 2 0 286.803 2.661 20 10 CFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000841036644 631315199 /nfs/dbraw/zinc/31/51/99/631315199.db2.gz RGTOBIKWRGYMOZ-UHFFFAOYSA-N 2 0 283.419 2.544 20 10 CFCDRP CCOc1cccc(C[NH2+]CC2([NH3+])CCCCC2)c1O ZINC000841039278 631316626 /nfs/dbraw/zinc/31/66/26/631316626.db2.gz HYZQRXCOWSGNMD-UHFFFAOYSA-N 2 0 278.396 2.542 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CC2([NH3+])CCCCCC2)c1 ZINC000841043813 631318951 /nfs/dbraw/zinc/31/89/51/631318951.db2.gz VKDLRASGNORGNO-UHFFFAOYSA-N 2 0 278.396 2.542 20 10 CFCDRP Cc1cccc(C[NH2+]CC2([NH3+])CCCCCC2)c1O ZINC000841042021 631319549 /nfs/dbraw/zinc/31/95/49/631319549.db2.gz CYTVOQMPEAPHOQ-UHFFFAOYSA-N 2 0 262.397 2.842 20 10 CFCDRP CC1(C[NH2+]Cc2cc(Cl)ccc2O)CC[NH2+]CC1 ZINC000841057552 631323622 /nfs/dbraw/zinc/32/36/22/631323622.db2.gz PHMYEGRXNMBVAJ-UHFFFAOYSA-N 2 0 268.788 2.525 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000841073383 631331274 /nfs/dbraw/zinc/33/12/74/631331274.db2.gz SHFGXCKKKPZKTG-SVEBXFOSSA-N 2 0 287.451 2.888 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1F ZINC000841084190 631333958 /nfs/dbraw/zinc/33/39/58/631333958.db2.gz WYYUNLUHEUOMME-HDJSIYSDSA-N 2 0 293.430 2.746 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1C ZINC000841086762 631334920 /nfs/dbraw/zinc/33/49/20/631334920.db2.gz LLVCDEGIHNYLMD-RDJZCZTQSA-N 2 0 288.435 2.973 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000841088456 631337171 /nfs/dbraw/zinc/33/71/71/631337171.db2.gz WTOIHSSESMPRSD-SJLPKXTDSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[NH2+]C2CC2)c(Cl)c1 ZINC000841091380 631338631 /nfs/dbraw/zinc/33/86/31/631338631.db2.gz WNDLOVDFEVJFQJ-UHFFFAOYSA-N 2 0 268.788 2.586 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c(Cl)c1 ZINC000843051746 631815963 /nfs/dbraw/zinc/81/59/63/631815963.db2.gz KYXWOAGJQFFOIB-NEPJUHHUSA-N 2 0 282.815 2.913 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2ccc(N(C)C)cc2C)CC1 ZINC000843056362 631819890 /nfs/dbraw/zinc/81/98/90/631819890.db2.gz ZKYRDMVTSDJZNK-UHFFFAOYSA-N 2 0 289.467 2.883 20 10 CFCDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000843056709 631820037 /nfs/dbraw/zinc/82/00/37/631820037.db2.gz XIJYZXQFMWYXHV-HNNXBMFYSA-N 2 0 281.419 2.697 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+](C)CC(C)(C)C[NH3+])c1O ZINC000843056583 631820296 /nfs/dbraw/zinc/82/02/96/631820296.db2.gz RDDUVAVOKLNIPG-UHFFFAOYSA-N 2 0 270.804 2.771 20 10 CFCDRP CCOc1ccc(C[N@H+](C)CC[C@H]([NH3+])C(C)C)c(O)c1 ZINC000843056457 631820664 /nfs/dbraw/zinc/82/06/64/631820664.db2.gz KPAWATWUKJTYJR-HNNXBMFYSA-N 2 0 280.412 2.596 20 10 CFCDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843116703 631839553 /nfs/dbraw/zinc/83/95/53/631839553.db2.gz LOVSVKACULAZMI-SFHVURJKSA-N 2 0 287.451 2.848 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC000843119674 631841998 /nfs/dbraw/zinc/84/19/98/631841998.db2.gz BGXBRKIILVNAAT-ONEGZZNKSA-N 2 0 299.462 2.841 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])cc1F ZINC000843122451 631842345 /nfs/dbraw/zinc/84/23/45/631842345.db2.gz CRZLCWVXGJJWRD-AWEZNQCLSA-N 2 0 279.403 2.595 20 10 CFCDRP COc1cccc(O)c1C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000843123491 631843169 /nfs/dbraw/zinc/84/31/69/631843169.db2.gz KTONMKXHOLQUSI-UHFFFAOYSA-N 2 0 292.423 2.742 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843126763 631846668 /nfs/dbraw/zinc/84/66/68/631846668.db2.gz MRAQHEGMOJGERP-JKSUJKDBSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1O ZINC000843130165 631849253 /nfs/dbraw/zinc/84/92/53/631849253.db2.gz ZBLYNDSPCRLOME-ZJUUUORDSA-N 2 0 256.777 2.569 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000843342173 631932104 /nfs/dbraw/zinc/93/21/04/631932104.db2.gz KPLMITKWSHBGOX-BRWVUGGUSA-N 2 0 287.451 2.539 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cccc(C)c1O ZINC000844905389 632332250 /nfs/dbraw/zinc/33/22/50/632332250.db2.gz YWIJXWHOAPBNLL-UHFFFAOYSA-N 2 0 270.376 2.710 20 10 CFCDRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cc(Cl)ccc1O ZINC000844924299 632338894 /nfs/dbraw/zinc/33/88/94/632338894.db2.gz XUEFRMWVMCBHGC-SNVBAGLBSA-N 2 0 268.788 2.825 20 10 CFCDRP CC(C)C[N@H+](C)CCCNCc1ccc2c(c1)CCO2 ZINC000845996226 632610230 /nfs/dbraw/zinc/61/02/30/632610230.db2.gz MOXHBFGVDCMOOX-UHFFFAOYSA-N 2 0 276.424 2.689 20 10 CFCDRP CCOc1ccc(C[NH2+]CCC[N@H+](C)CC(C)C)c(O)c1 ZINC000845997144 632610864 /nfs/dbraw/zinc/61/08/64/632610864.db2.gz VIJFEXBULRWAHS-UHFFFAOYSA-N 2 0 294.439 2.858 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC4(CCC4)C3)cc2)CC1 ZINC000846107310 632632750 /nfs/dbraw/zinc/63/27/50/632632750.db2.gz RRQOZKHXODTKOW-UHFFFAOYSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1C[NH3+] ZINC000817865079 632714784 /nfs/dbraw/zinc/71/47/84/632714784.db2.gz GDBXZSGDYUKIRL-VNHYZAJKSA-N 2 0 293.430 2.697 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])cc1 ZINC000817896919 632720941 /nfs/dbraw/zinc/72/09/41/632720941.db2.gz ZDNVXPMSWVRUHZ-HZPDHXFCSA-N 2 0 261.413 2.502 20 10 CFCDRP [NH3+]CC1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000817898594 632723567 /nfs/dbraw/zinc/72/35/67/632723567.db2.gz JQTSGWFSUYEHJN-UHFFFAOYSA-N 2 0 287.451 2.894 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@H]3CCCC[C@H]3C[NH3+])ccc21 ZINC000817901444 632725357 /nfs/dbraw/zinc/72/53/57/632725357.db2.gz VSERDAHWTFXVNB-IRXDYDNUSA-N 2 0 287.451 2.676 20 10 CFCDRP c1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc2c1OCC2 ZINC000817902376 632725878 /nfs/dbraw/zinc/72/58/78/632725878.db2.gz OYVWILSOAGTAMQ-GVDBMIGSSA-N 2 0 286.419 2.632 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1C[NH2+]C1 ZINC000817902023 632725945 /nfs/dbraw/zinc/72/59/45/632725945.db2.gz GVKIMTNVCAFDOD-HNNXBMFYSA-N 2 0 287.451 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1F ZINC000817903722 632726908 /nfs/dbraw/zinc/72/69/08/632726908.db2.gz TVQOMIPYBKHMQT-CHWSQXEVSA-N 2 0 281.419 2.887 20 10 CFCDRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cc2c(cc1O)CCCC2 ZINC000817940538 632743592 /nfs/dbraw/zinc/74/35/92/632743592.db2.gz IYLIVCCPMHOXBU-CYBMUJFWSA-N 2 0 288.435 2.921 20 10 CFCDRP C[NH2+]CCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817942218 632745420 /nfs/dbraw/zinc/74/54/20/632745420.db2.gz YRWBENPBJVOKMS-LBPRGKRZSA-N 2 0 262.397 2.531 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)cc1 ZINC000817941912 632745436 /nfs/dbraw/zinc/74/54/36/632745436.db2.gz TYTVJVVUAPJZRV-AWEZNQCLSA-N 2 0 275.440 2.793 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2CC[NH2+]CC2)c(O)c1 ZINC000817941259 632745680 /nfs/dbraw/zinc/74/56/80/632745680.db2.gz OVPCTJVCXUGXME-ZDUSSCGKSA-N 2 0 262.397 2.659 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC000817946634 632748336 /nfs/dbraw/zinc/74/83/36/632748336.db2.gz BZLJGOPPPSVIRI-HZSPNIEDSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC000817946636 632748514 /nfs/dbraw/zinc/74/85/14/632748514.db2.gz BZLJGOPPPSVIRI-MELADBBJSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000817946861 632748728 /nfs/dbraw/zinc/74/87/28/632748728.db2.gz GQFROLGHRNLLBH-HZSPNIEDSA-N 2 0 262.397 2.739 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@H]1CCC[NH2+]C1 ZINC000817946823 632748765 /nfs/dbraw/zinc/74/87/65/632748765.db2.gz FNHNFXGVZIHLFE-WOPDTQHZSA-N 2 0 266.360 2.570 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[NH2+]C(C)C)c1 ZINC000817952524 632752881 /nfs/dbraw/zinc/75/28/81/632752881.db2.gz FSBQXOFTAUABRA-CYBMUJFWSA-N 2 0 250.386 2.739 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c(O)c1C ZINC000817957640 632755831 /nfs/dbraw/zinc/75/58/31/632755831.db2.gz DLGZNSKITGEOEG-OCCSQVGLSA-N 2 0 250.386 2.643 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817959711 632757789 /nfs/dbraw/zinc/75/77/89/632757789.db2.gz UFRGYOTYQKWZDF-WBMJQRKESA-N 2 0 276.424 2.905 20 10 CFCDRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000817959896 632758111 /nfs/dbraw/zinc/75/81/11/632758111.db2.gz WKIXQPODQJYWED-ADEWGFFLSA-N 2 0 266.360 2.653 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000817960681 632759539 /nfs/dbraw/zinc/75/95/39/632759539.db2.gz PKWVMBWGVUMOJG-ZOWXZIJZSA-N 2 0 278.396 2.569 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc2ccccc2c1O ZINC000817966010 632763757 /nfs/dbraw/zinc/76/37/57/632763757.db2.gz ZBJJOGOXHVLYCF-BZNIZROVSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(F)ccc1O ZINC000817965064 632764163 /nfs/dbraw/zinc/76/41/63/632764163.db2.gz ORSSPOCUECKFEK-LLVKDONJSA-N 2 0 266.360 2.572 20 10 CFCDRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccccc1O ZINC000817966762 632766664 /nfs/dbraw/zinc/76/66/64/632766664.db2.gz VDHSRELNTHKTKQ-GOEBONIOSA-N 2 0 262.397 2.823 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(O)c1C ZINC000817967711 632766729 /nfs/dbraw/zinc/76/67/29/632766729.db2.gz BFXSEXHKEFWADB-ZIAGYGMSSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817968876 632767493 /nfs/dbraw/zinc/76/74/93/632767493.db2.gz OMQOVXDTMZQKJG-DZGCQCFKSA-N 2 0 261.413 2.545 20 10 CFCDRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968146 632767704 /nfs/dbraw/zinc/76/77/04/632767704.db2.gz QBARPNTYSYTOJH-SNVBAGLBSA-N 2 0 266.772 2.616 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(C)cc1O ZINC000817969616 632768631 /nfs/dbraw/zinc/76/86/31/632768631.db2.gz FBUBCXWKAJCWDU-QEJZJMRPSA-N 2 0 262.397 2.739 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(C)cc1O ZINC000817969615 632768899 /nfs/dbraw/zinc/76/88/99/632768899.db2.gz FBUBCXWKAJCWDU-AEGPPILISA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)c(O)c1 ZINC000817970282 632768940 /nfs/dbraw/zinc/76/89/40/632768940.db2.gz QMNBDHCDUDQSLO-RDBSUJKOSA-N 2 0 262.397 2.658 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C)c2c1c(F)ccc2O ZINC000817970832 632769373 /nfs/dbraw/zinc/76/93/73/632769373.db2.gz FTZLZTZYPWMHGD-URBCHYCLSA-N 2 0 278.371 2.667 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1O ZINC000817977063 632775380 /nfs/dbraw/zinc/77/53/80/632775380.db2.gz ZXCPDHIVAWLFGC-QMTHXVAHSA-N 2 0 280.799 2.838 20 10 CFCDRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000846698422 632777621 /nfs/dbraw/zinc/77/76/21/632777621.db2.gz GYWQLBUPYXWEGD-DOTOQJQBSA-N 2 0 287.451 2.989 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c(O)c1C ZINC000817981964 632779154 /nfs/dbraw/zinc/77/91/54/632779154.db2.gz OVRHPVUGSRKDCA-MELADBBJSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(F)ccc1O ZINC000817984927 632781166 /nfs/dbraw/zinc/78/11/66/632781166.db2.gz CNKRZUPEZOLAHA-AAEUAGOBSA-N 2 0 278.371 2.857 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000817985057 632781713 /nfs/dbraw/zinc/78/17/13/632781713.db2.gz GCOHKIHMFRIREP-UONOGXRCSA-N 2 0 272.392 2.644 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000817986585 632782190 /nfs/dbraw/zinc/78/21/90/632782190.db2.gz RWSZHGUGGOYNMX-QSPRXWTASA-N 2 0 287.451 2.791 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000817987136 632782294 /nfs/dbraw/zinc/78/22/94/632782294.db2.gz WOOUPFUVMYNYDU-QWHCGFSZSA-N 2 0 290.407 2.726 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1O ZINC000848559508 633289350 /nfs/dbraw/zinc/28/93/50/633289350.db2.gz XSKRVVLMEDRKRX-GUTXKFCHSA-N 2 0 262.397 2.773 20 10 CFCDRP CCc1cccc(C[N@H+](C)CCCn2ccnc2)c1O ZINC000848911998 633397127 /nfs/dbraw/zinc/39/71/27/633397127.db2.gz LYAMUJUAWKIYHK-UHFFFAOYSA-N 2 0 273.380 2.673 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350819 633625916 /nfs/dbraw/zinc/62/59/16/633625916.db2.gz XKUJCEHRTINAAS-CQSZACIVSA-N 2 0 292.398 2.743 20 10 CFCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000850382354 633968853 /nfs/dbraw/zinc/96/88/53/633968853.db2.gz STGOWAZCWJXFOX-GOSISDBHSA-N 2 0 287.451 2.717 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000854230281 635267161 /nfs/dbraw/zinc/26/71/61/635267161.db2.gz LSAPYXYIRKHLPK-GXFFZTMASA-N 2 0 254.349 2.555 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000858491317 636270238 /nfs/dbraw/zinc/27/02/38/636270238.db2.gz FDWWDIXEOATVQN-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(O)c(C[N@H+](C)CCCCCC[NH3+])cc1C ZINC000873231867 642085210 /nfs/dbraw/zinc/08/52/10/642085210.db2.gz XARLORAPTISTRS-UHFFFAOYSA-N 2 0 264.413 2.960 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873254403 642100010 /nfs/dbraw/zinc/10/00/10/642100010.db2.gz SKHFHADEKOHLPN-KCQAQPDRSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000873254954 642101031 /nfs/dbraw/zinc/10/10/31/642101031.db2.gz CCRWPUZTDDECGH-FXPVBKGRSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000873263139 642106525 /nfs/dbraw/zinc/10/65/25/642106525.db2.gz GOMQJAOXTIINIQ-APIJFGDWSA-N 2 0 274.408 2.882 20 10 CFCDRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000873264294 642108465 /nfs/dbraw/zinc/10/84/65/642108465.db2.gz CZKORHLMLSGMLW-ZIAGYGMSSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccccc1O ZINC000019905767 642196227 /nfs/dbraw/zinc/19/62/27/642196227.db2.gz KUJQIVXKBTXHHN-LBPRGKRZSA-N 2 0 250.386 2.631 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000020189673 642316469 /nfs/dbraw/zinc/31/64/69/642316469.db2.gz GSOOLJXOLHGHLN-ZDUSSCGKSA-N 2 0 262.397 2.917 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c(O)c1 ZINC000876782124 643007778 /nfs/dbraw/zinc/00/77/78/643007778.db2.gz OXMSSLZOVVNXAJ-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(O)c1 ZINC000876813884 643022451 /nfs/dbraw/zinc/02/24/51/643022451.db2.gz YBIDGHCJUCYTHS-ZBFHGGJFSA-N 2 0 274.408 2.617 20 10 CFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C)cc2O)C1 ZINC000876988103 643094508 /nfs/dbraw/zinc/09/45/08/643094508.db2.gz VBHLWFMOGAXEBQ-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)c(O)c1 ZINC000877596644 643389130 /nfs/dbraw/zinc/38/91/30/643389130.db2.gz VLZDLQRQUMNUFS-UHFFFAOYSA-N 2 0 262.397 2.663 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccccc1O ZINC000879648860 644362591 /nfs/dbraw/zinc/36/25/91/644362591.db2.gz FFZRURXFBKSCDH-ZIAGYGMSSA-N 2 0 262.397 2.917 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128332931 644640773 /nfs/dbraw/zinc/64/07/73/644640773.db2.gz CYVULEUVHOJIID-QWRGUYRKSA-N 2 0 268.788 2.605 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@H]1[NH3+] ZINC000252507181 651009405 /nfs/dbraw/zinc/00/94/05/651009405.db2.gz ZOCTVEPQTDJNGK-GXFFZTMASA-N 2 0 268.788 2.605 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000925783096 648322244 /nfs/dbraw/zinc/32/22/44/648322244.db2.gz BYVDMDYJCDCENC-VNHYZAJKSA-N 2 0 262.397 2.597 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c1 ZINC000925847630 648343760 /nfs/dbraw/zinc/34/37/60/648343760.db2.gz XMSUMXNYRVGWGV-KBRIMQKVSA-N 2 0 274.408 2.883 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000925882082 648354463 /nfs/dbraw/zinc/35/44/63/648354463.db2.gz JIHLFQYOZSUMCM-FOGDFJRCSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](C)C1 ZINC001235821041 778567380 /nfs/dbraw/zinc/56/73/80/778567380.db2.gz XTYCBTOLVFMALW-HOTGVXAUSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2O)CC[NH2+]1 ZINC001210495713 770296678 /nfs/dbraw/zinc/29/66/78/770296678.db2.gz ASPYHTKNVHXGBK-CYBMUJFWSA-N 2 0 276.424 2.874 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(N(C)C)cc1 ZINC000693914756 775250397 /nfs/dbraw/zinc/25/03/97/775250397.db2.gz CXXJBTOBTFROTL-WMLDXEAASA-N 2 0 275.440 2.888 20 10 CFCDRP CCOc1cccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000397296867 776285326 /nfs/dbraw/zinc/28/53/26/776285326.db2.gz DVTOUOCQHWUBHI-GUTXKFCHSA-N 2 0 292.423 2.596 20 10 CFCDRP Cc1c(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)c2ccccc2n1C ZINC001235018879 778356364 /nfs/dbraw/zinc/35/63/64/778356364.db2.gz XDFSQTPEHSBNDQ-WMLDXEAASA-N 2 0 283.419 2.671 20 10 CFCDRP CCc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236218364 778742817 /nfs/dbraw/zinc/74/28/17/778742817.db2.gz SOCCERXYVLTZNJ-CABCVRRESA-N 2 0 262.397 2.656 20 10 CFCDRP Oc1ccc(Cl)cc1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383089 779087162 /nfs/dbraw/zinc/08/71/62/779087162.db2.gz OCZFZUAQWWFZGR-BXUZGUMPSA-N 2 0 280.799 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205094784 779169147 /nfs/dbraw/zinc/16/91/47/779169147.db2.gz PLHKQYQWAUZBFV-MRXNPFEDSA-N 2 0 275.440 2.846 20 10 CFCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000700798775 780720944 /nfs/dbraw/zinc/72/09/44/780720944.db2.gz BYHJYUQNPCMUKS-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000700798777 780721936 /nfs/dbraw/zinc/72/19/36/780721936.db2.gz BYHJYUQNPCMUKS-LBPRGKRZSA-N 2 0 282.815 2.867 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(C)cc2O)C1 ZINC000037644185 372681822 /nfs/dbraw/zinc/68/18/22/372681822.db2.gz CWFPHBPKDKSFLN-UONOGXRCSA-N 2 0 262.397 2.693 20 10 CFCDRP CC1CC[NH+](CCC[NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000020146210 171032747 /nfs/dbraw/zinc/03/27/47/171032747.db2.gz BPFOTTWPGSASNV-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@@H]4[C@H]3C2)c1 ZINC000367472957 267092746 /nfs/dbraw/zinc/09/27/46/267092746.db2.gz ZMSJWIIGEUWNSA-IXDOHACOSA-N 2 0 286.419 2.617 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423088946 330169112 /nfs/dbraw/zinc/16/91/12/330169112.db2.gz TXQWQDDFYTUEKP-CZUORRHYSA-N 2 0 285.435 2.964 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccccc1O ZINC000228789904 519617185 /nfs/dbraw/zinc/61/71/85/519617185.db2.gz MHLPGPTYPJCGIC-ZDUSSCGKSA-N 2 0 250.386 2.773 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](CC)c1ccccc1O ZINC000156291163 520292777 /nfs/dbraw/zinc/29/27/77/520292777.db2.gz NODQQYWVZOGZEE-HOCLYGCPSA-N 2 0 294.439 2.790 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC000277595498 521143264 /nfs/dbraw/zinc/14/32/64/521143264.db2.gz VHKIFCWVIKNOOA-OAHLLOKOSA-N 2 0 292.423 2.707 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](CC)CCC[NH+](C)C)c1 ZINC000289396024 521144663 /nfs/dbraw/zinc/14/46/63/521144663.db2.gz FSCNKBWMIHWSAC-UHFFFAOYSA-N 2 0 280.412 2.565 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000360253575 521154439 /nfs/dbraw/zinc/15/44/39/521154439.db2.gz IUIQFVFCURVCNF-HUUCEWRRSA-N 2 0 290.407 2.507 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](CC)CC1 ZINC000278120198 521697144 /nfs/dbraw/zinc/69/71/44/521697144.db2.gz AXQDCULGGKWQJV-UHFFFAOYSA-N 2 0 275.440 2.846 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000037644483 521717971 /nfs/dbraw/zinc/71/79/71/521717971.db2.gz STCIYGMACBTKHJ-LSDHHAIUSA-N 2 0 275.440 2.745 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000173363243 521721149 /nfs/dbraw/zinc/72/11/49/521721149.db2.gz MOYFMZYVSNBCSG-PBHICJAKSA-N 2 0 275.440 2.573 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1 ZINC000062077815 524767852 /nfs/dbraw/zinc/76/78/52/524767852.db2.gz WCSMEJYHCCYKHA-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000036908286 524911237 /nfs/dbraw/zinc/91/12/37/524911237.db2.gz NIVRSMKUZWETNK-KEYYUXOJSA-N 2 0 275.440 2.571 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1C ZINC000277413081 525315111 /nfs/dbraw/zinc/31/51/11/525315111.db2.gz IOGDMYBCWPCSHO-MRXNPFEDSA-N 2 0 276.424 2.925 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1 ZINC000264999339 525344989 /nfs/dbraw/zinc/34/49/89/525344989.db2.gz ZCOKCIRBQRGKER-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000088163926 525345571 /nfs/dbraw/zinc/34/55/71/525345571.db2.gz WVRPRBDUPQUATH-MQVJKMGUSA-N 2 0 274.408 2.806 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(F)ccc1O ZINC000094617611 525416340 /nfs/dbraw/zinc/41/63/40/525416340.db2.gz ABRPQGHDDUTMEP-NWDGAFQWSA-N 2 0 278.371 2.666 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1O ZINC000157344606 525619813 /nfs/dbraw/zinc/61/98/13/525619813.db2.gz VTXBHWDOLNNYHU-MELADBBJSA-N 2 0 260.381 2.670 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c(O)c1 ZINC000037649052 525924408 /nfs/dbraw/zinc/92/44/08/525924408.db2.gz IAACUQGPBGHZGM-UONOGXRCSA-N 2 0 274.408 2.836 20 10 CFCDRP c1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc2c1OCC2 ZINC000278488890 526427246 /nfs/dbraw/zinc/42/72/46/526427246.db2.gz KYMXLXGRJRHSQU-UHFFFAOYSA-N 2 0 286.419 2.586 20 10 CFCDRP C[N@@H+](Cc1c(O)ccc2ccncc21)CC1CC[NH+](C)CC1 ZINC000728905155 574135613 /nfs/dbraw/zinc/13/56/13/574135613.db2.gz AYIDLXASEPZBRC-UHFFFAOYSA-N 2 0 299.418 2.714 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000725849441 574330180 /nfs/dbraw/zinc/33/01/80/574330180.db2.gz NMEKFXLOMUREJD-AWEZNQCLSA-N 2 0 292.423 2.611 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CCC[N@H+](C)C(C)C)c1O ZINC000894164620 618409181 /nfs/dbraw/zinc/40/91/81/618409181.db2.gz FGQSMSZBADHSKA-UHFFFAOYSA-N 2 0 280.412 2.529 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000840914983 618461007 /nfs/dbraw/zinc/46/10/07/618461007.db2.gz XWSAHVXWWARIER-UHFFFAOYSA-N 2 0 289.467 2.835 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1ccc(N(C)C)cc1 ZINC000013734521 618844690 /nfs/dbraw/zinc/84/46/90/618844690.db2.gz AOHPSDPZILMKKG-UHFFFAOYSA-N 2 0 263.429 2.574 20 10 CFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000106869065 619124460 /nfs/dbraw/zinc/12/44/60/619124460.db2.gz ZCQVVWPNYWXETH-HZPDHXFCSA-N 2 0 274.408 2.720 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000925876722 619197144 /nfs/dbraw/zinc/19/71/44/619197144.db2.gz GJFWGRJKQWFWPJ-NFAWXSAZSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000925876721 619197229 /nfs/dbraw/zinc/19/72/29/619197229.db2.gz GJFWGRJKQWFWPJ-GUTXKFCHSA-N 2 0 261.413 2.531 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000894764958 619462123 /nfs/dbraw/zinc/46/21/23/619462123.db2.gz DMACKPHSDRLEJE-AWEZNQCLSA-N 2 0 292.423 2.529 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)c1 ZINC000895557426 619554709 /nfs/dbraw/zinc/55/47/09/619554709.db2.gz PRJSYSSDOZWNHJ-OAHLLOKOSA-N 2 0 297.402 2.806 20 10 CFCDRP Cc1cccc(C[N@@H+](C)CC(C)(C)C[NH+](C)C)c1O ZINC000898308074 620370126 /nfs/dbraw/zinc/37/01/26/620370126.db2.gz NCBZUKCTKPBUCJ-UHFFFAOYSA-N 2 0 264.413 2.720 20 10 CFCDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000841058667 620423216 /nfs/dbraw/zinc/42/32/16/620423216.db2.gz VBHWYNHQYKTRSB-DTWKUNHWSA-N 2 0 272.751 2.544 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c(Cl)c1 ZINC000904406221 621590786 /nfs/dbraw/zinc/59/07/86/621590786.db2.gz UWHGQQJHHHKXGK-LLVKDONJSA-N 2 0 268.788 2.525 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000044534820 622918303 /nfs/dbraw/zinc/91/83/03/622918303.db2.gz BQGJYDUWDJBZSE-UKRRQHHQSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@H]([NH2+]CCCCn1ccnc1)c1ccccc1O ZINC000045105515 622964782 /nfs/dbraw/zinc/96/47/82/622964782.db2.gz YVEVFZNBQKBBQX-ZDUSSCGKSA-N 2 0 259.353 2.720 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c1O ZINC000229103824 623183027 /nfs/dbraw/zinc/18/30/27/623183027.db2.gz LIMHSQYLKMTMOT-GHMZBOCLSA-N 2 0 298.814 2.613 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@@H]21 ZINC000230125636 623257355 /nfs/dbraw/zinc/25/73/55/623257355.db2.gz HIHLERHUJXRTGC-UHIISALHSA-N 2 0 280.799 2.605 20 10 CFCDRP Cc1cc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)ccc1N1CCCCC1 ZINC000827458225 624008053 /nfs/dbraw/zinc/00/80/53/624008053.db2.gz UOZXLZBHWAGSPY-QZTJIDSGSA-N 2 0 299.462 2.637 20 10 CFCDRP CCC[NH+]1CCC([N@H+](C)Cc2cc(OC)ccc2O)CC1 ZINC000179797847 624977752 /nfs/dbraw/zinc/97/77/52/624977752.db2.gz JACDTIMZIPMHLF-UHFFFAOYSA-N 2 0 292.423 2.707 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921581146 625990993 /nfs/dbraw/zinc/99/09/93/625990993.db2.gz HVGLTFMLZBODIO-INIZCTEOSA-N 2 0 288.435 2.833 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)CC[N@@H+]1C ZINC000921779661 626120170 /nfs/dbraw/zinc/12/01/70/626120170.db2.gz KTPFLKPUSZWPFV-BBRMVZONSA-N 2 0 274.408 2.584 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)c1 ZINC000775368767 628016384 /nfs/dbraw/zinc/01/63/84/628016384.db2.gz FBSYIOGEEWDBPA-ZIAGYGMSSA-N 2 0 292.423 2.926 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C3CC3)cc2)CC1 ZINC000775677163 628054048 /nfs/dbraw/zinc/05/40/48/628054048.db2.gz IGHSBWJPMDUVPN-LJQANCHMSA-N 2 0 299.462 2.813 20 10 CFCDRP CN(C)c1ccc(/C=C\CN(C)CCC[NH+](C)C)cc1 ZINC000835052103 629352682 /nfs/dbraw/zinc/35/26/82/629352682.db2.gz AVSFNXLGWXJYBN-VURMDHGXSA-N 2 0 275.440 2.649 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000840941823 631273922 /nfs/dbraw/zinc/27/39/22/631273922.db2.gz MYLOKVZFOZBOCV-QGZVFWFLSA-N 2 0 289.467 2.977 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000841029475 631310982 /nfs/dbraw/zinc/31/09/82/631310982.db2.gz HQPMZNCLXABYCQ-NVXWUHKLSA-N 2 0 275.440 2.750 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000841031580 631312155 /nfs/dbraw/zinc/31/21/55/631312155.db2.gz WURIDKVHBCUAQB-UHFFFAOYSA-N 2 0 270.804 2.961 20 10 CFCDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000841072344 631330299 /nfs/dbraw/zinc/33/02/99/631330299.db2.gz IVKHNYJRKUQRSS-CYBMUJFWSA-N 2 0 268.788 2.523 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000841089389 631337480 /nfs/dbraw/zinc/33/74/80/631337480.db2.gz MKIRGWFOKWVLAL-AWEZNQCLSA-N 2 0 290.407 2.555 20 10 CFCDRP C[NH2+]CCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000841105078 631341665 /nfs/dbraw/zinc/34/16/65/631341665.db2.gz YXBXFIPGNLMIHD-UHFFFAOYSA-N 2 0 275.440 2.718 20 10 CFCDRP CC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000155295030 650016611 /nfs/dbraw/zinc/01/66/11/650016611.db2.gz CIMIFMMGWQLHER-CQSZACIVSA-N 2 0 293.430 2.856 20 10 CFCDRP CCC[N@H+](Cc1cc(OCC)ccc1O)C1CC[NH2+]CC1 ZINC000843045627 631813406 /nfs/dbraw/zinc/81/34/06/631813406.db2.gz YGYYMEUFLDWFNS-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1C ZINC000843046098 631814243 /nfs/dbraw/zinc/81/42/43/631814243.db2.gz NKAAMGLMVMGFEI-KRWDZBQOSA-N 2 0 288.435 2.973 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1O ZINC000843051432 631815260 /nfs/dbraw/zinc/81/52/60/631815260.db2.gz HNMVGJHASHZZOT-ZWNOBZJWSA-N 2 0 268.788 2.523 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1F ZINC000843057085 631819673 /nfs/dbraw/zinc/81/96/73/631819673.db2.gz GAPDYGNNZQGMAU-ZFWWWQNUSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c(Cl)c1 ZINC000843057364 631820641 /nfs/dbraw/zinc/82/06/41/631820641.db2.gz JOENMUUXKJLNOY-MNOVXSKESA-N 2 0 268.788 2.523 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c(Cl)c1 ZINC000843057363 631820725 /nfs/dbraw/zinc/82/07/25/631820725.db2.gz JOENMUUXKJLNOY-GHMZBOCLSA-N 2 0 268.788 2.523 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000843059408 631821867 /nfs/dbraw/zinc/82/18/67/631821867.db2.gz LGVFLEBTCKDJTN-CGTJXYLNSA-N 2 0 287.451 2.702 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])cc1F ZINC000843122453 631840952 /nfs/dbraw/zinc/84/09/52/631840952.db2.gz CRZLCWVXGJJWRD-CQSZACIVSA-N 2 0 279.403 2.595 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000843122786 631843260 /nfs/dbraw/zinc/84/32/60/631843260.db2.gz FCPKSQGKCRLFFX-GOSISDBHSA-N 2 0 287.451 2.637 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000843126256 631844708 /nfs/dbraw/zinc/84/47/08/631844708.db2.gz HAFCPTHIUUOXSD-MJGOQNOKSA-N 2 0 299.462 2.861 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126356 631844785 /nfs/dbraw/zinc/84/47/85/631844785.db2.gz JOXKWGVBANQEHP-GJZGRUSLSA-N 2 0 274.408 2.604 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)c1 ZINC000843344042 631933867 /nfs/dbraw/zinc/93/38/67/631933867.db2.gz NITGUVLQLXUJOW-LBPRGKRZSA-N 2 0 286.375 2.710 20 10 CFCDRP C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000813877317 631971276 /nfs/dbraw/zinc/97/12/76/631971276.db2.gz RPVITWCJTXQAFZ-QWRGUYRKSA-N 2 0 270.804 2.894 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CC[NH2+]C1 ZINC000844220741 632136270 /nfs/dbraw/zinc/13/62/70/632136270.db2.gz MEHXYFGIXGEDOT-QGZVFWFLSA-N 2 0 287.451 2.718 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1O ZINC000844902615 632331288 /nfs/dbraw/zinc/33/12/88/632331288.db2.gz SZZMHPNAEFXQCJ-BBRMVZONSA-N 2 0 294.826 2.915 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000844925797 632338447 /nfs/dbraw/zinc/33/84/47/632338447.db2.gz UXKXCNDBQUBEEO-MRXNPFEDSA-N 2 0 282.387 2.889 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccccc1O ZINC000844924326 632338862 /nfs/dbraw/zinc/33/88/62/632338862.db2.gz ONYIIQNHRSZSFQ-LLVKDONJSA-N 2 0 274.339 2.841 20 10 CFCDRP CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccccc1O ZINC000844926932 632339507 /nfs/dbraw/zinc/33/95/07/632339507.db2.gz WSGVEIBLIXWMKA-OAHLLOKOSA-N 2 0 262.397 2.823 20 10 CFCDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000844927503 632339816 /nfs/dbraw/zinc/33/98/16/632339816.db2.gz PCFFJSGIQBTISS-AWEZNQCLSA-N 2 0 275.440 2.793 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000846139477 632643727 /nfs/dbraw/zinc/64/37/27/632643727.db2.gz NVNVXWSZMQHTGX-STQMWFEESA-N 2 0 290.407 2.536 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1O ZINC000846162872 632651128 /nfs/dbraw/zinc/65/11/28/632651128.db2.gz JJFQUUCDZYLHOM-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000846168272 632651654 /nfs/dbraw/zinc/65/16/54/632651654.db2.gz JAKCENNMEIJHAS-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)cc1C ZINC000817866337 632715144 /nfs/dbraw/zinc/71/51/44/632715144.db2.gz YSGYWFRXIMGSQX-YCPHGPKFSA-N 2 0 276.424 2.814 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])cc1 ZINC000817896920 632720711 /nfs/dbraw/zinc/72/07/11/632720711.db2.gz ZDNVXPMSWVRUHZ-JKSUJKDBSA-N 2 0 261.413 2.502 20 10 CFCDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000817896993 632720982 /nfs/dbraw/zinc/72/09/82/632720982.db2.gz BBBLMARVXDHCMJ-HUUCEWRRSA-N 2 0 275.440 2.892 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901498 632725254 /nfs/dbraw/zinc/72/52/54/632725254.db2.gz WMHMCRJVSVTCIE-AWEZNQCLSA-N 2 0 275.440 2.676 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)cc1 ZINC000817941913 632744972 /nfs/dbraw/zinc/74/49/72/632744972.db2.gz TYTVJVVUAPJZRV-CQSZACIVSA-N 2 0 275.440 2.793 20 10 CFCDRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817942224 632745560 /nfs/dbraw/zinc/74/55/60/632745560.db2.gz ZGJYZGBORPTAIY-OAHLLOKOSA-N 2 0 275.440 2.937 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817945365 632747425 /nfs/dbraw/zinc/74/74/25/632747425.db2.gz AGUSZRMXUFFVPE-RHSMWYFYSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc2ccccc2c1O ZINC000817953481 632753334 /nfs/dbraw/zinc/75/33/34/632753334.db2.gz PQFNTBGORYXYPT-NWDGAFQWSA-N 2 0 258.365 2.933 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000817959860 632757687 /nfs/dbraw/zinc/75/76/87/632757687.db2.gz WBWKBFGGPWYZOH-BXKDBHETSA-N 2 0 256.777 2.680 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000817959685 632757807 /nfs/dbraw/zinc/75/78/07/632757807.db2.gz GHZXGBAZPVLOSV-LBPRGKRZSA-N 2 0 250.386 2.869 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(N(C)C)cc1 ZINC000817960383 632759321 /nfs/dbraw/zinc/75/93/21/632759321.db2.gz YMNSDVULONDWRC-HZPDHXFCSA-N 2 0 263.429 2.777 20 10 CFCDRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817963273 632761691 /nfs/dbraw/zinc/76/16/91/632761691.db2.gz SYXIEHUDKDUFFB-RYUDHWBXSA-N 2 0 262.397 2.516 20 10 CFCDRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cc(Cl)ccc1O ZINC000817962212 632761931 /nfs/dbraw/zinc/76/19/31/632761931.db2.gz IYQWBNMUKSLOSM-SKDRFNHKSA-N 2 0 256.777 2.681 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCC1)c1cc(Br)ccc1O ZINC000817964381 632763269 /nfs/dbraw/zinc/76/32/69/632763269.db2.gz AIVAKROAIMOEBJ-SECBINFHSA-N 2 0 299.212 2.687 20 10 CFCDRP CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccccc1O ZINC000817966763 632766066 /nfs/dbraw/zinc/76/60/66/632766066.db2.gz VDHSRELNTHKTKQ-HOCLYGCPSA-N 2 0 262.397 2.823 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c(O)c1 ZINC000817966852 632766502 /nfs/dbraw/zinc/76/65/02/632766502.db2.gz XAQKDFLXECYISC-CJNGLKHVSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817968494 632767447 /nfs/dbraw/zinc/76/74/47/632767447.db2.gz KFLJBRHJXIKWRF-NQBHXWOUSA-N 2 0 278.371 2.811 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(O)c1 ZINC000817968487 632767526 /nfs/dbraw/zinc/76/75/26/632767526.db2.gz KEKZRAYEHMUYRH-KBPBESRZSA-N 2 0 262.397 2.802 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(O)c1 ZINC000817970107 632768574 /nfs/dbraw/zinc/76/85/74/632768574.db2.gz LIGFPXPBXZTAIX-MELADBBJSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817970434 632769433 /nfs/dbraw/zinc/76/94/33/632769433.db2.gz VFRRDWBDRMEKGY-QEJZJMRPSA-N 2 0 261.413 2.673 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(C)cc1O ZINC000817970783 632769858 /nfs/dbraw/zinc/76/98/58/632769858.db2.gz FCZUWSMHPMPJFU-IPYPFGDCSA-N 2 0 262.397 2.882 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)c2c1c(F)ccc2O ZINC000817970456 632769886 /nfs/dbraw/zinc/76/98/86/632769886.db2.gz VZMJJIJNLUPTGH-XZUYRWCXSA-N 2 0 278.371 2.939 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c(O)c1C ZINC000817971702 632771348 /nfs/dbraw/zinc/77/13/48/632771348.db2.gz PEPTXOTXCWTYGP-KWCYVHTRSA-N 2 0 262.397 2.800 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000817972613 632772375 /nfs/dbraw/zinc/77/23/75/632772375.db2.gz YNAUFPXAWSZPGC-GRDNDAEWSA-N 2 0 275.440 2.791 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H](C)[NH3+])c1cc(Br)ccc1O ZINC000817973952 632773050 /nfs/dbraw/zinc/77/30/50/632773050.db2.gz WYQMVEMIPSGLGS-KCJUWKMLSA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1O ZINC000817977062 632774855 /nfs/dbraw/zinc/77/48/55/632774855.db2.gz ZXCPDHIVAWLFGC-IINYFYTJSA-N 2 0 280.799 2.838 20 10 CFCDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817977940 632774887 /nfs/dbraw/zinc/77/48/87/632774887.db2.gz RVBIUDJBNBOGOF-CIUDSAMLSA-N 2 0 287.201 2.541 20 10 CFCDRP CC[C@H]([NH3+])C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000817980706 632777864 /nfs/dbraw/zinc/77/78/64/632777864.db2.gz WPBWYNLPBVRQAT-JQWIXIFHSA-N 2 0 256.777 2.824 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000817982159 632778862 /nfs/dbraw/zinc/77/88/62/632778862.db2.gz YOJKUQVEKHUVDK-QWHCGFSZSA-N 2 0 278.396 2.584 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CCC[NH2+]C2CC2)c2c1c(F)ccc2O ZINC000817983850 632779820 /nfs/dbraw/zinc/77/98/20/632779820.db2.gz JXPQYJHTUMKFGO-GWCFXTLKSA-N 2 0 278.371 2.811 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(F)ccc1O ZINC000817984930 632781073 /nfs/dbraw/zinc/78/10/73/632781073.db2.gz CNKRZUPEZOLAHA-YPMHNXCESA-N 2 0 278.371 2.857 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000817987023 632782101 /nfs/dbraw/zinc/78/21/01/632782101.db2.gz PDZGHYXZTNUURD-ZQDZILKHSA-N 2 0 274.408 2.739 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000817987135 632782181 /nfs/dbraw/zinc/78/21/81/632782181.db2.gz WOOUPFUVMYNYDU-OLZOCXBDSA-N 2 0 290.407 2.726 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1O ZINC000817987834 632783151 /nfs/dbraw/zinc/78/31/51/632783151.db2.gz YOAAWKALJHSSEG-NHIYQJMISA-N 2 0 274.408 2.821 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)c1 ZINC000818431962 632843495 /nfs/dbraw/zinc/84/34/95/632843495.db2.gz YECSUJWESSCVDK-AWEZNQCLSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(F)cc1[O-] ZINC000848557449 633288548 /nfs/dbraw/zinc/28/85/48/633288548.db2.gz IDLZNGMLHUFELP-LNSITVRQSA-N 2 0 280.387 2.912 20 10 CFCDRP CCc1cccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1O ZINC000848907750 633393834 /nfs/dbraw/zinc/39/38/34/633393834.db2.gz RZFBEYURGMFPHK-UHFFFAOYSA-N 2 0 288.435 2.919 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000849350711 633626076 /nfs/dbraw/zinc/62/60/76/633626076.db2.gz SJOLKNBIRASJQZ-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C)[C@H](C)C1 ZINC000122692290 639337566 /nfs/dbraw/zinc/33/75/66/639337566.db2.gz QTDCAKTWJSKADM-QAPCUYQASA-N 2 0 289.467 2.881 20 10 CFCDRP Cc1ccc(O)c(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000872250781 641717745 /nfs/dbraw/zinc/71/77/45/641717745.db2.gz BLJZAYDTTKCFDR-CQSZACIVSA-N 2 0 262.397 2.568 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000872252081 641718095 /nfs/dbraw/zinc/71/80/95/641718095.db2.gz OQVRXHJTZNSHNQ-CQSZACIVSA-N 2 0 292.423 2.659 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1 ZINC000872725742 641913326 /nfs/dbraw/zinc/91/33/26/641913326.db2.gz VTCHLGBRRXMEMT-ZBFHGGJFSA-N 2 0 274.408 2.535 20 10 CFCDRP C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CC[NH2+]CC1 ZINC000873219962 642072431 /nfs/dbraw/zinc/07/24/31/642072431.db2.gz HXTGGNPVBNMRLZ-RGDDUWESSA-N 2 0 287.451 2.744 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CCCCCC[NH3+])cc1F ZINC000873231352 642085373 /nfs/dbraw/zinc/08/53/73/642085373.db2.gz GZPSKOIPFPTLRS-UHFFFAOYSA-N 2 0 281.419 2.843 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Br)cc1O ZINC000873249711 642096860 /nfs/dbraw/zinc/09/68/60/642096860.db2.gz CCRWPUZTDDECGH-ATZCPNFKSA-N 2 0 299.212 2.543 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000125554451 642669505 /nfs/dbraw/zinc/66/95/05/642669505.db2.gz HPMPCZLXXDRIAF-QGZVFWFLSA-N 2 0 289.467 2.916 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)cc2O)C1 ZINC000876774796 643006465 /nfs/dbraw/zinc/00/64/65/643006465.db2.gz HGXZAEQYRIFOGW-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1ccc(C[NH2+]C2CC[NH+](CC(C)C)CC2)c(O)c1 ZINC000876925219 643066527 /nfs/dbraw/zinc/06/65/27/643066527.db2.gz XHUKSFQMNNSZCF-UHFFFAOYSA-N 2 0 276.424 2.911 20 10 CFCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(C)cc2O)CC1 ZINC000877020197 643106422 /nfs/dbraw/zinc/10/64/22/643106422.db2.gz ZFXORVKWWTWIHT-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000877068099 643132149 /nfs/dbraw/zinc/13/21/49/643132149.db2.gz QSEVZSFWJORQLX-GOOCMWNKSA-N 2 0 274.408 2.806 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000877551863 643352218 /nfs/dbraw/zinc/35/22/18/643352218.db2.gz MCDDQZGACLVQKI-QGZVFWFLSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)c(O)c1 ZINC000877577144 643373901 /nfs/dbraw/zinc/37/39/01/643373901.db2.gz AMQYASBHUIKCTO-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)c1O ZINC000252878581 651028062 /nfs/dbraw/zinc/02/80/62/651028062.db2.gz YIIIBOKXJRWMKH-ZWNOBZJWSA-N 2 0 298.814 2.627 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC34CCC4)cc2)CC1 ZINC000883290537 645723415 /nfs/dbraw/zinc/72/34/15/645723415.db2.gz XGAMXRYKKNQPEN-SFHVURJKSA-N 2 0 299.462 2.861 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c1 ZINC000925784451 648322855 /nfs/dbraw/zinc/32/28/55/648322855.db2.gz RPOSVDKVXMTZBB-VXGBXAGGSA-N 2 0 284.350 2.596 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925787196 648323983 /nfs/dbraw/zinc/32/39/83/648323983.db2.gz XBNBWDLQPSBJND-NOHGZBONSA-N 2 0 278.371 2.525 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925797032 648326473 /nfs/dbraw/zinc/32/64/73/648326473.db2.gz MXWKWLRXERKIQY-HZSPNIEDSA-N 2 0 262.397 2.597 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)c1 ZINC001235941652 778618830 /nfs/dbraw/zinc/61/88/30/778618830.db2.gz WQFVPNNZNKPNNC-UKRRQHHQSA-N 2 0 288.435 2.731 20 10 CFCDRP CC[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235949448 778624309 /nfs/dbraw/zinc/62/43/09/778624309.db2.gz LELXWGVJKFHFHN-INIZCTEOSA-N 2 0 287.451 2.718 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C[C@H]1CC1(C)C ZINC001235958011 778626735 /nfs/dbraw/zinc/62/67/35/778626735.db2.gz BFWFSXOIBHXLAJ-MRXNPFEDSA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1Cl ZINC001235959597 778628513 /nfs/dbraw/zinc/62/85/13/778628513.db2.gz KTNHCBFCFBNHLI-QHBPRCKVSA-N 2 0 280.799 2.523 20 10 CFCDRP CCC[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)CC(C)C ZINC001236264232 778757427 /nfs/dbraw/zinc/75/74/27/778757427.db2.gz OCWCQGXWWRQGNO-UHFFFAOYSA-N 2 0 292.423 2.742 20 10 CFCDRP COc1cc(C)c(C[N@H+](C)CCC[NH+]2CCCC2)c(O)c1 ZINC001236813388 778950295 /nfs/dbraw/zinc/95/02/95/778950295.db2.gz JSBKFMASUJLRDH-UHFFFAOYSA-N 2 0 292.423 2.627 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)ccc1N(C)C ZINC001237386793 779090512 /nfs/dbraw/zinc/09/05/12/779090512.db2.gz AHJGWQBPACCMMO-IRXDYDNUSA-N 2 0 287.451 2.635 20 10 CFCDRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c1O ZINC001237395600 779094747 /nfs/dbraw/zinc/09/47/47/779094747.db2.gz YBLMZDDCDUJCQT-ZBFHGGJFSA-N 2 0 274.408 2.583 20 10 CFCDRP CCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237417074 779104609 /nfs/dbraw/zinc/10/46/09/779104609.db2.gz RZSDRTKOTCVIJE-ZBFHGGJFSA-N 2 0 274.408 2.529 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CCC2CC[NH+](C)CC2)c1 ZINC000113336179 376011063 /nfs/dbraw/zinc/01/10/63/376011063.db2.gz MPJWTYHVMLCGMK-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(C[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000124672653 377075686 /nfs/dbraw/zinc/07/56/86/377075686.db2.gz LSMLSWBPMMMZTB-UHFFFAOYSA-N 2 0 262.397 2.666 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCC[NH+](C)C)cc1 ZINC000151918295 378372523 /nfs/dbraw/zinc/37/25/23/378372523.db2.gz FDMJLILIJDUHBB-CQSZACIVSA-N 2 0 263.429 2.745 20 10 CFCDRP Cc1cccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c1O ZINC000179826565 380584258 /nfs/dbraw/zinc/58/42/58/380584258.db2.gz XNVPFOBQLGAAEW-UHFFFAOYSA-N 2 0 276.424 2.864 20 10 CFCDRP C[NH+]1CCC2(CCC[N@H+](Cc3cc(F)ccc3O)C2)CC1 ZINC000369705594 381316641 /nfs/dbraw/zinc/31/66/41/381316641.db2.gz ZJVVNPOYAUAIBE-UHFFFAOYSA-N 2 0 292.398 2.839 20 10 CFCDRP C[C@H]([NH2+]C1CCN(C)CC1)c1cc(Cl)ccc1O ZINC000184897346 381493476 /nfs/dbraw/zinc/49/34/76/381493476.db2.gz FXVXUEHGBVQKSH-JTQLQIEISA-N 2 0 268.788 2.790 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000185650867 381693648 /nfs/dbraw/zinc/69/36/48/381693648.db2.gz BFFZSTGRCCMCMX-RDBSUJKOSA-N 2 0 292.423 2.924 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672013 381699270 /nfs/dbraw/zinc/69/92/70/381699270.db2.gz JULNFZHBOKVGFW-MELADBBJSA-N 2 0 274.408 2.976 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672173 381699451 /nfs/dbraw/zinc/69/94/51/381699451.db2.gz GYXVUFZSAMXEHD-AVGNSLFASA-N 2 0 290.407 2.677 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000293748123 382262976 /nfs/dbraw/zinc/26/29/76/382262976.db2.gz WOWQXTIZLLFMQO-QGZVFWFLSA-N 2 0 274.408 2.618 20 10 CFCDRP C[C@H](Cn1ccnc1)[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000294140678 382431940 /nfs/dbraw/zinc/43/19/40/382431940.db2.gz HLPAIWLLMYTSCY-SECBINFHSA-N 2 0 283.734 2.560 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000249382009 383342804 /nfs/dbraw/zinc/34/28/04/383342804.db2.gz STCIYGMACBTKHJ-CABCVRRESA-N 2 0 275.440 2.745 20 10 CFCDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccccc1O ZINC000019914857 170924908 /nfs/dbraw/zinc/92/49/08/170924908.db2.gz YHJUAPUSASLFHT-CQSZACIVSA-N 2 0 264.413 2.992 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccccc1O ZINC000020129086 171016345 /nfs/dbraw/zinc/01/63/45/171016345.db2.gz IHXXXCJNRXBBCY-HNNXBMFYSA-N 2 0 262.397 2.919 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2cc(C)ccc2O)CC1 ZINC000071408609 176156943 /nfs/dbraw/zinc/15/69/43/176156943.db2.gz ZLRHOSRVHJOWOW-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)CC[C@@H]21 ZINC000156092295 277084163 /nfs/dbraw/zinc/08/41/63/277084163.db2.gz XZIJPZZQSAQDIR-WFASDCNBSA-N 2 0 294.826 2.962 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccccc1O ZINC000049553307 522689335 /nfs/dbraw/zinc/68/93/35/522689335.db2.gz MUPSZENNNWUWFW-JSGCOSHPSA-N 2 0 250.386 2.773 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295986878 519616785 /nfs/dbraw/zinc/61/67/85/519616785.db2.gz NNXXPZJXEFLSAJ-CQSZACIVSA-N 2 0 262.397 2.699 20 10 CFCDRP CCOc1cccc(C[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000020128774 521362059 /nfs/dbraw/zinc/36/20/59/521362059.db2.gz NUFVRVJYSPVYCM-UHFFFAOYSA-N 2 0 292.423 2.757 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c1O ZINC000060942145 521363933 /nfs/dbraw/zinc/36/39/33/521363933.db2.gz QERZWMYYSWRJTL-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)C[NH+]1CCCC1 ZINC000062077557 524749445 /nfs/dbraw/zinc/74/94/45/524749445.db2.gz DOPAMAJBKGHAMK-KBPBESRZSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1C ZINC000246238648 525316915 /nfs/dbraw/zinc/31/69/15/525316915.db2.gz GHJOQUCWPIIMRC-DOTOQJQBSA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649019 525358724 /nfs/dbraw/zinc/35/87/24/525358724.db2.gz UQVBBUDVRYXAIR-KGLIPLIRSA-N 2 0 274.408 2.836 20 10 CFCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N(C)C)cc1 ZINC000271818947 525424559 /nfs/dbraw/zinc/42/45/59/525424559.db2.gz CBSSYKFJLHAKNE-CQSZACIVSA-N 2 0 273.424 2.665 20 10 CFCDRP c1csc(SCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)n1 ZINC000754792591 574121060 /nfs/dbraw/zinc/12/10/60/574121060.db2.gz DJYGONWTAINUEW-STQMWFEESA-N 2 0 297.493 2.842 20 10 CFCDRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccc(N(C)C)cc1 ZINC000843343762 617821617 /nfs/dbraw/zinc/82/16/17/617821617.db2.gz XRDMZDOMKNTVGY-AWEZNQCLSA-N 2 0 263.429 2.922 20 10 CFCDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1cccc(Cl)c1[O-] ZINC000841072009 620758987 /nfs/dbraw/zinc/75/89/87/620758987.db2.gz DPKGFBPYLUITCB-LBPRGKRZSA-N 2 0 268.788 2.523 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000044533197 618026711 /nfs/dbraw/zinc/02/67/11/618026711.db2.gz GDYKDDBKSUIOHR-CABCVRRESA-N 2 0 275.440 2.745 20 10 CFCDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000925842773 619175740 /nfs/dbraw/zinc/17/57/40/619175740.db2.gz NMQGUHWFQGXSBV-ZTFGCOKTSA-N 2 0 287.451 2.935 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000925876301 619196412 /nfs/dbraw/zinc/19/64/12/619196412.db2.gz SUCAWJDUXJTJOP-UKPHBRMFSA-N 2 0 275.440 2.921 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1C ZINC000841028531 620255728 /nfs/dbraw/zinc/25/57/28/620255728.db2.gz AVZCNGXBZVIKBT-GJZGRUSLSA-N 2 0 262.397 2.611 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902488772 621113176 /nfs/dbraw/zinc/11/31/76/621113176.db2.gz NTGHNBFZCUKXPI-YDHLFZDLSA-N 2 0 261.413 2.531 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1F ZINC000841085241 622219740 /nfs/dbraw/zinc/21/97/40/622219740.db2.gz XJIWBZRHRCIKRM-UKRRQHHQSA-N 2 0 293.430 2.889 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1C ZINC000841089625 622349668 /nfs/dbraw/zinc/34/96/68/622349668.db2.gz PGGQNPWCVSCPPE-HNNXBMFYSA-N 2 0 274.408 2.773 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000044534814 622918657 /nfs/dbraw/zinc/91/86/57/622918657.db2.gz BQGJYDUWDJBZSE-ZFWWWQNUSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000164517728 622958168 /nfs/dbraw/zinc/95/81/68/622958168.db2.gz JDGKOANHJCWGMI-NVXWUHKLSA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)[C@@H](C)[NH3+])c1O ZINC000817979219 625972857 /nfs/dbraw/zinc/97/28/57/625972857.db2.gz IVAAUJNMDYEXJU-BBBLOLIVSA-N 2 0 256.777 2.740 20 10 CFCDRP Cc1cc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)ccc1N(C)C ZINC000923335463 626467045 /nfs/dbraw/zinc/46/70/45/626467045.db2.gz PGDSFQJNHMRYJR-INIZCTEOSA-N 2 0 275.440 2.635 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C)C2)cc1 ZINC000843053484 626548613 /nfs/dbraw/zinc/54/86/13/626548613.db2.gz YSWJAOWYDQQTAB-MRXNPFEDSA-N 2 0 275.440 2.574 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000768302711 627332162 /nfs/dbraw/zinc/33/21/62/627332162.db2.gz KGNHHJWVHAJWTB-UHFFFAOYSA-N 2 0 275.440 2.526 20 10 CFCDRP COc1cccc(O)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000768998103 627393632 /nfs/dbraw/zinc/39/36/32/627393632.db2.gz LLUKRSXKNINFGO-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000769515514 627450509 /nfs/dbraw/zinc/45/05/09/627450509.db2.gz ROIOXMBLUHPIMT-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000771823433 627634641 /nfs/dbraw/zinc/63/46/41/627634641.db2.gz BLGQDKFCNPSXOE-SFHVURJKSA-N 2 0 289.467 2.963 20 10 CFCDRP C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771830418 627635088 /nfs/dbraw/zinc/63/50/88/627635088.db2.gz QVCNOKOTAUQEBD-MAUKXSAKSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775639589 628048926 /nfs/dbraw/zinc/04/89/26/628048926.db2.gz ZPIIYWJGFIECLS-INIZCTEOSA-N 2 0 287.451 2.670 20 10 CFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775652814 628050075 /nfs/dbraw/zinc/05/00/75/628050075.db2.gz VEYINTFJMPIFHN-UHFFFAOYSA-N 2 0 287.451 2.813 20 10 CFCDRP C[C@@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000775708955 628058019 /nfs/dbraw/zinc/05/80/19/628058019.db2.gz QLRXYEAQBUCYJO-HZPDHXFCSA-N 2 0 287.451 2.526 20 10 CFCDRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000780575617 628478938 /nfs/dbraw/zinc/47/89/38/628478938.db2.gz FSLKSLHUPKLSQE-NVXWUHKLSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000780575618 628478985 /nfs/dbraw/zinc/47/89/85/628478985.db2.gz FSLKSLHUPKLSQE-RDJZCZTQSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835038345 629333304 /nfs/dbraw/zinc/33/33/04/629333304.db2.gz WGAGWQMGEPCMJB-XHPSBEMXSA-N 2 0 275.440 2.696 20 10 CFCDRP Cc1cccc(C[NH2+]CCCC[N@@H+](C)C2CC2)c1O ZINC000835063171 629366320 /nfs/dbraw/zinc/36/63/20/629366320.db2.gz HZSNPWUMEHCGII-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)c1 ZINC000793768273 629592810 /nfs/dbraw/zinc/59/28/10/629592810.db2.gz QPUZGKKCYSQSCP-QGZVFWFLSA-N 2 0 274.408 2.537 20 10 CFCDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000840808429 631227448 /nfs/dbraw/zinc/22/74/48/631227448.db2.gz CDKBLBYCQQYCIP-HIFRSBDPSA-N 2 0 274.408 2.701 20 10 CFCDRP C[C@@H]1C[C@H](C[N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC000841002664 631300478 /nfs/dbraw/zinc/30/04/78/631300478.db2.gz ASUAEYWAYJBLRG-GDBMZVCRSA-N 2 0 275.440 2.573 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]([NH3+])CC(C)C ZINC000841007265 631304065 /nfs/dbraw/zinc/30/40/65/631304065.db2.gz NXOAIHYULRAHHO-HNNXBMFYSA-N 2 0 264.413 2.978 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1F ZINC000841030658 631311310 /nfs/dbraw/zinc/31/13/10/631311310.db2.gz OBSWAOZPZJOLJM-ZBFHGGJFSA-N 2 0 293.430 2.889 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(Cl)c1 ZINC000841058787 631326220 /nfs/dbraw/zinc/32/62/20/631326220.db2.gz VMWKFSLMKZXLFN-MNOVXSKESA-N 2 0 268.788 2.714 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1O ZINC000841073365 631330336 /nfs/dbraw/zinc/33/03/36/631330336.db2.gz RVSLKBCXWMUNML-CQSZACIVSA-N 2 0 282.815 2.976 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000841073385 631330645 /nfs/dbraw/zinc/33/06/45/631330645.db2.gz SHFGXCKKKPZKTG-ZVVFDCPKSA-N 2 0 287.451 2.888 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)c1O ZINC000841072612 631331110 /nfs/dbraw/zinc/33/11/10/631331110.db2.gz LMMOYDRZIZSZHY-CYBMUJFWSA-N 2 0 282.815 2.832 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1O ZINC000841080859 631332649 /nfs/dbraw/zinc/33/26/49/631332649.db2.gz WHUSTYOGQBRTED-HDJSIYSDSA-N 2 0 292.423 2.646 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000841090077 631336609 /nfs/dbraw/zinc/33/66/09/631336609.db2.gz VDAINVIKYGNKLS-AWEZNQCLSA-N 2 0 291.414 2.656 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088889 631337312 /nfs/dbraw/zinc/33/73/12/631337312.db2.gz FHIIJIAQBDHUIR-ZDUSSCGKSA-N 2 0 280.799 2.810 20 10 CFCDRP C[C@@H]1CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@H]1C[NH3+] ZINC000841099799 631339836 /nfs/dbraw/zinc/33/98/36/631339836.db2.gz PCRHSDIYKVHZNE-XQJUWPJRSA-N 2 0 287.451 2.683 20 10 CFCDRP C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000842211894 631567219 /nfs/dbraw/zinc/56/72/19/631567219.db2.gz ZOPYMTHANWGWNJ-XHPSBEMXSA-N 2 0 275.440 2.553 20 10 CFCDRP CCC[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccccc1O ZINC000842472279 631639543 /nfs/dbraw/zinc/63/95/43/631639543.db2.gz VWDOFFWDABSRTB-HNNXBMFYSA-N 2 0 276.424 2.994 20 10 CFCDRP [NH3+][C@@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000843043775 631812289 /nfs/dbraw/zinc/81/22/89/631812289.db2.gz GZVOJLSFALSCRV-MRXNPFEDSA-N 2 0 273.424 2.600 20 10 CFCDRP C[NH2+]C[C@H]1CCCN(Cc2c(O)cc(C)cc2Cl)C1 ZINC000843045279 631812301 /nfs/dbraw/zinc/81/23/01/631812301.db2.gz UECHKFNPFFUSIZ-GFCCVEGCSA-N 2 0 282.815 2.785 20 10 CFCDRP C[NH2+]C[C@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000843045408 631812349 /nfs/dbraw/zinc/81/23/49/631812349.db2.gz WQGHHEWAGVOCSD-UKINESCASA-N 2 0 287.451 2.697 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2C)CC[C@@H]1[NH3+] ZINC000843050784 631815159 /nfs/dbraw/zinc/81/51/59/631815159.db2.gz PHHJIQJKZJFMGC-PBHICJAKSA-N 2 0 275.440 2.620 20 10 CFCDRP CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@]1(C)CC[NH2+]C1 ZINC000843061051 631823045 /nfs/dbraw/zinc/82/30/45/631823045.db2.gz YGHFVFYZGFNWTA-SFHVURJKSA-N 2 0 289.467 2.963 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000843109552 631838809 /nfs/dbraw/zinc/83/88/09/631838809.db2.gz YBNYSYJXMGCJFT-SNAWJCMRSA-N 2 0 273.424 2.579 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1 ZINC000843113633 631838902 /nfs/dbraw/zinc/83/89/02/631838902.db2.gz ZUJMDUYJXRFWBI-IVZVJUQRSA-N 2 0 287.451 2.827 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1 ZINC000843124564 631844146 /nfs/dbraw/zinc/84/41/46/631844146.db2.gz CDBDRGYMGJQGRL-CABCVRRESA-N 2 0 274.408 2.522 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000843127907 631847820 /nfs/dbraw/zinc/84/78/20/631847820.db2.gz JNHZAKQQUAUOJG-UHFFFAOYSA-N 2 0 283.419 2.810 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)ccc21 ZINC000843342874 631932395 /nfs/dbraw/zinc/93/23/95/631932395.db2.gz QVJBSWQKYXDCJI-RCCFBDPRSA-N 2 0 299.462 2.547 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000844220325 632136596 /nfs/dbraw/zinc/13/65/96/632136596.db2.gz DAUTXXHYKQHPIT-MRXNPFEDSA-N 2 0 275.440 2.574 20 10 CFCDRP Cc1cccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)c1O ZINC000844904738 632331770 /nfs/dbraw/zinc/33/17/70/632331770.db2.gz PKWFJDAAUTYNSJ-UHFFFAOYSA-N 2 0 274.339 2.588 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)c(O)c1 ZINC000844920851 632336438 /nfs/dbraw/zinc/33/64/38/632336438.db2.gz NOSYNQCGBCEXTN-CYBMUJFWSA-N 2 0 262.397 2.789 20 10 CFCDRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000844925796 632338807 /nfs/dbraw/zinc/33/88/07/632338807.db2.gz UXKXCNDBQUBEEO-INIZCTEOSA-N 2 0 282.387 2.889 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1O ZINC000846140895 632644573 /nfs/dbraw/zinc/64/45/73/632644573.db2.gz IHFIYYDYCLZNLU-KGLIPLIRSA-N 2 0 292.423 2.783 20 10 CFCDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817899474 632723310 /nfs/dbraw/zinc/72/33/10/632723310.db2.gz OXUTUTROLWKCMI-KGLIPLIRSA-N 2 0 261.413 2.502 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1F ZINC000817903725 632726725 /nfs/dbraw/zinc/72/67/25/632726725.db2.gz TVQOMIPYBKHMQT-STQMWFEESA-N 2 0 281.419 2.887 20 10 CFCDRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817941317 632745291 /nfs/dbraw/zinc/74/52/91/632745291.db2.gz SDHRGXQYPJDPHU-LBPRGKRZSA-N 2 0 258.365 2.806 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817955012 632754923 /nfs/dbraw/zinc/75/49/23/632754923.db2.gz OODUWQRFYDCQTI-KGLIPLIRSA-N 2 0 288.435 2.921 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000817955507 632755106 /nfs/dbraw/zinc/75/51/06/632755106.db2.gz XRGSMTNUEWCOJK-CABCVRRESA-N 2 0 275.440 2.793 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000817960960 632759442 /nfs/dbraw/zinc/75/94/42/632759442.db2.gz VENZLKBUIKHQOL-CYBMUJFWSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(F)ccc1O ZINC000817966271 632765494 /nfs/dbraw/zinc/76/54/94/632765494.db2.gz KAEWWOOWOITZPL-XHDPSFHLSA-N 2 0 266.360 2.572 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(O)c1 ZINC000817970106 632768892 /nfs/dbraw/zinc/76/88/92/632768892.db2.gz LIGFPXPBXZTAIX-IHRRRGAJSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000817972414 632772242 /nfs/dbraw/zinc/77/22/42/632772242.db2.gz XATXSYMXMCAXDM-DCGLDWPTSA-N 2 0 288.435 2.920 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1O ZINC000817976457 632774403 /nfs/dbraw/zinc/77/44/03/632774403.db2.gz YYZWDSVJJCRNMW-IHRRRGAJSA-N 2 0 262.397 2.808 20 10 CFCDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817977342 632775469 /nfs/dbraw/zinc/77/54/69/632775469.db2.gz HZYZETBETGBUEB-SRVKXCTJSA-N 2 0 258.365 2.932 20 10 CFCDRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccc1O ZINC000817980274 632776862 /nfs/dbraw/zinc/77/68/62/632776862.db2.gz KKICVXQGCVDEPJ-ZFWWWQNUSA-N 2 0 262.397 2.965 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000817981429 632777881 /nfs/dbraw/zinc/77/78/81/632777881.db2.gz JFUSBLYDDCYHEA-SQWLQELKSA-N 2 0 275.440 2.921 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]([NH3+])CC)c1cc(Cl)ccc1O ZINC000817980704 632778010 /nfs/dbraw/zinc/77/80/10/632778010.db2.gz WPBWYNLPBVRQAT-CMPLNLGQSA-N 2 0 256.777 2.824 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c(O)c1 ZINC000817985105 632781972 /nfs/dbraw/zinc/78/19/72/632781972.db2.gz AHIVDBSISZMXHZ-ZQDZILKHSA-N 2 0 274.408 2.739 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1 ZINC000817985070 632782193 /nfs/dbraw/zinc/78/21/93/632782193.db2.gz GMOWPOUZVNDGIC-CQSZACIVSA-N 2 0 274.408 2.969 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000817985056 632782251 /nfs/dbraw/zinc/78/22/51/632782251.db2.gz GCOHKIHMFRIREP-KGLIPLIRSA-N 2 0 272.392 2.644 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c(O)c1 ZINC000817985103 632782330 /nfs/dbraw/zinc/78/23/30/632782330.db2.gz AHIVDBSISZMXHZ-GBJTYRQASA-N 2 0 274.408 2.739 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(F)ccc1O ZINC000817985152 632782367 /nfs/dbraw/zinc/78/23/67/632782367.db2.gz BDNQDCNYQHBZOC-FMCLSXCISA-N 2 0 278.371 2.570 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1 ZINC000858491198 636269755 /nfs/dbraw/zinc/26/97/55/636269755.db2.gz ZXJHELKEJIAUTL-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1O ZINC000858491316 636269847 /nfs/dbraw/zinc/26/98/47/636269847.db2.gz FDWWDIXEOATVQN-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000122664002 639305812 /nfs/dbraw/zinc/30/58/12/639305812.db2.gz UPSCXPISSSSZSQ-GDBMZVCRSA-N 2 0 275.440 2.633 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000122805993 639441679 /nfs/dbraw/zinc/44/16/79/639441679.db2.gz UTGZBCKDDRGKJB-HNNXBMFYSA-N 2 0 289.467 2.881 20 10 CFCDRP C[N@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccccc1O ZINC000873203370 642065603 /nfs/dbraw/zinc/06/56/03/642065603.db2.gz BARYLEBYMHKYAM-UHFFFAOYSA-N 2 0 288.416 2.731 20 10 CFCDRP C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CC[NH2+]CC1 ZINC000873219958 642073337 /nfs/dbraw/zinc/07/33/37/642073337.db2.gz HXTGGNPVBNMRLZ-FOSCPCJNSA-N 2 0 287.451 2.744 20 10 CFCDRP COc1ccc(O)c(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223951 642077769 /nfs/dbraw/zinc/07/77/69/642077769.db2.gz VOFFZBSSBAZKDV-QGZVFWFLSA-N 2 0 292.423 2.598 20 10 CFCDRP [NH3+][C@@H](CC[NH2+][C@@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000873235427 642088403 /nfs/dbraw/zinc/08/84/03/642088403.db2.gz OLQGPBRREXDWBF-DLBZAZTESA-N 2 0 296.414 2.929 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000876949449 643076483 /nfs/dbraw/zinc/07/64/83/643076483.db2.gz WQIGUSZTORGPMI-CQSZACIVSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c(O)c1 ZINC000877019848 643106332 /nfs/dbraw/zinc/10/63/32/643106332.db2.gz FPTQKJQLCWNVCF-OAHLLOKOSA-N 2 0 276.424 2.911 20 10 CFCDRP Cc1cccc(O)c1C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000877073717 643136074 /nfs/dbraw/zinc/13/60/74/643136074.db2.gz RAINGMVQYNSDPW-UONOGXRCSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c(O)c1 ZINC000877074032 643136460 /nfs/dbraw/zinc/13/64/60/643136460.db2.gz YBBKBJFKVNAYMC-HUUCEWRRSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(O)c1C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000877073718 643136660 /nfs/dbraw/zinc/13/66/60/643136660.db2.gz RAINGMVQYNSDPW-ZIAGYGMSSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000877585087 643380535 /nfs/dbraw/zinc/38/05/35/643380535.db2.gz PGMBPSKRRNWZHO-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1O ZINC000877756588 643536700 /nfs/dbraw/zinc/53/67/00/643536700.db2.gz VTXBHWDOLNNYHU-RDBSUJKOSA-N 2 0 260.381 2.670 20 10 CFCDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000094617960 650960479 /nfs/dbraw/zinc/96/04/79/650960479.db2.gz NBJKQTXAKGXTHT-LLVKDONJSA-N 2 0 266.360 2.524 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000251160904 650984877 /nfs/dbraw/zinc/98/48/77/650984877.db2.gz MIIKDVOIOSDGDZ-GDBMZVCRSA-N 2 0 274.408 2.665 20 10 CFCDRP CC[C@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883291016 645725117 /nfs/dbraw/zinc/72/51/17/645725117.db2.gz PMKUITDOJSXFQZ-FUHWJXTLSA-N 2 0 287.451 2.717 20 10 CFCDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1cc(Cl)ccc1O ZINC000133353052 646074506 /nfs/dbraw/zinc/07/45/06/646074506.db2.gz KHYFQBNVQBBQRU-ZDUSSCGKSA-N 2 0 270.804 2.851 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(C)cc1O ZINC000925776525 648318964 /nfs/dbraw/zinc/31/89/64/648318964.db2.gz LARQDQFSVDRNII-GXTWGEPZSA-N 2 0 298.377 2.986 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925781637 648321200 /nfs/dbraw/zinc/32/12/00/648321200.db2.gz IYJSYZQCDCITKT-VXGBXAGGSA-N 2 0 284.350 2.596 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c1 ZINC000925784449 648323397 /nfs/dbraw/zinc/32/33/97/648323397.db2.gz RPOSVDKVXMTZBB-NWDGAFQWSA-N 2 0 284.350 2.596 20 10 CFCDRP Cc1cc(C)c(C[NH+]2CCC([NH+](C)C)CC2)c(O)c1 ZINC001231840990 777345763 /nfs/dbraw/zinc/34/57/63/777345763.db2.gz BMTHZCOPKBUHCY-UHFFFAOYSA-N 2 0 262.397 2.535 20 10 CFCDRP CCC[NH+]1C[C@@H]2C[NH+](Cc3c(C)cc(C)cc3O)C[C@H]2C1 ZINC001231851074 777351055 /nfs/dbraw/zinc/35/10/55/777351055.db2.gz ZDDQNONTRGJVFC-HZPDHXFCSA-N 2 0 288.435 2.783 20 10 CFCDRP Cc1cc(O)c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)cc1Cl ZINC001231867413 777356987 /nfs/dbraw/zinc/35/69/87/777356987.db2.gz MTBBCHHAWDMXRN-OCCSQVGLSA-N 2 0 294.826 2.738 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(CN2CC[C@H]3C[NH2+]C[C@H]32)cc1 ZINC001235004407 778350910 /nfs/dbraw/zinc/35/09/10/778350910.db2.gz ADHNJIVMFPMWLN-PKOBYXMFSA-N 2 0 295.430 2.888 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)c2ccccc21 ZINC001235027159 778359562 /nfs/dbraw/zinc/35/95/62/778359562.db2.gz VKQFGCAVVVVTPZ-MAUKXSAKSA-N 2 0 295.430 2.700 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC001235034504 778361968 /nfs/dbraw/zinc/36/19/68/778361968.db2.gz ZNHODIQCFKHQAC-SFHVURJKSA-N 2 0 288.435 2.875 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001235034502 778362661 /nfs/dbraw/zinc/36/26/61/778362661.db2.gz ZNHODIQCFKHQAC-GOSISDBHSA-N 2 0 288.435 2.875 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235227230 778422219 /nfs/dbraw/zinc/42/22/19/778422219.db2.gz FKFCJJICLYSTMT-MRXNPFEDSA-N 2 0 274.408 2.746 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC(C3CC[NH2+]CC3)CC2)c1 ZINC001235705843 778543797 /nfs/dbraw/zinc/54/37/97/778543797.db2.gz MDVUINQQENFQRJ-UHFFFAOYSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c(C)n1-c1ccccc1 ZINC001235750682 778552013 /nfs/dbraw/zinc/55/20/13/778552013.db2.gz RRLHRUSYHZOWPT-INIZCTEOSA-N 2 0 283.419 2.875 20 10 CFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C(C)C ZINC001236931284 778982304 /nfs/dbraw/zinc/98/23/04/778982304.db2.gz ITVDLRQUFUQXCV-UHFFFAOYSA-N 2 0 293.430 2.808 20 10 CFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)C[C@H]2C1 ZINC001237051084 779000275 /nfs/dbraw/zinc/00/02/75/779000275.db2.gz HGRKMUFAMHYFFU-IAGOWNOFSA-N 2 0 288.435 2.899 20 10 CFCDRP Cc1cc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237404627 779097831 /nfs/dbraw/zinc/09/78/31/779097831.db2.gz ODLWUAHCDFQJEL-GDBMZVCRSA-N 2 0 274.408 2.583 20 10 CFCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000093769905 375306894 /nfs/dbraw/zinc/30/68/94/375306894.db2.gz SAGYOLUBCDNKQH-INIZCTEOSA-N 2 0 275.440 2.526 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1C ZINC000129296885 377408882 /nfs/dbraw/zinc/40/88/82/377408882.db2.gz GHJOQUCWPIIMRC-WBVHZDCISA-N 2 0 288.435 2.925 20 10 CFCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(OC)ccc2O)C1 ZINC000180486567 380667545 /nfs/dbraw/zinc/66/75/45/380667545.db2.gz HRSMFSSAAWXVSM-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP C[N@@H+]1CC[C@@]2(CCN(Cc3cc(Cl)ccc3O)C2)C1 ZINC000368318573 380990532 /nfs/dbraw/zinc/99/05/32/380990532.db2.gz SGXNPNMAUIDJPF-OAHLLOKOSA-N 2 0 280.799 2.573 20 10 CFCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1O ZINC000296040730 381226310 /nfs/dbraw/zinc/22/63/10/381226310.db2.gz UHGJTPYKBZVVBZ-RLAWYHOSSA-N 2 0 260.381 2.668 20 10 CFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(F)ccc1O ZINC000296310971 381342947 /nfs/dbraw/zinc/34/29/47/381342947.db2.gz GJXKDIDLDNYWGJ-HLVVYCRESA-N 2 0 278.371 2.807 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(OC)ccc2O)C1 ZINC000185112368 381537680 /nfs/dbraw/zinc/53/76/80/381537680.db2.gz ILHYCAGRCIOXGZ-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185670803 381699429 /nfs/dbraw/zinc/69/94/29/381699429.db2.gz NBMZKOBCKUGEKW-CABCVRRESA-N 2 0 294.439 2.708 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 ZINC000185672477 381699563 /nfs/dbraw/zinc/69/95/63/381699563.db2.gz CYJZYHSHYBENRF-MELADBBJSA-N 2 0 274.408 2.976 20 10 CFCDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(F)ccc2O)CC1 ZINC000375512662 382087740 /nfs/dbraw/zinc/08/77/40/382087740.db2.gz SJMXPGFJVOHWAG-UHFFFAOYSA-N 2 0 278.371 2.592 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293748033 382261173 /nfs/dbraw/zinc/26/11/73/382261173.db2.gz WMOYCMGDFXLGPS-UHFFFAOYSA-N 2 0 292.423 2.757 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1O ZINC000251579072 383391280 /nfs/dbraw/zinc/39/12/80/383391280.db2.gz VTXBHWDOLNNYHU-MJBXVCDLSA-N 2 0 260.381 2.670 20 10 CFCDRP CC[C@@H](c1ccccc1O)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000312704258 393522084 /nfs/dbraw/zinc/52/20/84/393522084.db2.gz OIFPIWUPZYYZIK-RDJZCZTQSA-N 2 0 274.408 2.871 20 10 CFCDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000297836856 276834425 /nfs/dbraw/zinc/83/44/25/276834425.db2.gz SEJDHMXNPZNZOA-ZNMIVQPWSA-N 2 0 274.408 2.842 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@H]1CC[NH2+]C1 ZINC000423088566 330169265 /nfs/dbraw/zinc/16/92/65/330169265.db2.gz SGJYWOIHYAJWCB-KGLIPLIRSA-N 2 0 271.408 2.574 20 10 CFCDRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000230658244 519616674 /nfs/dbraw/zinc/61/66/74/519616674.db2.gz VJNXBXGPSGNOHD-GFCCVEGCSA-N 2 0 268.376 2.912 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cccc(OCC)c1O ZINC000290477490 521653335 /nfs/dbraw/zinc/65/33/35/521653335.db2.gz NVTYYMUHVBPADB-UHFFFAOYSA-N 2 0 294.439 2.955 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000278129487 521697350 /nfs/dbraw/zinc/69/73/50/521697350.db2.gz BWNDKGCUXWMNOQ-ROUUACIJSA-N 2 0 287.451 2.989 20 10 CFCDRP COc1ccc(O)c(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000020088837 524749893 /nfs/dbraw/zinc/74/98/93/524749893.db2.gz HJQPTXREMICIAR-AWEZNQCLSA-N 2 0 292.423 2.755 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1C ZINC000164773469 525318857 /nfs/dbraw/zinc/31/88/57/525318857.db2.gz GHRSSTHSHCGRDK-NVXWUHKLSA-N 2 0 288.435 2.925 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1C ZINC000293527810 525320701 /nfs/dbraw/zinc/32/07/01/525320701.db2.gz BPCYHJIPMKBEGF-SFHVURJKSA-N 2 0 288.435 2.927 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000278531941 525345390 /nfs/dbraw/zinc/34/53/90/525345390.db2.gz VITQDNSGXOYXLX-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1 ZINC000290466526 525346434 /nfs/dbraw/zinc/34/64/34/525346434.db2.gz NHXURKKLUXEPNQ-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000273357888 525360181 /nfs/dbraw/zinc/36/01/81/525360181.db2.gz DBSYDIHBZIUVTK-CYBMUJFWSA-N 2 0 260.381 2.613 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649180 525482025 /nfs/dbraw/zinc/48/20/25/525482025.db2.gz HLZGDGBDCXBCRA-OLZOCXBDSA-N 2 0 260.381 2.527 20 10 CFCDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc(F)ccc1O ZINC000226582857 526248899 /nfs/dbraw/zinc/24/88/99/526248899.db2.gz HGRNQMWFANMWPZ-ZDUSSCGKSA-N 2 0 280.387 2.885 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H](C)C[NH+](C)C)cc1 ZINC000312445181 618281406 /nfs/dbraw/zinc/28/14/06/618281406.db2.gz CNCPKHHNWYUTQB-HNNXBMFYSA-N 2 0 277.456 2.820 20 10 CFCDRP C[C@H](CC[NH2+]C/C=C\c1ccc(N(C)C)cc1)[NH+](C)C ZINC000895291889 618512538 /nfs/dbraw/zinc/51/25/38/618512538.db2.gz JJXDLRGNDGIBIC-IDTUSYRASA-N 2 0 275.440 2.696 20 10 CFCDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000312813050 618954162 /nfs/dbraw/zinc/95/41/62/618954162.db2.gz LVCPTUAFEIBVKG-AWEZNQCLSA-N 2 0 274.408 2.701 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C)C1 ZINC000840931487 619074361 /nfs/dbraw/zinc/07/43/61/619074361.db2.gz XDAJOEPGUYGJES-INIZCTEOSA-N 2 0 289.467 2.883 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1O ZINC000925799465 619121047 /nfs/dbraw/zinc/12/10/47/619121047.db2.gz VCTUCYFMPGXTJG-GRYCIOLGSA-N 2 0 282.815 2.942 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000925876300 619196542 /nfs/dbraw/zinc/19/65/42/619196542.db2.gz SUCAWJDUXJTJOP-KMFMINBZSA-N 2 0 275.440 2.921 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2cc(C)cc(OC)c2O)CC1 ZINC000894241615 619277497 /nfs/dbraw/zinc/27/74/97/619277497.db2.gz KPLVILPCXXQQFJ-UHFFFAOYSA-N 2 0 292.423 2.531 20 10 CFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CC2([NH3+])CC2)c1O ZINC000902407788 621056164 /nfs/dbraw/zinc/05/61/64/621056164.db2.gz UVZXPGOJTWYFRC-SECBINFHSA-N 2 0 299.212 2.605 20 10 CFCDRP c1cc2c(cc1C[NH2+]CCC[C@H]1CCC[NH2+]1)CCCO2 ZINC000904354149 621581703 /nfs/dbraw/zinc/58/17/03/621581703.db2.gz BKTAUVMYJKHHBR-INIZCTEOSA-N 2 0 274.408 2.633 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1F ZINC000904404946 621590207 /nfs/dbraw/zinc/59/02/07/621590207.db2.gz BUYYCALVARFVTQ-CQSZACIVSA-N 2 0 293.430 2.843 20 10 CFCDRP C[C@H](C[NH2+]Cc1cc(Cl)ccc1O)C[NH+]1CCCC1 ZINC000060942124 623167500 /nfs/dbraw/zinc/16/75/00/623167500.db2.gz MVDSYCSDFZSORS-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1cc(O)c(CN2CC[C@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC000825986709 623779003 /nfs/dbraw/zinc/77/90/03/623779003.db2.gz NCRSPMSDMZCQJP-INIZCTEOSA-N 2 0 294.826 2.882 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000827948594 624136246 /nfs/dbraw/zinc/13/62/46/624136246.db2.gz HWMAHMYFGHRDCE-AWEZNQCLSA-N 2 0 292.398 2.743 20 10 CFCDRP C[N@H+](CCCC[NH2+]Cc1ccc2c(c1)CCCO2)C1CC1 ZINC000922172931 626229569 /nfs/dbraw/zinc/22/95/69/626229569.db2.gz ZHUZBOUUBNGTOE-UHFFFAOYSA-N 2 0 288.435 2.976 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000839182159 626529873 /nfs/dbraw/zinc/52/98/73/626529873.db2.gz LFPHLMFUENYQTK-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000757674017 626557501 /nfs/dbraw/zinc/55/75/01/626557501.db2.gz NNBDHKHIUIKIDZ-ZDUSSCGKSA-N 2 0 298.402 2.540 20 10 CFCDRP CCOc1ccc(O)c(C[NH+]2CCC(C[NH+](C)C)CC2)c1 ZINC000768301695 627331472 /nfs/dbraw/zinc/33/14/72/627331472.db2.gz IQIGXHPNOUPBBJ-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000769515512 627450821 /nfs/dbraw/zinc/45/08/21/627450821.db2.gz ROIOXMBLUHPIMT-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)c1 ZINC000775368764 628016230 /nfs/dbraw/zinc/01/62/30/628016230.db2.gz FBSYIOGEEWDBPA-KBPBESRZSA-N 2 0 292.423 2.926 20 10 CFCDRP CC[C@@H](C)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775653849 628050357 /nfs/dbraw/zinc/05/03/57/628050357.db2.gz DIOOAVLEVMNJDV-MRXNPFEDSA-N 2 0 289.467 2.916 20 10 CFCDRP C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775736231 628061479 /nfs/dbraw/zinc/06/14/79/628061479.db2.gz AFZMBUUUNPUJMA-JKSUJKDBSA-N 2 0 287.451 2.669 20 10 CFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C ZINC000775736225 628061519 /nfs/dbraw/zinc/06/15/19/628061519.db2.gz AFZMBUUUNPUJMA-CVEARBPZSA-N 2 0 287.451 2.669 20 10 CFCDRP CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)C[NH+]1CCCC1 ZINC000791011705 629280680 /nfs/dbraw/zinc/28/06/80/629280680.db2.gz YKBUGODMHSOWHS-UHFFFAOYSA-N 2 0 288.435 2.833 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC[N@@H+]1C ZINC000835042022 629337412 /nfs/dbraw/zinc/33/74/12/629337412.db2.gz FYLKZSLUOPMPCZ-FHYYHZITSA-N 2 0 287.451 2.838 20 10 CFCDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841029050 631310150 /nfs/dbraw/zinc/31/01/50/631310150.db2.gz DYVIWDHBUUOAFE-SJLPKXTDSA-N 2 0 287.451 2.894 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CC1([NH3+])CCCCC1 ZINC000841040816 631318436 /nfs/dbraw/zinc/31/84/36/631318436.db2.gz ZRGKDNUXZHUFRI-UHFFFAOYSA-N 2 0 275.440 2.812 20 10 CFCDRP COc1cccc(C[NH2+]CC2([NH3+])CCCCCC2)c1O ZINC000841042507 631319657 /nfs/dbraw/zinc/31/96/57/631319657.db2.gz JKDRSLJGXBJHEW-UHFFFAOYSA-N 2 0 278.396 2.542 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000841056924 631324028 /nfs/dbraw/zinc/32/40/28/631324028.db2.gz JZTILQMPQQUNHS-MJICGBHWSA-N 2 0 287.451 2.745 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CC2(C)CC[NH2+]CC2)c1O ZINC000841056055 631324394 /nfs/dbraw/zinc/32/43/94/631324394.db2.gz BEKVBPVWMBYMSA-UHFFFAOYSA-N 2 0 282.815 2.833 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841060670 631325991 /nfs/dbraw/zinc/32/59/91/631325991.db2.gz AQYGRCHVUBGBEW-DOTOQJQBSA-N 2 0 287.451 2.907 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000841058072 631326544 /nfs/dbraw/zinc/32/65/44/631326544.db2.gz OZYJPDPZDPOWDJ-KRWDZBQOSA-N 2 0 287.451 2.909 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1F ZINC000841061885 631327234 /nfs/dbraw/zinc/32/72/34/631327234.db2.gz PLBIBUOWXXSJFO-HIFRSBDPSA-N 2 0 293.430 2.902 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1F ZINC000841062812 631327521 /nfs/dbraw/zinc/32/75/21/631327521.db2.gz CRPOBDRTOMGBRS-CJNGLKHVSA-N 2 0 293.430 2.760 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000841073152 631330901 /nfs/dbraw/zinc/33/09/01/631330901.db2.gz RCMGPPIHUOOVBD-INIZCTEOSA-N 2 0 275.440 2.539 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000841073384 631331189 /nfs/dbraw/zinc/33/11/89/631331189.db2.gz SHFGXCKKKPZKTG-ZNNBYXKUSA-N 2 0 287.451 2.888 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000841077666 631331806 /nfs/dbraw/zinc/33/18/06/631331806.db2.gz AHTMEKYBZJOBJB-PMGBHYCQSA-N 2 0 275.440 2.873 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1c(O)cccc1Cl ZINC000841078916 631333120 /nfs/dbraw/zinc/33/31/20/631333120.db2.gz JSTIBCBYNTYKLR-SNVBAGLBSA-N 2 0 256.777 2.653 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000841088455 631336727 /nfs/dbraw/zinc/33/67/27/631336727.db2.gz WTOIHSSESMPRSD-FUHWJXTLSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@@]1(C)C[NH3+] ZINC000841089767 631337060 /nfs/dbraw/zinc/33/70/60/631337060.db2.gz ABSDAWQXXFYWCW-CDZANEANSA-N 2 0 287.451 2.683 20 10 CFCDRP CCOc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c(O)c1 ZINC000841089958 631337379 /nfs/dbraw/zinc/33/73/79/631337379.db2.gz RZULCWTXXAQVMC-AWEZNQCLSA-N 2 0 290.407 2.555 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)CCC[NH2+]C)cc1 ZINC000841102937 631340545 /nfs/dbraw/zinc/34/05/45/631340545.db2.gz DATPYPZIBKMNNQ-UHFFFAOYSA-N 2 0 263.429 2.574 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000843047056 631813226 /nfs/dbraw/zinc/81/32/26/631813226.db2.gz MRJYIXJJQNAKTL-LFJURXANSA-N 2 0 299.462 2.981 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H](C)[NH3+])cc1C ZINC000843046692 631813376 /nfs/dbraw/zinc/81/33/76/631813376.db2.gz ZEYKELVPJZMMDS-UKRRQHHQSA-N 2 0 262.397 2.711 20 10 CFCDRP C[C@H]([NH3+])C1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000843048827 631814564 /nfs/dbraw/zinc/81/45/64/631814564.db2.gz ZNMDMWNQOWOYTL-XVWMLYKFSA-N 2 0 287.451 2.825 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CC[C@@H]1[NH3+] ZINC000843053132 631817594 /nfs/dbraw/zinc/81/75/94/631817594.db2.gz XQPIYTGNMKBFTE-GWCFXTLKSA-N 2 0 268.788 2.605 20 10 CFCDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843057178 631820013 /nfs/dbraw/zinc/82/00/13/631820013.db2.gz GJHNPHKOVDMGFI-DOTOQJQBSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1O ZINC000843057794 631820358 /nfs/dbraw/zinc/82/03/58/631820358.db2.gz LCHCZVMGLASKRH-MNOVXSKESA-N 2 0 268.788 2.523 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1F ZINC000843057083 631820624 /nfs/dbraw/zinc/82/06/24/631820624.db2.gz GAPDYGNNZQGMAU-HIFRSBDPSA-N 2 0 293.430 2.841 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000843056999 631820656 /nfs/dbraw/zinc/82/06/56/631820656.db2.gz FBIANZYVTWPAPP-GOEBONIOSA-N 2 0 275.440 2.702 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1F ZINC000843057052 631820775 /nfs/dbraw/zinc/82/07/75/631820775.db2.gz FULYQOUAXOLNGW-UKRRQHHQSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c(Cl)c1 ZINC000843059696 631822850 /nfs/dbraw/zinc/82/28/50/631822850.db2.gz PXDMPRQEZGDSRR-ZOWXZIJZSA-N 2 0 294.826 2.913 20 10 CFCDRP [NH3+]CCC[N@@H+](Cc1cc(F)ccc1O)CC1CCCC1 ZINC000843123774 631843934 /nfs/dbraw/zinc/84/39/34/631843934.db2.gz PGNJQVYLNNXNHC-UHFFFAOYSA-N 2 0 280.387 2.872 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000843122789 631843976 /nfs/dbraw/zinc/84/39/76/631843976.db2.gz FCPKSQGKCRLFFX-SFHVURJKSA-N 2 0 287.451 2.637 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1 ZINC000843126061 631845416 /nfs/dbraw/zinc/84/54/16/631845416.db2.gz FQIRXJXNHSFPTF-ARJAWSKDSA-N 2 0 299.462 2.841 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCCCCC[NH3+])c(O)c1 ZINC000843340948 631931539 /nfs/dbraw/zinc/93/15/39/631931539.db2.gz GQJVVMTZFAKZKC-ZDUSSCGKSA-N 2 0 250.386 2.870 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)cc1 ZINC000813877075 631971475 /nfs/dbraw/zinc/97/14/75/631971475.db2.gz JYVUTBUPYSTYBP-GJZGRUSLSA-N 2 0 277.456 2.991 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1 ZINC000815628123 632301862 /nfs/dbraw/zinc/30/18/62/632301862.db2.gz RSLLMVDAKIVUAG-JSGCOSHPSA-N 2 0 264.413 2.857 20 10 CFCDRP [NH3+]CC1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000844900674 632330599 /nfs/dbraw/zinc/33/05/99/632330599.db2.gz CNXYFUKRRGSJNC-UHFFFAOYSA-N 2 0 287.451 2.896 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1 ZINC000844901981 632330666 /nfs/dbraw/zinc/33/06/66/632330666.db2.gz LRBKEKLMKDVXTR-BBRMVZONSA-N 2 0 292.423 2.740 20 10 CFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c(O)c1 ZINC000844903058 632332168 /nfs/dbraw/zinc/33/21/68/632332168.db2.gz ZJTIJMBESWIBFG-BBRMVZONSA-N 2 0 292.423 2.740 20 10 CFCDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816549392 632482100 /nfs/dbraw/zinc/48/21/00/632482100.db2.gz MPOZVGNJTKUYCJ-AWEZNQCLSA-N 2 0 284.403 2.977 20 10 CFCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)C[C@@H]2C1 ZINC000816594319 632491736 /nfs/dbraw/zinc/49/17/36/632491736.db2.gz YPEGXMHWFIFCCT-IYBDPMFKSA-N 2 0 282.387 2.539 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@@H](C)C2)c1O ZINC000846148275 632646724 /nfs/dbraw/zinc/64/67/24/632646724.db2.gz POEUTBWVQKHUOX-RWMBFGLXSA-N 2 0 278.396 2.534 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)cc1C ZINC000817866336 632715730 /nfs/dbraw/zinc/71/57/30/632715730.db2.gz YSGYWFRXIMGSQX-LZWOXQAQSA-N 2 0 276.424 2.814 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000817887701 632717692 /nfs/dbraw/zinc/71/76/92/632717692.db2.gz CHQNICCLLNMQRA-ZIAGYGMSSA-N 2 0 263.429 2.748 20 10 CFCDRP c1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc2c1OCC2 ZINC000817902375 632726160 /nfs/dbraw/zinc/72/61/60/632726160.db2.gz OYVWILSOAGTAMQ-BRWVUGGUSA-N 2 0 286.419 2.632 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000817936303 632741764 /nfs/dbraw/zinc/74/17/64/632741764.db2.gz NMRYDKLDEKWTHE-CYBMUJFWSA-N 2 0 261.413 2.545 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c(O)c1C ZINC000817940761 632744175 /nfs/dbraw/zinc/74/41/75/632744175.db2.gz KOQHVZKCVSETLZ-CYBMUJFWSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH2+]C)c1cc(Cl)ccc1O ZINC000817939590 632744211 /nfs/dbraw/zinc/74/42/11/632744211.db2.gz FLROAXKRYDOHCG-GFCCVEGCSA-N 2 0 256.777 2.696 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)c2c1c(F)ccc2O ZINC000817947098 632749347 /nfs/dbraw/zinc/74/93/47/632749347.db2.gz JYCPKQMXVQHVMG-ZUYNKMSQSA-N 2 0 278.371 2.939 20 10 CFCDRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817953899 632753542 /nfs/dbraw/zinc/75/35/42/632753542.db2.gz WCDOMEXEATZRJQ-IUCAKERBSA-N 2 0 287.201 2.543 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2c1c(F)ccc2O ZINC000817954660 632755097 /nfs/dbraw/zinc/75/50/97/632755097.db2.gz GDNIRELRLHGZQW-NQBHXWOUSA-N 2 0 278.371 2.669 20 10 CFCDRP C[C@H]([NH2+]CC(C)(C)[NH3+])c1cc(Br)ccc1O ZINC000817959988 632758078 /nfs/dbraw/zinc/75/80/78/632758078.db2.gz JRMRRHWCSBFJGG-QMMMGPOBSA-N 2 0 287.201 2.543 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c(O)c1 ZINC000817960732 632758951 /nfs/dbraw/zinc/75/89/51/632758951.db2.gz QRIYPDSORRSPKF-KCQAQPDRSA-N 2 0 262.397 2.869 20 10 CFCDRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000817963276 632761945 /nfs/dbraw/zinc/76/19/45/632761945.db2.gz SYXIEHUDKDUFFB-VXGBXAGGSA-N 2 0 262.397 2.516 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(O)c1 ZINC000817968489 632767112 /nfs/dbraw/zinc/76/71/12/632767112.db2.gz KEKZRAYEHMUYRH-UONOGXRCSA-N 2 0 262.397 2.802 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000817968898 632767499 /nfs/dbraw/zinc/76/74/99/632767499.db2.gz XQXSEBVFMQYJIS-CQSZACIVSA-N 2 0 273.424 2.713 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(C)cc1O ZINC000817969072 632767508 /nfs/dbraw/zinc/76/75/08/632767508.db2.gz QQNPUUZKISJSOK-ZFWWWQNUSA-N 2 0 262.397 2.883 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(C)cc1O ZINC000817969070 632767546 /nfs/dbraw/zinc/76/75/46/632767546.db2.gz QQNPUUZKISJSOK-HIFRSBDPSA-N 2 0 262.397 2.883 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(O)c1C ZINC000817969925 632768934 /nfs/dbraw/zinc/76/89/34/632768934.db2.gz IICXXGRWWRSVOQ-MJBXVCDLSA-N 2 0 262.397 2.930 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000817976440 632774125 /nfs/dbraw/zinc/77/41/25/632774125.db2.gz XWUVHWMLEXCOMN-ZIAGYGMSSA-N 2 0 263.429 2.921 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccccc1O ZINC000817976190 632774336 /nfs/dbraw/zinc/77/43/36/632774336.db2.gz HSZJSOQTOBZVIY-DZGCQCFKSA-N 2 0 260.381 2.575 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000817978997 632776378 /nfs/dbraw/zinc/77/63/78/632776378.db2.gz GHJJQXXGHYVDDQ-GXSJLCMTSA-N 2 0 256.777 2.742 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(C)cc1O ZINC000817981472 632777824 /nfs/dbraw/zinc/77/78/24/632777824.db2.gz KSJHYSPZMVVVDJ-GUTXKFCHSA-N 2 0 262.397 2.869 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000817987137 632782027 /nfs/dbraw/zinc/78/20/27/632782027.db2.gz WOOUPFUVMYNYDU-STQMWFEESA-N 2 0 290.407 2.726 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000818614877 632879402 /nfs/dbraw/zinc/87/94/02/632879402.db2.gz IDLKMFFXVONLCW-OJAKKHQRSA-N 2 0 278.371 2.939 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CCCN3CCCC[C@H]23)cc1 ZINC000848574342 633294038 /nfs/dbraw/zinc/29/40/38/633294038.db2.gz CQRGGKSDTGIVAP-ZWKOTPCHSA-N 2 0 287.451 2.859 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000848721411 633324325 /nfs/dbraw/zinc/32/43/25/633324325.db2.gz COOKPYBXJMGQJA-USXIJHARSA-N 2 0 289.467 2.852 20 10 CFCDRP Oc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093918 634902652 /nfs/dbraw/zinc/90/26/52/634902652.db2.gz UINGUJWTHBONNT-HNNXBMFYSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2([NH3+])CCCC2)c(O)c1 ZINC000854221930 635262569 /nfs/dbraw/zinc/26/25/69/635262569.db2.gz BATCMBNRJLTSJU-CYBMUJFWSA-N 2 0 262.397 2.931 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000858088513 636121545 /nfs/dbraw/zinc/12/15/45/636121545.db2.gz HMJZCKLTYABKHZ-OAHLLOKOSA-N 2 0 275.440 2.715 20 10 CFCDRP C[C@@H]([NH2+]CCOCCC[NH3+])c1ccc2ccccc2c1O ZINC000863544879 637691589 /nfs/dbraw/zinc/69/15/89/637691589.db2.gz DLURBTFMUYXEPV-CYBMUJFWSA-N 2 0 288.391 2.561 20 10 CFCDRP COc1cccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1O ZINC000865766047 638562640 /nfs/dbraw/zinc/56/26/40/638562640.db2.gz YUACHJPLAJFUFJ-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1O ZINC000873265809 642108963 /nfs/dbraw/zinc/10/89/63/642108963.db2.gz XYMVADNQGYIVSH-HLPPOEQASA-N 2 0 274.408 2.964 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000877477383 643294738 /nfs/dbraw/zinc/29/47/38/643294738.db2.gz CCLHQOCHBKRFSC-YOEHRIQHSA-N 2 0 275.440 2.844 20 10 CFCDRP Cc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(O)c1 ZINC000877517552 643323123 /nfs/dbraw/zinc/32/31/23/643323123.db2.gz NTKHHUBEAGTUIQ-XYPWUTKMSA-N 2 0 274.408 2.758 20 10 CFCDRP Cc1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000877528618 643332031 /nfs/dbraw/zinc/33/20/31/643332031.db2.gz FYQYVWTUINDVCF-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1ccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c(O)c1 ZINC000877533184 643336434 /nfs/dbraw/zinc/33/64/34/643336434.db2.gz ZZCFBEYLABGWIT-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c(O)c1 ZINC000877552111 643352480 /nfs/dbraw/zinc/35/24/80/643352480.db2.gz QNUITXFKDLIITH-QGZVFWFLSA-N 2 0 274.408 2.618 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000877653404 643433277 /nfs/dbraw/zinc/43/32/77/643433277.db2.gz JKQWNBUKODXIAP-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@H]1[NH3+] ZINC000252507182 651009662 /nfs/dbraw/zinc/00/96/62/651009662.db2.gz ZOCTVEPQTDJNGK-ZWNOBZJWSA-N 2 0 268.788 2.605 20 10 CFCDRP CC[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883291017 645724662 /nfs/dbraw/zinc/72/46/62/645724662.db2.gz PMKUITDOJSXFQZ-SJLPKXTDSA-N 2 0 287.451 2.717 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]CCCSc2nccs2)[C@H](C)C1 ZINC000132196094 645890655 /nfs/dbraw/zinc/89/06/55/645890655.db2.gz QQVJSKACPYJWDR-OLZOCXBDSA-N 2 0 299.509 2.945 20 10 CFCDRP CC[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(C)cc1O ZINC000925737379 648304806 /nfs/dbraw/zinc/30/48/06/648304806.db2.gz HWRPBNWPVCWWAL-ZDUSSCGKSA-N 2 0 250.386 2.869 20 10 CFCDRP CC[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(N(C)C)cc1 ZINC000925742508 648306465 /nfs/dbraw/zinc/30/64/65/648306465.db2.gz UYOXXFOEEZVVBX-HNNXBMFYSA-N 2 0 263.429 2.921 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]2CC[NH3+])c(Cl)c1 ZINC001235925485 778611841 /nfs/dbraw/zinc/61/18/41/778611841.db2.gz QJNADDQVGBJEEB-ZDUSSCGKSA-N 2 0 281.831 2.719 20 10 CFCDRP [NH3+]CC1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001205053072 780634601 /nfs/dbraw/zinc/63/46/01/780634601.db2.gz JEHJSDHOYKIIIC-UHFFFAOYSA-N 2 0 270.376 2.716 20 10 CFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(Cl)cc1O)CC2 ZINC001140465213 770683589 /nfs/dbraw/zinc/68/35/89/770683589.db2.gz ILXOEMVMRAOEQF-UHFFFAOYSA-N 2 0 280.799 2.573 20 10 CFCDRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3c(C)cc(C)cc3O)C[C@@H]2C1 ZINC001231851075 777350254 /nfs/dbraw/zinc/35/02/54/777350254.db2.gz ZDDQNONTRGJVFC-IYBDPMFKSA-N 2 0 288.435 2.783 20 10 CFCDRP C[NH+]1CCC2(CC[N@H+](Cc3cccc(Cl)c3[O-])C2)CC1 ZINC001231912250 777381778 /nfs/dbraw/zinc/38/17/78/777381778.db2.gz BBABFTXXIKRKLJ-UHFFFAOYSA-N 2 0 294.826 2.963 20 10 CFCDRP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235030418 778360937 /nfs/dbraw/zinc/36/09/37/778360937.db2.gz APBDQOWXCRVPNH-GOSISDBHSA-N 2 0 288.435 2.875 20 10 CFCDRP C[NH2+]CC1CC[NH+](Cc2c(C)n(C)c3ccccc32)CC1 ZINC001235677501 778534385 /nfs/dbraw/zinc/53/43/85/778534385.db2.gz HVSMTMFYDCSCEB-UHFFFAOYSA-N 2 0 285.435 2.918 20 10 CFCDRP Cc1c(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c2ccccc2n1C ZINC001235951747 778623768 /nfs/dbraw/zinc/62/37/68/778623768.db2.gz SCLSJNDPHBORQQ-OAHLLOKOSA-N 2 0 285.435 2.918 20 10 CFCDRP CCC(CC)[N@H+](CC)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235963468 778631082 /nfs/dbraw/zinc/63/10/82/778631082.db2.gz UQEFJGDOTQAFBJ-UHFFFAOYSA-N 2 0 292.423 2.885 20 10 CFCDRP Oc1ccc(F)c(Cl)c1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321985 778779431 /nfs/dbraw/zinc/77/94/31/778779431.db2.gz ZEUJYNANEQLFTM-PHIMTYICSA-N 2 0 298.789 2.616 20 10 CFCDRP CCc1ccc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC001236782468 778933795 /nfs/dbraw/zinc/93/37/95/778933795.db2.gz BLLQMFYQMDJHCJ-UHFFFAOYSA-N 2 0 297.402 2.672 20 10 CFCDRP CCc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c(O)c1 ZINC001236793586 778939587 /nfs/dbraw/zinc/93/95/87/778939587.db2.gz ZGLCMDHQZFXNSI-UHFFFAOYSA-N 2 0 288.435 2.872 20 10 CFCDRP CC[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236934067 778982960 /nfs/dbraw/zinc/98/29/60/778982960.db2.gz CEDFFEMAWQONRB-CQSZACIVSA-N 2 0 293.430 2.808 20 10 CFCDRP CCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237417068 779103607 /nfs/dbraw/zinc/10/36/07/779103607.db2.gz RZSDRTKOTCVIJE-GDBMZVCRSA-N 2 0 274.408 2.529 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c1O ZINC001237679003 779159740 /nfs/dbraw/zinc/15/97/40/779159740.db2.gz DQNIMJMYXQZSDQ-OCCSQVGLSA-N 2 0 294.826 2.738 20 10 CFCDRP CCC[N@H+]1C[C@H]2CN(Cc3cc(F)cc(C)c3O)C[C@H]2C1 ZINC001238064455 779242796 /nfs/dbraw/zinc/24/27/96/779242796.db2.gz COMHRIMUXWKIBR-GASCZTMLSA-N 2 0 292.398 2.613 20 10 CFCDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000700811332 780725292 /nfs/dbraw/zinc/72/52/92/780725292.db2.gz BVVNCYHHNUGHAO-UKRRQHHQSA-N 2 0 274.408 2.701 20 10 CFCDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000045664003 296121695 /nfs/dbraw/zinc/12/16/95/296121695.db2.gz OZGQOKBPDIKTQU-CQSZACIVSA-N 2 0 263.429 2.745 20 10 CFCDRP Cc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1O ZINC000180392442 380651419 /nfs/dbraw/zinc/65/14/19/380651419.db2.gz IEOIYIHMLZOREE-OAHLLOKOSA-N 2 0 274.408 2.618 20 10 CFCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)c(F)c1[O-] ZINC000296642419 381485885 /nfs/dbraw/zinc/48/58/85/381485885.db2.gz YDWXOYNVWLKFMI-WAAKLRNESA-N 2 0 296.361 2.946 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 ZINC000185672460 381699331 /nfs/dbraw/zinc/69/93/31/381699331.db2.gz CYJZYHSHYBENRF-BFHYXJOUSA-N 2 0 274.408 2.976 20 10 CFCDRP C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1cc(F)ccc1O ZINC000185672752 381699517 /nfs/dbraw/zinc/69/95/17/381699517.db2.gz SZWNYUYLTWINGZ-GMXVVIOVSA-N 2 0 278.371 2.807 20 10 CFCDRP C[C@H]1CCC[N@@H+]1C1CCN(Cc2cccc(F)c2O)CC1 ZINC000378493349 382472684 /nfs/dbraw/zinc/47/26/84/382472684.db2.gz IOUXPQAOZSAOCW-ZDUSSCGKSA-N 2 0 292.398 2.980 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC000367316995 382563744 /nfs/dbraw/zinc/56/37/44/382563744.db2.gz GTHOSEVVDZIEBN-ZIAGYGMSSA-N 2 0 292.423 2.878 20 10 CFCDRP CCOc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1O ZINC000252668468 383425992 /nfs/dbraw/zinc/42/59/92/383425992.db2.gz XJIJLGKWBLYTIB-CABCVRRESA-N 2 0 290.407 2.507 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CC2 ZINC000296031222 285396901 /nfs/dbraw/zinc/39/69/01/285396901.db2.gz QCGYXQXYCHPWMU-INIZCTEOSA-N 2 0 286.419 2.844 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000096543567 393838866 /nfs/dbraw/zinc/83/88/66/393838866.db2.gz NFUMAIJNEOEWBD-GFCCVEGCSA-N 2 0 280.412 2.639 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC000277421385 394056296 /nfs/dbraw/zinc/05/62/96/394056296.db2.gz JAZFOJUEUUCSKX-OAHLLOKOSA-N 2 0 262.397 2.617 20 10 CFCDRP CCC[NH+]1CCC([NH2+]Cc2cc(C)ccc2O)CC1 ZINC000071406742 176156356 /nfs/dbraw/zinc/15/63/56/176156356.db2.gz ULKBRWBLSZJIDY-UHFFFAOYSA-N 2 0 262.397 2.665 20 10 CFCDRP CC(C)(C[NH2+]Cc1cc(F)ccc1O)C[NH+]1CCCC1 ZINC000276801849 519269433 /nfs/dbraw/zinc/26/94/33/519269433.db2.gz MQWWCSWJCMITKE-UHFFFAOYSA-N 2 0 280.387 2.743 20 10 CFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](CC)c1ccccc1O ZINC000156290935 520503577 /nfs/dbraw/zinc/50/35/77/520503577.db2.gz NODQQYWVZOGZEE-ZBFHGGJFSA-N 2 0 294.439 2.790 20 10 CFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccccc1O ZINC000289466205 521012331 /nfs/dbraw/zinc/01/23/31/521012331.db2.gz OXYPBLVRQWWHGT-UHFFFAOYSA-N 2 0 262.397 2.700 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000292855652 522178959 /nfs/dbraw/zinc/17/89/59/522178959.db2.gz CEFBASFCLZDPID-SFHVURJKSA-N 2 0 287.451 2.670 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccccc1O ZINC000049553309 522734174 /nfs/dbraw/zinc/73/41/74/522734174.db2.gz MUPSZENNNWUWFW-OCCSQVGLSA-N 2 0 250.386 2.773 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1 ZINC000230672017 524768018 /nfs/dbraw/zinc/76/80/18/524768018.db2.gz DGHVQBGMSXWPPY-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1C ZINC000277413076 525314538 /nfs/dbraw/zinc/31/45/38/525314538.db2.gz IOGDMYBCWPCSHO-INIZCTEOSA-N 2 0 276.424 2.925 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1 ZINC000293613917 525729037 /nfs/dbraw/zinc/72/90/37/525729037.db2.gz JHNAXOJDXNTMSI-CHWSQXEVSA-N 2 0 250.386 2.549 20 10 CFCDRP CCOc1cccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1O ZINC000040621422 617636960 /nfs/dbraw/zinc/63/69/60/617636960.db2.gz ULOIZHPMPLDUQN-CQSZACIVSA-N 2 0 292.423 2.611 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)C[NH+](C)C)cc1 ZINC000312445184 618281875 /nfs/dbraw/zinc/28/18/75/618281875.db2.gz CNCPKHHNWYUTQB-OAHLLOKOSA-N 2 0 277.456 2.820 20 10 CFCDRP CN(C)c1ccc(C[N@H+](CC2CC[NH2+]CC2)C2CC2)cc1 ZINC000094021733 619072912 /nfs/dbraw/zinc/07/29/12/619072912.db2.gz FKGVNBWSYXNEQQ-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925781362 619103627 /nfs/dbraw/zinc/10/36/27/619103627.db2.gz YHCCCRBNPCLDSR-GXTWGEPZSA-N 2 0 297.393 2.648 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccccc1O ZINC000925787225 619112106 /nfs/dbraw/zinc/11/21/06/619112106.db2.gz ZGQUAXDETOTFFZ-YPMHNXCESA-N 2 0 284.350 2.678 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(N(C)C)cc1 ZINC000925792147 619117416 /nfs/dbraw/zinc/11/74/16/619117416.db2.gz UIOGZKMZFNETQI-UKPHBRMFSA-N 2 0 275.440 2.649 20 10 CFCDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccccc1O ZINC000925847061 619179718 /nfs/dbraw/zinc/17/97/18/619179718.db2.gz RWYPIPQHITVBDM-APHBMKBZSA-N 2 0 260.381 2.575 20 10 CFCDRP CCN1CCC[C@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC000035052657 620069832 /nfs/dbraw/zinc/06/98/32/620069832.db2.gz MJNJNHZDFBRUJG-HNNXBMFYSA-N 2 0 262.397 2.578 20 10 CFCDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000841058669 620423225 /nfs/dbraw/zinc/42/32/25/620423225.db2.gz VBHWYNHQYKTRSB-RKDXNWHRSA-N 2 0 272.751 2.544 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000841062045 620424337 /nfs/dbraw/zinc/42/43/37/620424337.db2.gz RNPCSRWYOBWPRJ-GDBMZVCRSA-N 2 0 275.440 2.763 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1O ZINC000841072989 621025230 /nfs/dbraw/zinc/02/52/30/621025230.db2.gz OLUNMVIIJXKBET-ZDUSSCGKSA-N 2 0 298.814 2.676 20 10 CFCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Br)cc1O ZINC000902487378 621112656 /nfs/dbraw/zinc/11/26/56/621112656.db2.gz UFJOPOFUEOIFDU-FXPVBKGRSA-N 2 0 299.212 2.543 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)c1O ZINC000903959721 621480402 /nfs/dbraw/zinc/48/04/02/621480402.db2.gz MZHWELCTZKAFOQ-KRWDZBQOSA-N 2 0 274.408 2.666 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(Cl)c1 ZINC000903978609 621494138 /nfs/dbraw/zinc/49/41/38/621494138.db2.gz HUFDWZKPLSDRCV-VXGBXAGGSA-N 2 0 282.815 2.689 20 10 CFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@]1(C)CCC[NH2+]C1 ZINC000904301970 621568668 /nfs/dbraw/zinc/56/86/68/621568668.db2.gz QQZLQFKJKMVOSQ-GOSISDBHSA-N 2 0 289.467 2.964 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000904355348 621581764 /nfs/dbraw/zinc/58/17/64/621581764.db2.gz QHLKRRQTBFBZCZ-SHTZXODSSA-N 2 0 288.435 2.866 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)c(Cl)c1 ZINC000904412027 621593535 /nfs/dbraw/zinc/59/35/35/621593535.db2.gz ZTWHAHXQPCFMLS-NEPJUHHUSA-N 2 0 282.815 2.771 20 10 CFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1 ZINC000150195071 622434413 /nfs/dbraw/zinc/43/44/13/622434413.db2.gz ZEIMHXYIFCGFFL-UHFFFAOYSA-N 2 0 269.392 2.501 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000044534818 622918367 /nfs/dbraw/zinc/91/83/67/622918367.db2.gz BQGJYDUWDJBZSE-HIFRSBDPSA-N 2 0 262.397 2.775 20 10 CFCDRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1O ZINC000044515484 622918389 /nfs/dbraw/zinc/91/83/89/622918389.db2.gz PVVQHXJUNIDXIR-HNNXBMFYSA-N 2 0 262.397 2.775 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000044534189 622918589 /nfs/dbraw/zinc/91/85/89/622918589.db2.gz YSAMYUWTTOGDLH-KGLIPLIRSA-N 2 0 262.397 2.693 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC2=CC[N@H+](C)CC2)cc1Cl ZINC000825406273 623688165 /nfs/dbraw/zinc/68/81/65/623688165.db2.gz QJDYJHQDOUKPGL-UHFFFAOYSA-N 2 0 280.799 2.706 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000827948597 624136328 /nfs/dbraw/zinc/13/63/28/624136328.db2.gz HWMAHMYFGHRDCE-CQSZACIVSA-N 2 0 292.398 2.743 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c1O ZINC000817963338 625965491 /nfs/dbraw/zinc/96/54/91/625965491.db2.gz UGUZFDMRRLWSPN-WPRPVWTQSA-N 2 0 256.777 2.599 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)CC[N@@H+]1C ZINC000921779664 626120403 /nfs/dbraw/zinc/12/04/03/626120403.db2.gz KTPFLKPUSZWPFV-XJKSGUPXSA-N 2 0 274.408 2.584 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)ccc1N(C)C ZINC000923357125 626468533 /nfs/dbraw/zinc/46/85/33/626468533.db2.gz WPVIKJKFDJZWDF-GOSISDBHSA-N 2 0 287.451 2.637 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000839180395 626529702 /nfs/dbraw/zinc/52/97/02/626529702.db2.gz CTCCDBADQUQYAS-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1 ZINC000839182385 626529879 /nfs/dbraw/zinc/52/98/79/626529879.db2.gz MWIYEQJSBAWPBQ-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771830417 627635503 /nfs/dbraw/zinc/63/55/03/627635503.db2.gz QVCNOKOTAUQEBD-CRAIPNDOSA-N 2 0 287.451 2.717 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC3CCC3)cc2)CC1 ZINC000771843511 627636810 /nfs/dbraw/zinc/63/68/10/627636810.db2.gz QJKGAHZPWVTRIE-UHFFFAOYSA-N 2 0 287.451 2.718 20 10 CFCDRP CC[C@H](C)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775653848 628050100 /nfs/dbraw/zinc/05/01/00/628050100.db2.gz DIOOAVLEVMNJDV-INIZCTEOSA-N 2 0 289.467 2.916 20 10 CFCDRP C[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775715806 628058934 /nfs/dbraw/zinc/05/89/34/628058934.db2.gz LORMGGQJBLPHIL-JKSUJKDBSA-N 2 0 287.451 2.669 20 10 CFCDRP CC(C)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775790661 628069088 /nfs/dbraw/zinc/06/90/88/628069088.db2.gz AUOUZNOAZBWRNP-HNNXBMFYSA-N 2 0 275.440 2.573 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CC(C)(C)C[NH+](C)C)cc1 ZINC000835034220 629328044 /nfs/dbraw/zinc/32/80/44/629328044.db2.gz PSIAHWVVPMLWHO-FPLPWBNLSA-N 2 0 289.467 2.943 20 10 CFCDRP C[C@@H]([NH3+])C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000110644142 634765541 /nfs/dbraw/zinc/76/55/41/634765541.db2.gz KPRAXEQVKYPTEN-SNVBAGLBSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1ccc(O)c(C[N@H+](C)CCC[NH+]2CCCC2)c1 ZINC000798958303 630263827 /nfs/dbraw/zinc/26/38/27/630263827.db2.gz UARFLSZWHAMPEY-UHFFFAOYSA-N 2 0 262.397 2.618 20 10 CFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000040620688 649985615 /nfs/dbraw/zinc/98/56/15/649985615.db2.gz VDQJEGGBRLSFHL-INIZCTEOSA-N 2 0 275.440 2.573 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000840941822 631273448 /nfs/dbraw/zinc/27/34/48/631273448.db2.gz MYLOKVZFOZBOCV-KRWDZBQOSA-N 2 0 289.467 2.977 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000840951238 631278966 /nfs/dbraw/zinc/27/89/66/631278966.db2.gz YUEOBEOCVXLMAF-SFHVURJKSA-N 2 0 287.451 2.589 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]([NH3+])CC(C)C ZINC000841007267 631303956 /nfs/dbraw/zinc/30/39/56/631303956.db2.gz NXOAIHYULRAHHO-OAHLLOKOSA-N 2 0 264.413 2.978 20 10 CFCDRP Oc1ccc(F)cc1CNCC[NH2+]C1CCCCCC1 ZINC000841028331 631309176 /nfs/dbraw/zinc/30/91/76/631309176.db2.gz OUBBGIGVXIQKSO-UHFFFAOYSA-N 2 0 280.387 2.933 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CCC[NH2+]CC2)c1O ZINC000841057770 631323990 /nfs/dbraw/zinc/32/39/90/631323990.db2.gz NIZKMWUGDINBTA-ZDUSSCGKSA-N 2 0 268.788 2.586 20 10 CFCDRP CC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]CC1 ZINC000841063267 631327982 /nfs/dbraw/zinc/32/79/82/631327982.db2.gz HMXPIWGUBBIZMF-UHFFFAOYSA-N 2 0 287.451 2.909 20 10 CFCDRP COc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1C ZINC000841072105 631330265 /nfs/dbraw/zinc/33/02/65/631330265.db2.gz GOWDTFLVVBXZGM-OAHLLOKOSA-N 2 0 262.397 2.625 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000841073381 631330327 /nfs/dbraw/zinc/33/03/27/631330327.db2.gz SHFGXCKKKPZKTG-GPCFVJJQSA-N 2 0 287.451 2.888 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1O ZINC000841073363 631330810 /nfs/dbraw/zinc/33/08/10/631330810.db2.gz RVSLKBCXWMUNML-AWEZNQCLSA-N 2 0 282.815 2.976 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000841082386 631334242 /nfs/dbraw/zinc/33/42/42/631334242.db2.gz ISVYFNVRWWJDKZ-HDJSIYSDSA-N 2 0 262.397 2.555 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000841088454 631337444 /nfs/dbraw/zinc/33/74/44/631337444.db2.gz WTOIHSSESMPRSD-AEFFLSMTSA-N 2 0 287.451 2.717 20 10 CFCDRP CCC[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1O ZINC000842471841 631639662 /nfs/dbraw/zinc/63/96/62/631639662.db2.gz COKPPDMLRMKFIR-AWEZNQCLSA-N 2 0 262.397 2.604 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCCCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000843045059 631811336 /nfs/dbraw/zinc/81/13/36/631811336.db2.gz HFVUKXHGESDZJO-XDWWLABZSA-N 2 0 287.451 2.968 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1C ZINC000843046099 631813245 /nfs/dbraw/zinc/81/32/45/631813245.db2.gz NKAAMGLMVMGFEI-QGZVFWFLSA-N 2 0 288.435 2.973 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2C)CC[C@H]1[NH3+] ZINC000843050785 631814625 /nfs/dbraw/zinc/81/46/25/631814625.db2.gz PHHJIQJKZJFMGC-RHSMWYFYSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c1O ZINC000843048622 631814656 /nfs/dbraw/zinc/81/46/56/631814656.db2.gz LJODPOYNRNRVHJ-NSHDSACASA-N 2 0 282.815 2.913 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2cc(C)c(C)cc2O)CC[C@H]1[NH3+] ZINC000843051314 631814698 /nfs/dbraw/zinc/81/46/98/631814698.db2.gz CXXFJWXYKLOHNU-DZGCQCFKSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000843048770 631814985 /nfs/dbraw/zinc/81/49/85/631814985.db2.gz XFLIJFODOPNHCA-CQSZACIVSA-N 2 0 275.440 2.620 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000843056998 631819979 /nfs/dbraw/zinc/81/99/79/631819979.db2.gz FBIANZYVTWPAPP-GDBMZVCRSA-N 2 0 275.440 2.702 20 10 CFCDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000843057184 631820612 /nfs/dbraw/zinc/82/06/12/631820612.db2.gz GJHNPHKOVDMGFI-WBVHZDCISA-N 2 0 287.451 2.846 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1F ZINC000843057084 631820758 /nfs/dbraw/zinc/82/07/58/631820758.db2.gz GAPDYGNNZQGMAU-UKRRQHHQSA-N 2 0 293.430 2.841 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000843060233 631823470 /nfs/dbraw/zinc/82/34/70/631823470.db2.gz YLITUSGMFGAFPG-ZOPGNSJXSA-N 2 0 299.462 2.825 20 10 CFCDRP CCC[N@H+](Cc1ccccc1O)C[C@@]1(C)CC[NH2+]C1 ZINC000843060978 631823726 /nfs/dbraw/zinc/82/37/26/631823726.db2.gz VHFVMNIWAIDRBX-INIZCTEOSA-N 2 0 262.397 2.604 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c1O ZINC000843112571 631839045 /nfs/dbraw/zinc/83/90/45/631839045.db2.gz HRVAIIIGBCOEEV-GFCCVEGCSA-N 2 0 282.815 2.915 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000843116880 631840165 /nfs/dbraw/zinc/84/01/65/631840165.db2.gz NBBYWEVQDLBPBO-KRWDZBQOSA-N 2 0 275.440 2.704 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000843120336 631841266 /nfs/dbraw/zinc/84/12/66/631841266.db2.gz FTTSMDLOABHKLI-LJQANCHMSA-N 2 0 299.462 2.862 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1F ZINC000843125392 631845472 /nfs/dbraw/zinc/84/54/72/631845472.db2.gz VDBHTZIBQZSWGJ-UHFFFAOYSA-N 2 0 279.403 2.593 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCCCCC[NH3+])c1 ZINC000843340668 631931408 /nfs/dbraw/zinc/93/14/08/631931408.db2.gz DIQBGQMEETYEGB-CYBMUJFWSA-N 2 0 250.386 2.870 20 10 CFCDRP [NH3+]Cc1ccc2c(c1)CCCN2CCC[NH+]1CCCCC1 ZINC000843349781 631934822 /nfs/dbraw/zinc/93/48/22/631934822.db2.gz CABJQJHYCGVEOY-UHFFFAOYSA-N 2 0 287.451 2.774 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c(O)c1 ZINC000815628122 632301633 /nfs/dbraw/zinc/30/16/33/632301633.db2.gz RSLLMVDAKIVUAG-GXTWGEPZSA-N 2 0 264.413 2.857 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC(CC[NH3+])CC2)cc1C ZINC000844912413 632334643 /nfs/dbraw/zinc/33/46/43/632334643.db2.gz UKUJJRXKPPMKBD-UHFFFAOYSA-N 2 0 262.397 2.570 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)c(O)c1C ZINC000844920870 632336428 /nfs/dbraw/zinc/33/64/28/632336428.db2.gz NSKDIQUUWGPCAP-ZDUSSCGKSA-N 2 0 262.397 2.789 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C2CCC([NH+](C)C)CC2)cc1C ZINC000817416263 632626511 /nfs/dbraw/zinc/62/65/11/632626511.db2.gz WYIGVUJUHDPPHC-UHFFFAOYSA-N 2 0 276.424 2.971 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1O ZINC000846140897 632645053 /nfs/dbraw/zinc/64/50/53/632645053.db2.gz IHFIYYDYCLZNLU-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000846175986 632654038 /nfs/dbraw/zinc/65/40/38/632654038.db2.gz AXSGDGDUUAFTNJ-OAHLLOKOSA-N 2 0 276.424 2.947 20 10 CFCDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000817896991 632720483 /nfs/dbraw/zinc/72/04/83/632720483.db2.gz BBBLMARVXDHCMJ-CABCVRRESA-N 2 0 275.440 2.892 20 10 CFCDRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817939750 632743729 /nfs/dbraw/zinc/74/37/29/632743729.db2.gz BOZOTVDEUYHYNA-JTQLQIEISA-N 2 0 268.788 2.696 20 10 CFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N(C)C)cc1 ZINC000817945642 632747045 /nfs/dbraw/zinc/74/70/45/632747045.db2.gz IQMKQQFXISBBIU-NTQSIJHJSA-N 2 0 273.424 2.686 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000817946554 632748203 /nfs/dbraw/zinc/74/82/03/632748203.db2.gz ZBCGOYIHMVRCRH-HUUCEWRRSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccccc1O ZINC000817947799 632749393 /nfs/dbraw/zinc/74/93/93/632749393.db2.gz RHLCMFPDZQGEOI-YDHLFZDLSA-N 2 0 262.397 2.821 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817947802 632749503 /nfs/dbraw/zinc/74/95/03/632749503.db2.gz RPESSGDBNMBFIF-DZKIICNBSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)ccc1O ZINC000817949947 632750322 /nfs/dbraw/zinc/75/03/22/632750322.db2.gz UTGHRWQUEDEJEB-GFCCVEGCSA-N 2 0 288.366 2.883 20 10 CFCDRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817953482 632753632 /nfs/dbraw/zinc/75/36/32/632753632.db2.gz PQFNTBGORYXYPT-RYUDHWBXSA-N 2 0 258.365 2.933 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]([NH3+])C(C)C)c1O ZINC000817958931 632756688 /nfs/dbraw/zinc/75/66/88/632756688.db2.gz MZZPPRMWKKPEJQ-GWCFXTLKSA-N 2 0 270.804 2.988 20 10 CFCDRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964759 632762812 /nfs/dbraw/zinc/76/28/12/632762812.db2.gz HBTSFYFUVNTLHQ-CYBMUJFWSA-N 2 0 291.414 2.686 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000817965049 632763239 /nfs/dbraw/zinc/76/32/39/632763239.db2.gz OBYBLLNJGOYZSJ-CYBMUJFWSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CC2([NH3+])CCC2)c1O ZINC000817965364 632763841 /nfs/dbraw/zinc/76/38/41/632763841.db2.gz SUXACSXYVZEZJE-JTQLQIEISA-N 2 0 268.788 2.886 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c(O)c1C ZINC000817967721 632766143 /nfs/dbraw/zinc/76/61/43/632766143.db2.gz LHTFRDUVQJDPRM-CYBMUJFWSA-N 2 0 260.381 2.579 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC000817967818 632766345 /nfs/dbraw/zinc/76/63/45/632766345.db2.gz CHEFVWMZWYFYGT-LBPRGKRZSA-N 2 0 298.386 2.855 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c(O)c1 ZINC000817966851 632766710 /nfs/dbraw/zinc/76/67/10/632766710.db2.gz XAQKDFLXECYISC-BBRMVZONSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(O)c1 ZINC000817968488 632767630 /nfs/dbraw/zinc/76/76/30/632767630.db2.gz KEKZRAYEHMUYRH-KGLIPLIRSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000817970431 632768883 /nfs/dbraw/zinc/76/88/83/632768883.db2.gz VFRRDWBDRMEKGY-AEGPPILISA-N 2 0 261.413 2.673 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c(O)c1 ZINC000817971400 632770685 /nfs/dbraw/zinc/77/06/85/632770685.db2.gz LWMWJISQEAZFSK-IHRRRGAJSA-N 2 0 262.397 2.800 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000817972417 632772389 /nfs/dbraw/zinc/77/23/89/632772389.db2.gz XATXSYMXMCAXDM-IIYDPXPESA-N 2 0 288.435 2.920 20 10 CFCDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000817974518 632773042 /nfs/dbraw/zinc/77/30/42/632773042.db2.gz BVRKKZLXJOFFIJ-UMVBOHGHSA-N 2 0 274.408 2.734 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000817975690 632773431 /nfs/dbraw/zinc/77/34/31/632773431.db2.gz PVSYBOCWHDQDKZ-IHRRRGAJSA-N 2 0 292.423 2.817 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(N(C)C)cc1 ZINC000817977273 632775305 /nfs/dbraw/zinc/77/53/05/632775305.db2.gz FZBSWOVBEWQXKA-CJNGLKHVSA-N 2 0 263.429 2.921 20 10 CFCDRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(C)cc1O ZINC000817978168 632776090 /nfs/dbraw/zinc/77/60/90/632776090.db2.gz XUFYZVXOOIJHRV-JSGCOSHPSA-N 2 0 250.386 2.869 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000846698999 632777462 /nfs/dbraw/zinc/77/74/62/632777462.db2.gz OCZHUXKCRNRLKB-ZBFHGGJFSA-N 2 0 275.440 2.844 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(N(C)C)cc1 ZINC000817983382 632779608 /nfs/dbraw/zinc/77/96/08/632779608.db2.gz BEFMJLRLXUKWRW-KRWDZBQOSA-N 2 0 275.440 2.935 20 10 CFCDRP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1cc(Cl)ccc1O ZINC000817984271 632781251 /nfs/dbraw/zinc/78/12/51/632781251.db2.gz PPDBSHIRIBAYOG-JTQLQIEISA-N 2 0 268.788 2.838 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000848721410 633324834 /nfs/dbraw/zinc/32/48/34/633324834.db2.gz COOKPYBXJMGQJA-UAGQMJEPSA-N 2 0 289.467 2.852 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000853247331 634950160 /nfs/dbraw/zinc/95/01/60/634950160.db2.gz LXXXPMNCJMVYEW-LLVKDONJSA-N 2 0 274.767 2.648 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1cc(Cl)ccc1O ZINC000854222049 635262511 /nfs/dbraw/zinc/26/25/11/635262511.db2.gz BXYOPAFBZPSUQL-JTQLQIEISA-N 2 0 268.788 2.968 20 10 CFCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1F ZINC000858246028 636162551 /nfs/dbraw/zinc/16/25/51/636162551.db2.gz RNAWQLBIUYCTFR-HNNXBMFYSA-N 2 0 293.430 2.713 20 10 CFCDRP Cc1cc(O)c(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1C ZINC000858245602 636162586 /nfs/dbraw/zinc/16/25/86/636162586.db2.gz KHTCFQYSGHIULB-OAHLLOKOSA-N 2 0 276.424 2.831 20 10 CFCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000865723821 638536987 /nfs/dbraw/zinc/53/69/87/638536987.db2.gz BFLWYMZNNSTASL-UHFFFAOYSA-N 2 0 299.418 2.630 20 10 CFCDRP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c(O)c1 ZINC000872252457 641717550 /nfs/dbraw/zinc/71/75/50/641717550.db2.gz RBVLUBOBLXMAJT-CQSZACIVSA-N 2 0 292.423 2.659 20 10 CFCDRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1O ZINC000872251224 641718161 /nfs/dbraw/zinc/71/81/61/641718161.db2.gz HZWBNIQWEGODSK-AWEZNQCLSA-N 2 0 292.423 2.659 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)cc1 ZINC000873223123 642077143 /nfs/dbraw/zinc/07/71/43/642077143.db2.gz IBWBCNMWPJGDIX-SFHVURJKSA-N 2 0 289.467 2.950 20 10 CFCDRP C[C@@H](NC[C@@H]1CCC(C)(C)C[NH2+]1)c1ccccc1O ZINC000873234058 642087018 /nfs/dbraw/zinc/08/70/18/642087018.db2.gz BWRLIGYXDNNLNQ-OLZOCXBDSA-N 2 0 262.397 2.821 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000873239851 642089921 /nfs/dbraw/zinc/08/99/21/642089921.db2.gz DXQHWAXVPMZZEZ-JHJVBQTASA-N 2 0 278.396 2.569 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000873239901 642091237 /nfs/dbraw/zinc/09/12/37/642091237.db2.gz FYEVRGBWXKWSMI-IIAWOOMASA-N 2 0 275.440 2.921 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(F)ccc1O ZINC000873264448 642108175 /nfs/dbraw/zinc/10/81/75/642108175.db2.gz PPFRGYBGIDRMJK-VTPLQMEGSA-N 2 0 278.371 2.713 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(C)cccc2O)[C@@H](C)C1 ZINC000876763681 642999473 /nfs/dbraw/zinc/99/94/73/642999473.db2.gz LZEFUNYXDLZPAD-HOCLYGCPSA-N 2 0 276.424 2.863 20 10 CFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2c(C)cccc2O)C1 ZINC000876963914 643084391 /nfs/dbraw/zinc/08/43/91/643084391.db2.gz KSCOHGCSIYIZHE-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000877020246 643106467 /nfs/dbraw/zinc/10/64/67/643106467.db2.gz MUIKUOCGXAAZBV-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000877585088 643379878 /nfs/dbraw/zinc/37/98/78/643379878.db2.gz PGMBPSKRRNWZHO-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1O ZINC000879651641 644364869 /nfs/dbraw/zinc/36/48/69/644364869.db2.gz FFZRURXFBKSCDH-KBPBESRZSA-N 2 0 262.397 2.917 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128332474 644641600 /nfs/dbraw/zinc/64/16/00/644641600.db2.gz CYVULEUVHOJIID-WDEREUQCSA-N 2 0 268.788 2.605 20 10 CFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000093741878 650946137 /nfs/dbraw/zinc/94/61/37/650946137.db2.gz FYUVNEWRYQGQBL-QGZVFWFLSA-N 2 0 289.467 2.916 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c(O)c1 ZINC000925797034 648326830 /nfs/dbraw/zinc/32/68/30/648326830.db2.gz MXWKWLRXERKIQY-MGPQQGTHSA-N 2 0 262.397 2.597 20 10 CFCDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cc(F)cc(F)c1[O-] ZINC000925839890 648340226 /nfs/dbraw/zinc/34/02/26/648340226.db2.gz FRODDRKDPCFNRU-QSGSBWRWSA-N 2 0 296.361 2.853 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000925882083 648354732 /nfs/dbraw/zinc/35/47/32/648354732.db2.gz JIHLFQYOZSUMCM-UMNHJUIQSA-N 2 0 268.788 2.824 20 10 CFCDRP CN(C)c1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c2ccccc21 ZINC001234980221 778345122 /nfs/dbraw/zinc/34/51/22/778345122.db2.gz VMUNHTBJHHADIQ-IYBDPMFKSA-N 2 0 295.430 2.557 20 10 CFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC001235750687 778552684 /nfs/dbraw/zinc/55/26/84/778552684.db2.gz RTEKIFXGCJXFMB-QGZVFWFLSA-N 2 0 283.419 2.875 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001235893732 778595050 /nfs/dbraw/zinc/59/50/50/778595050.db2.gz RKEPWJZECQWEES-HKUYNNGSSA-N 2 0 299.462 2.861 20 10 CFCDRP CC(C)(C)c1ccc(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)c(O)c1 ZINC001235939971 778619426 /nfs/dbraw/zinc/61/94/26/778619426.db2.gz RRKCBWZWJBAUQW-UKRRQHHQSA-N 2 0 288.435 2.731 20 10 CFCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C[C@@H]1CC1(C)C ZINC001235958010 778626764 /nfs/dbraw/zinc/62/67/64/778626764.db2.gz BFWFSXOIBHXLAJ-INIZCTEOSA-N 2 0 287.451 2.574 20 10 CFCDRP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC001235958272 778626858 /nfs/dbraw/zinc/62/68/58/778626858.db2.gz CHRGQAKSXDKDGR-IZZQQSIFSA-N 2 0 299.462 2.846 20 10 CFCDRP CC(C)(C)c1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1O ZINC001235959241 778627979 /nfs/dbraw/zinc/62/79/79/778627979.db2.gz JOODQCFJYFHEJR-YWVIFJGQSA-N 2 0 288.435 2.859 20 10 CFCDRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001236065549 778678929 /nfs/dbraw/zinc/67/89/29/778678929.db2.gz BEGGXHJDNBMXRU-HNNXBMFYSA-N 2 0 297.446 2.947 20 10 CFCDRP CCC[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC(C)C ZINC001236263748 778756855 /nfs/dbraw/zinc/75/68/55/778756855.db2.gz JLHBTWNKQUQOFC-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP Nc1ccc(C[NH+]2CCC(CC3CC[NH2+]CC3)CC2)cc1 ZINC001236962225 778986059 /nfs/dbraw/zinc/98/60/59/778986059.db2.gz LFZFSUGAVFDUFB-UHFFFAOYSA-N 2 0 287.451 2.871 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237385027 779089643 /nfs/dbraw/zinc/08/96/43/779089643.db2.gz ZGPNUFDWJNAAHM-PKOBYXMFSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000700817580 780726532 /nfs/dbraw/zinc/72/65/32/780726532.db2.gz VVDCZPOSQFPYTJ-STQMWFEESA-N 2 0 280.387 2.914 20 10 CFCDRP CCc1cccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c1O ZINC000705213644 781135484 /nfs/dbraw/zinc/13/54/84/781135484.db2.gz ZNCPYFDQXNABHX-AWEZNQCLSA-N 2 0 276.424 2.728 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC000093692680 375300184 /nfs/dbraw/zinc/30/01/84/375300184.db2.gz MUYCQNPAXQVLKO-QGZVFWFLSA-N 2 0 289.467 2.916 20 10 CFCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)c1 ZINC000093770616 375309778 /nfs/dbraw/zinc/30/97/78/375309778.db2.gz PSXUHKPHWZFOIX-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000574630000 335034806 /nfs/dbraw/zinc/03/48/06/335034806.db2.gz NAEQMCCQGQFXGJ-LSDHHAIUSA-N 2 0 285.435 2.964 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1F ZINC000132211951 377814908 /nfs/dbraw/zinc/81/49/08/377814908.db2.gz YUGHNARDVLBGDB-UHFFFAOYSA-N 2 0 293.430 2.665 20 10 CFCDRP COc1ccc(O)c(C[NH+]2CCC(CC[NH+](C)C)CC2)c1 ZINC000179826656 380583580 /nfs/dbraw/zinc/58/35/80/380583580.db2.gz UUYOZZBTZHDDMC-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251779769 383396752 /nfs/dbraw/zinc/39/67/52/383396752.db2.gz SJPYCASYBCDBLH-IHRRRGAJSA-N 2 0 290.407 2.678 20 10 CFCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036199 394353951 /nfs/dbraw/zinc/35/39/51/394353951.db2.gz VQIBVAMSZMEKKQ-WFASDCNBSA-N 2 0 294.826 2.962 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000020129066 171016590 /nfs/dbraw/zinc/01/65/90/171016590.db2.gz DZPQLPCSKREBSJ-CYBMUJFWSA-N 2 0 278.396 2.537 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC[N@@H+]1C ZINC000090720476 260261563 /nfs/dbraw/zinc/26/15/63/260261563.db2.gz OVFPYUOOXPRFKQ-RDJZCZTQSA-N 2 0 287.451 2.859 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000094617602 521710986 /nfs/dbraw/zinc/71/09/86/521710986.db2.gz YKSOLVQLMLLCKU-RYUDHWBXSA-N 2 0 266.360 2.524 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000019943072 520623709 /nfs/dbraw/zinc/62/37/09/520623709.db2.gz XCBZTBNKRUPYMA-CYBMUJFWSA-N 2 0 280.412 2.783 20 10 CFCDRP CC[N@H+](CCC[NH+](C)C)Cc1cc(C)c(C)cc1O ZINC000289388377 521009023 /nfs/dbraw/zinc/00/90/23/521009023.db2.gz DMROOPPFXHUGMT-UHFFFAOYSA-N 2 0 264.413 2.783 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000277602790 522176003 /nfs/dbraw/zinc/17/60/03/522176003.db2.gz VUHDGKWWJOBARN-MRXNPFEDSA-N 2 0 275.440 2.669 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000278473327 522204381 /nfs/dbraw/zinc/20/43/81/522204381.db2.gz HTOVKRXWDKZZLV-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP CC[C@H]([NH2+]CCC[N@H+](C)CCOC)c1ccc(C)cc1O ZINC000280065950 522580002 /nfs/dbraw/zinc/58/00/02/522580002.db2.gz KSGYNSDWXGCKQI-INIZCTEOSA-N 2 0 294.439 2.710 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000277587774 524393249 /nfs/dbraw/zinc/39/32/49/524393249.db2.gz UNNFARKMXGTJGN-OAHLLOKOSA-N 2 0 262.397 2.617 20 10 CFCDRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000049554087 524476205 /nfs/dbraw/zinc/47/62/05/524476205.db2.gz ZNMRKVDZCLYOFO-KBPBESRZSA-N 2 0 263.429 2.743 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)c1 ZINC000230658180 524763657 /nfs/dbraw/zinc/76/36/57/524763657.db2.gz QACZHPDYAWITMX-CYBMUJFWSA-N 2 0 280.412 2.782 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)c1 ZINC000062077818 524764321 /nfs/dbraw/zinc/76/43/21/524764321.db2.gz WCSMEJYHCCYKHA-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)c1 ZINC000230658185 524770177 /nfs/dbraw/zinc/77/01/77/524770177.db2.gz QACZHPDYAWITMX-ZDUSSCGKSA-N 2 0 280.412 2.782 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000185650850 524773739 /nfs/dbraw/zinc/77/37/39/524773739.db2.gz BFFZSTGRCCMCMX-IHRRRGAJSA-N 2 0 292.423 2.924 20 10 CFCDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cc(F)ccc1O ZINC000094618022 525434578 /nfs/dbraw/zinc/43/45/78/525434578.db2.gz MWAVXIYMRXZHKX-LLVKDONJSA-N 2 0 254.349 2.524 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245584745 526372548 /nfs/dbraw/zinc/37/25/48/526372548.db2.gz DCSMWMGYDVSDDP-WMLDXEAASA-N 2 0 286.419 2.841 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000733324965 574221811 /nfs/dbraw/zinc/22/18/11/574221811.db2.gz OCCLTOWBQCKJCS-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CCC[NH+](C)C)c2c1c(F)ccc2O ZINC000756342539 574226903 /nfs/dbraw/zinc/22/69/03/574226903.db2.gz KOXPZVASGJFXGB-CMPLNLGQSA-N 2 0 266.360 2.621 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC2=CC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756788150 574262708 /nfs/dbraw/zinc/26/27/08/574262708.db2.gz BGHQHXMMTUQKHR-RISCZKNCSA-N 2 0 290.382 2.931 20 10 CFCDRP CCC1([NH3+])CC[NH+]([C@H](C)c2ccc(C)cc2O)CC1 ZINC000925757507 619067070 /nfs/dbraw/zinc/06/70/70/619067070.db2.gz HVZKUWUVVYBIPE-CYBMUJFWSA-N 2 0 262.397 2.965 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]CCC[N@@H+](C)C(C)C ZINC000840929704 619071986 /nfs/dbraw/zinc/07/19/86/619071986.db2.gz WCBJQWGUKLVJHW-UHFFFAOYSA-N 2 0 277.456 2.881 20 10 CFCDRP C[N@H+](Cc1cc(F)cc(F)c1[O-])C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000894748172 619454636 /nfs/dbraw/zinc/45/46/36/619454636.db2.gz IKRBVWUBSZURAF-PBWFPOADSA-N 2 0 296.361 2.727 20 10 CFCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781990 619465915 /nfs/dbraw/zinc/46/59/15/619465915.db2.gz IHHJEAPZASDMHS-XHDPSFHLSA-N 2 0 296.361 2.587 20 10 CFCDRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2ccccc2c1O ZINC000902485688 621111413 /nfs/dbraw/zinc/11/14/13/621111413.db2.gz MPNQXMPZNBFHNA-YRGRVCCFSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2ccccc2c1O ZINC000902485687 621111633 /nfs/dbraw/zinc/11/16/33/621111633.db2.gz MPNQXMPZNBFHNA-OBJOEFQTSA-N 2 0 270.376 2.933 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H](C)CCC[NH3+])c1O ZINC000841078402 621453332 /nfs/dbraw/zinc/45/33/32/621453332.db2.gz CSNVQQHHAXRBEB-SNVBAGLBSA-N 2 0 256.777 2.571 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000904301674 621568982 /nfs/dbraw/zinc/56/89/82/621568982.db2.gz OJNCLMTYOWNUBC-QGZVFWFLSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[C@@H]1C[NH3+] ZINC000904409995 621590798 /nfs/dbraw/zinc/59/07/98/621590798.db2.gz LHQSRZXRXWGBKA-GWOVIKRFSA-N 2 0 287.451 2.683 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c(Cl)c1 ZINC000841083399 622200609 /nfs/dbraw/zinc/20/06/09/622200609.db2.gz BVPMOZQSCJHGRM-QWRGUYRKSA-N 2 0 268.788 2.571 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534384 622918452 /nfs/dbraw/zinc/91/84/52/622918452.db2.gz SLXZQRZXFDZYJI-KRWDZBQOSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1cc(F)ccc1O ZINC000157652296 623044290 /nfs/dbraw/zinc/04/42/90/623044290.db2.gz VVICQYPDAIUQFK-GVXVVHGQSA-N 2 0 266.360 2.665 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)c1 ZINC000168758454 623102669 /nfs/dbraw/zinc/10/26/69/623102669.db2.gz DLHCCFLWUZSAQM-ZDUSSCGKSA-N 2 0 292.423 2.783 20 10 CFCDRP CC[C@@H]1C[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824784005 623565181 /nfs/dbraw/zinc/56/51/81/623565181.db2.gz YVSUCYYTSIEOQI-SJORKVTESA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1cc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)ccc1N1CCCCC1 ZINC000827458226 624008263 /nfs/dbraw/zinc/00/82/63/624008263.db2.gz UOZXLZBHWAGSPY-ROUUACIJSA-N 2 0 299.462 2.637 20 10 CFCDRP C[NH+](C)CC(C)(C)C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921471104 624901973 /nfs/dbraw/zinc/90/19/73/624901973.db2.gz UZNQSGLFRJQCKK-UHFFFAOYSA-N 2 0 276.424 2.689 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]34C[C@H]3CCC4)cc2)CC1 ZINC000922965168 626433727 /nfs/dbraw/zinc/43/37/27/626433727.db2.gz ZTVJQJCGADCKOJ-MJGOQNOKSA-N 2 0 299.462 2.718 20 10 CFCDRP Cc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)ccc1N(C)C ZINC000923331328 626466017 /nfs/dbraw/zinc/46/60/17/626466017.db2.gz FXHFBINCHNIQBS-ULQDDVLXSA-N 2 0 287.451 2.620 20 10 CFCDRP Cc1cc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)ccc1N(C)C ZINC000923368984 626468896 /nfs/dbraw/zinc/46/88/96/626468896.db2.gz IHDQAVMTBZKUTB-INIZCTEOSA-N 2 0 275.440 2.539 20 10 CFCDRP CCC1(C)C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000839142804 626528632 /nfs/dbraw/zinc/52/86/32/626528632.db2.gz JFLPTATVXFCAKZ-UHFFFAOYSA-N 2 0 287.451 2.670 20 10 CFCDRP COc1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1C ZINC000839183520 626530047 /nfs/dbraw/zinc/53/00/47/626530047.db2.gz XQGYITTUSRGBTF-OAHLLOKOSA-N 2 0 276.424 2.825 20 10 CFCDRP CCOc1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000839183502 626530070 /nfs/dbraw/zinc/53/00/70/626530070.db2.gz XKOUQJYMMBBSLU-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H]4C[C@@H]43)cc2)CC1 ZINC000839190916 626530710 /nfs/dbraw/zinc/53/07/10/626530710.db2.gz LAUYPBCKSCTNIR-NEWSRXKRSA-N 2 0 299.462 2.717 20 10 CFCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@]1(C)CC[NH2+]C1 ZINC000843059947 626553053 /nfs/dbraw/zinc/55/30/53/626553053.db2.gz VYJJRDCAJZBINX-KRWDZBQOSA-N 2 0 275.440 2.574 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000757674028 626557507 /nfs/dbraw/zinc/55/75/07/626557507.db2.gz OERKCHMRELRENG-HNNXBMFYSA-N 2 0 294.439 2.710 20 10 CFCDRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000757674016 626557569 /nfs/dbraw/zinc/55/75/69/626557569.db2.gz NNBDHKHIUIKIDZ-CYBMUJFWSA-N 2 0 298.402 2.540 20 10 CFCDRP CC(C)CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771828553 627635473 /nfs/dbraw/zinc/63/54/73/627635473.db2.gz YZEGVJWSDJVDHZ-UHFFFAOYSA-N 2 0 289.467 2.964 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccoc1 ZINC000771849363 627637680 /nfs/dbraw/zinc/63/76/80/627637680.db2.gz XMONFSZRSJDSFA-HNNXBMFYSA-N 2 0 299.418 2.882 20 10 CFCDRP CC(C)[C@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652212 628050393 /nfs/dbraw/zinc/05/03/93/628050393.db2.gz ILPJDOYELJCOCU-INIZCTEOSA-N 2 0 289.467 2.915 20 10 CFCDRP CC(C)=CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790992567 629278444 /nfs/dbraw/zinc/27/84/44/629278444.db2.gz YWDKNSIBGNTIFX-UHFFFAOYSA-N 2 0 287.451 2.884 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000835035846 629330248 /nfs/dbraw/zinc/33/02/48/629330248.db2.gz MFVGSPCJJMPZEE-DUVWHUSGSA-N 2 0 299.462 2.982 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H]4C[C@H]43)cc2)CC1 ZINC000800890335 630414827 /nfs/dbraw/zinc/41/48/27/630414827.db2.gz LAUYPBCKSCTNIR-UHOSZYNNSA-N 2 0 299.462 2.717 20 10 CFCDRP CCCN(CC[NH2+]C(C)(C)C)Cc1ccccc1O ZINC000841006829 631302939 /nfs/dbraw/zinc/30/29/39/631302939.db2.gz JDZLVWSVOZUORP-UHFFFAOYSA-N 2 0 264.413 2.992 20 10 CFCDRP CCN(CC)c1ccc(CNC[C@H]([NH3+])C(C)C)cc1F ZINC000841028198 631308887 /nfs/dbraw/zinc/30/88/87/631308887.db2.gz CVZVXYUZCYDZMO-HNNXBMFYSA-N 2 0 281.419 2.745 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1F ZINC000841030656 631310778 /nfs/dbraw/zinc/31/07/78/631310778.db2.gz OBSWAOZPZJOLJM-HOCLYGCPSA-N 2 0 293.430 2.889 20 10 CFCDRP C[C@@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)[C@@H]1CCC[NH2+]C1 ZINC000841034122 631313929 /nfs/dbraw/zinc/31/39/29/631313929.db2.gz WDPSPQCKAOFWHN-NXEZZACHSA-N 2 0 286.778 2.662 20 10 CFCDRP CC(C)(C)[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841036873 631315299 /nfs/dbraw/zinc/31/52/99/631315299.db2.gz WSQYYJHBKFPXOZ-UHFFFAOYSA-N 2 0 275.440 2.664 20 10 CFCDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841051705 631322393 /nfs/dbraw/zinc/32/23/93/631322393.db2.gz QRJZXMSZXKNBLX-JTQLQIEISA-N 2 0 289.345 2.598 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC000841057409 631323657 /nfs/dbraw/zinc/32/36/57/631323657.db2.gz GYLHVGCCSLSCNO-LLVKDONJSA-N 2 0 268.788 2.586 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH2+]1 ZINC000841060672 631325760 /nfs/dbraw/zinc/32/57/60/631325760.db2.gz AQYGRCHVUBGBEW-RDJZCZTQSA-N 2 0 287.451 2.907 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC000841072981 631330248 /nfs/dbraw/zinc/33/02/48/631330248.db2.gz OLQUOQGYTICOEJ-KEGWNNHHSA-N 2 0 287.451 2.744 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)c1O ZINC000841073410 631330580 /nfs/dbraw/zinc/33/05/80/631330580.db2.gz STOARMOQWWMATG-ZDUSSCGKSA-N 2 0 298.814 2.532 20 10 CFCDRP Oc1cccc(Cl)c1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841090108 631337551 /nfs/dbraw/zinc/33/75/51/631337551.db2.gz VYTMNYBICALURN-NSHDSACASA-N 2 0 280.799 2.810 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4C[C@H]4C3)cc2)CC1 ZINC000842775209 631737393 /nfs/dbraw/zinc/73/73/93/631737393.db2.gz CILMJULHXXGKHK-OKZBNKHCSA-N 2 0 299.462 2.717 20 10 CFCDRP C[C@H]([NH3+])[C@@H]1CCCCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000843045057 631811686 /nfs/dbraw/zinc/81/16/86/631811686.db2.gz HFVUKXHGESDZJO-MLCBILRFSA-N 2 0 287.451 2.968 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H](C[NH3+])C2)c(Cl)c1 ZINC000843046740 631813188 /nfs/dbraw/zinc/81/31/88/631813188.db2.gz AGUPXOWARJLJKM-LLVKDONJSA-N 2 0 268.788 2.525 20 10 CFCDRP C[NH2+]CC1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000843049986 631814643 /nfs/dbraw/zinc/81/46/43/631814643.db2.gz XHYGEQLBDSKODB-SNAWJCMRSA-N 2 0 287.451 2.697 20 10 CFCDRP C[C@H]([NH3+])[C@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000843050953 631815373 /nfs/dbraw/zinc/81/53/73/631815373.db2.gz CJXYGYPWEBJWJX-DVJJNNKXSA-N 2 0 287.451 2.825 20 10 CFCDRP C[NH2+]CC1CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000843048852 631815639 /nfs/dbraw/zinc/81/56/39/631815639.db2.gz BEXGWXZEHGMHHR-UHFFFAOYSA-N 2 0 282.815 2.785 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c1O ZINC000843051948 631816835 /nfs/dbraw/zinc/81/68/35/631816835.db2.gz NANOZDUCRREYRP-VXGBXAGGSA-N 2 0 282.815 2.913 20 10 CFCDRP CN(C)c1ccc(/C=C\C[N@H+](C)C2CCC([NH3+])CC2)cc1 ZINC000843055079 631818897 /nfs/dbraw/zinc/81/88/97/631818897.db2.gz PSFAAXPKROAVHK-PLNGDYQASA-N 2 0 287.451 2.968 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1C ZINC000843059059 631821704 /nfs/dbraw/zinc/82/17/04/631821704.db2.gz DULBQMYCOMWMEP-IMJJTQAJSA-N 2 0 274.408 2.568 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1C ZINC000843114877 631840322 /nfs/dbraw/zinc/84/03/22/631840322.db2.gz DHXLNJBGGDQETC-KRWDZBQOSA-N 2 0 274.408 2.585 20 10 CFCDRP Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126309 631845299 /nfs/dbraw/zinc/84/52/99/631845299.db2.gz ISJYEKJJLHKBDN-KGLIPLIRSA-N 2 0 292.398 2.743 20 10 CFCDRP COc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1C ZINC000843128689 631847830 /nfs/dbraw/zinc/84/78/30/631847830.db2.gz NKONZWVGGPQCGP-UHFFFAOYSA-N 2 0 270.376 2.752 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCCCCC[NH3+])c(O)c1 ZINC000843340945 631931596 /nfs/dbraw/zinc/93/15/96/631931596.db2.gz GQJVVMTZFAKZKC-CYBMUJFWSA-N 2 0 250.386 2.870 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H](C)C[NH+](C)C)cc1F ZINC000813784590 631959274 /nfs/dbraw/zinc/95/92/74/631959274.db2.gz KTJFLBYSPZWIQL-AWEZNQCLSA-N 2 0 295.446 2.959 20 10 CFCDRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(N(C)C)cc1 ZINC000844923474 632338040 /nfs/dbraw/zinc/33/80/40/632338040.db2.gz SENOULQNOYLWQY-CYBMUJFWSA-N 2 0 261.413 2.532 20 10 CFCDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000844927504 632339737 /nfs/dbraw/zinc/33/97/37/632339737.db2.gz PCFFJSGIQBTISS-CQSZACIVSA-N 2 0 275.440 2.793 20 10 CFCDRP C[NH+](C)CCC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816610248 632493822 /nfs/dbraw/zinc/49/38/22/632493822.db2.gz DHKRZRIOLDETRC-UHFFFAOYSA-N 2 0 272.392 2.929 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)c1O ZINC000846137653 632643669 /nfs/dbraw/zinc/64/36/69/632643669.db2.gz DYVBADFCNINPDN-CYBMUJFWSA-N 2 0 280.412 2.782 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846137362 632644075 /nfs/dbraw/zinc/64/40/75/632644075.db2.gz OLBFHGWQMUNKDS-CYBMUJFWSA-N 2 0 292.423 2.926 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1O ZINC000846141794 632644518 /nfs/dbraw/zinc/64/45/18/632644518.db2.gz SYZJKYIOWOHYAH-MELADBBJSA-N 2 0 290.407 2.678 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c1O ZINC000846151356 632647807 /nfs/dbraw/zinc/64/78/07/632647807.db2.gz XAYDQHKYCAAEPK-IHRRRGAJSA-N 2 0 292.423 2.924 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C[NH3+] ZINC000817865075 632714372 /nfs/dbraw/zinc/71/43/72/632714372.db2.gz GDBXZSGDYUKIRL-NFAWXSAZSA-N 2 0 293.430 2.697 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)cc1C ZINC000817866332 632715791 /nfs/dbraw/zinc/71/57/91/632715791.db2.gz YSGYWFRXIMGSQX-FMKPAKJESA-N 2 0 276.424 2.814 20 10 CFCDRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1cc(F)ccc1O ZINC000817938304 632743405 /nfs/dbraw/zinc/74/34/05/632743405.db2.gz INQIZSIFPZDXTE-LLVKDONJSA-N 2 0 266.360 2.844 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000817943630 632746570 /nfs/dbraw/zinc/74/65/70/632746570.db2.gz QBBMHBYZWKGEJT-CYBMUJFWSA-N 2 0 250.386 2.659 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000817955508 632754337 /nfs/dbraw/zinc/75/43/37/632754337.db2.gz XRGSMTNUEWCOJK-GJZGRUSLSA-N 2 0 275.440 2.793 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817955013 632754493 /nfs/dbraw/zinc/75/44/93/632754493.db2.gz OODUWQRFYDCQTI-UONOGXRCSA-N 2 0 288.435 2.921 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(O)c1 ZINC000817954705 632754699 /nfs/dbraw/zinc/75/46/99/632754699.db2.gz HHGMQCWWRRTNRB-ZIAGYGMSSA-N 2 0 262.397 2.659 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000817956781 632755971 /nfs/dbraw/zinc/75/59/71/632755971.db2.gz CRTNLMASJCSFBG-IAGOWNOFSA-N 2 0 267.376 2.546 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]([NH3+])C2CC2)c1O ZINC000817966030 632764409 /nfs/dbraw/zinc/76/44/09/632764409.db2.gz ZLRLTYLTLGTFKU-NOZJJQNGSA-N 2 0 268.788 2.742 20 10 CFCDRP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc2ccccc2c1O ZINC000817966012 632764571 /nfs/dbraw/zinc/76/45/71/632764571.db2.gz ZBJJOGOXHVLYCF-ZBEGNZNMSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817968145 632767573 /nfs/dbraw/zinc/76/75/73/632767573.db2.gz QBARPNTYSYTOJH-JTQLQIEISA-N 2 0 266.772 2.616 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(O)c1C ZINC000817969924 632768493 /nfs/dbraw/zinc/76/84/93/632768493.db2.gz IICXXGRWWRSVOQ-MELADBBJSA-N 2 0 262.397 2.930 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c(O)c1C ZINC000817971625 632770629 /nfs/dbraw/zinc/77/06/29/632770629.db2.gz OMCMBZYEFYNWAX-CORIIIEPSA-N 2 0 262.397 2.658 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(F)ccc1O ZINC000817975098 632773746 /nfs/dbraw/zinc/77/37/46/632773746.db2.gz INFVDGGMZODOGH-JHJVBQTASA-N 2 0 280.387 2.947 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000817976712 632774235 /nfs/dbraw/zinc/77/42/35/632774235.db2.gz SCHZJUYAJZIENZ-MPKXVKKWSA-N 2 0 290.382 2.811 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c(O)c1C ZINC000817976732 632774499 /nfs/dbraw/zinc/77/44/99/632774499.db2.gz SONMTOKVRMJITP-DZGCQCFKSA-N 2 0 274.408 2.802 20 10 CFCDRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccccc1O ZINC000817976123 632774669 /nfs/dbraw/zinc/77/46/69/632774669.db2.gz GOBBMQUAUSAFNO-OCCSQVGLSA-N 2 0 250.386 2.950 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(C)cc1O ZINC000817981475 632777909 /nfs/dbraw/zinc/77/79/09/632777909.db2.gz KSJHYSPZMVVVDJ-YDHLFZDLSA-N 2 0 262.397 2.869 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c(O)c1 ZINC000817981882 632778717 /nfs/dbraw/zinc/77/87/17/632778717.db2.gz WPGRVKHEZNDKBO-KBPBESRZSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2c1c(F)ccc2O ZINC000817982462 632779160 /nfs/dbraw/zinc/77/91/60/632779160.db2.gz SQKRFEJEPPUEER-BLFANLJRSA-N 2 0 278.371 2.797 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(F)ccc1O ZINC000817985154 632782118 /nfs/dbraw/zinc/78/21/18/632782118.db2.gz BDNQDCNYQHBZOC-ZJQBRPOHSA-N 2 0 278.371 2.570 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1C ZINC000818431398 632843726 /nfs/dbraw/zinc/84/37/26/632843726.db2.gz KXCHLJDQXPREPO-OAHLLOKOSA-N 2 0 288.435 2.973 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2[NH3+])c(O)c1C ZINC000818614438 632880043 /nfs/dbraw/zinc/88/00/43/632880043.db2.gz ATMDIDGGFKRVGT-NWANDNLSSA-N 2 0 262.397 2.930 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1O ZINC000849350732 633625756 /nfs/dbraw/zinc/62/57/56/633625756.db2.gz ULTMJAJCTYFSGA-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000854230744 635265988 /nfs/dbraw/zinc/26/59/88/635265988.db2.gz XOICMUNZSJYOCM-CZUORRHYSA-N 2 0 263.429 2.777 20 10 CFCDRP CC[C@@H]1C[N@H+](Cc2cc(Cl)ccc2O)CC[C@@H]1[NH3+] ZINC000122324167 638988830 /nfs/dbraw/zinc/98/88/30/638988830.db2.gz RNAKRWFNTSVJBU-MFKMUULPSA-N 2 0 268.788 2.605 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000122806168 639441848 /nfs/dbraw/zinc/44/18/48/639441848.db2.gz UTGZBCKDDRGKJB-OAHLLOKOSA-N 2 0 289.467 2.881 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1F ZINC000872252977 641718809 /nfs/dbraw/zinc/71/88/09/641718809.db2.gz XHRDPRZEZUKXBQ-AWEZNQCLSA-N 2 0 293.430 2.760 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1C ZINC000872725577 641913062 /nfs/dbraw/zinc/91/30/62/641913062.db2.gz URFICMOMJJRURD-GDBMZVCRSA-N 2 0 274.408 2.535 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1 ZINC000872725740 641913531 /nfs/dbraw/zinc/91/35/31/641913531.db2.gz VTCHLGBRRXMEMT-GOEBONIOSA-N 2 0 274.408 2.535 20 10 CFCDRP C[C@@H]([NH2+]Cc1c(O)cccc1Cl)C1CC[NH2+]CC1 ZINC000873221619 642075015 /nfs/dbraw/zinc/07/50/15/642075015.db2.gz YWGIBDHPLCZWDH-SNVBAGLBSA-N 2 0 268.788 2.523 20 10 CFCDRP CCOc1ccc(C[N@H+](C)CCCCCC[NH3+])c(O)c1 ZINC000873231461 642085461 /nfs/dbraw/zinc/08/54/61/642085461.db2.gz JXNSUMQMRLJXEI-UHFFFAOYSA-N 2 0 280.412 2.742 20 10 CFCDRP Oc1ccc(F)cc1C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873232905 642086367 /nfs/dbraw/zinc/08/63/67/642086367.db2.gz QUUYIQCXLYUQPO-INIZCTEOSA-N 2 0 292.398 2.933 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000873241821 642090948 /nfs/dbraw/zinc/09/09/48/642090948.db2.gz GFWZKIXKBSEVCZ-OLZOCXBDSA-N 2 0 292.423 2.830 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000873252655 642098647 /nfs/dbraw/zinc/09/86/47/642098647.db2.gz USUNGDOUESJJOV-ATZCPNFKSA-N 2 0 299.212 2.543 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2ccccc2c1O ZINC000873255818 642101712 /nfs/dbraw/zinc/10/17/12/642101712.db2.gz INNRXYUMRGMCSZ-YRGRVCCFSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000873269134 642112021 /nfs/dbraw/zinc/11/20/21/642112021.db2.gz CZKORHLMLSGMLW-KBPBESRZSA-N 2 0 275.440 2.791 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(C)cccc2O)C1 ZINC000876775443 643006414 /nfs/dbraw/zinc/00/64/14/643006414.db2.gz WACBMQUXKYQZDR-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(C)cc2O)C1 ZINC000876988105 643094134 /nfs/dbraw/zinc/09/41/34/643094134.db2.gz VBHLWFMOGAXEBQ-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1c(C)cccc1O ZINC000877142101 643175405 /nfs/dbraw/zinc/17/54/05/643175405.db2.gz KDIZOLIEIWVLLH-UHFFFAOYSA-N 2 0 250.386 2.522 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c(O)c1 ZINC000877524836 643327968 /nfs/dbraw/zinc/32/79/68/643327968.db2.gz ICEUWFDYLNQQRB-AWEZNQCLSA-N 2 0 262.397 2.521 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1c(C)cccc1O ZINC000877527207 643330555 /nfs/dbraw/zinc/33/05/55/643330555.db2.gz IMZMABRJNUMDHA-UHFFFAOYSA-N 2 0 264.413 2.864 20 10 CFCDRP CSC1(C[NH2+]Cc2c(C)cccc2O)CC[NH+](C)CC1 ZINC000877539612 643340755 /nfs/dbraw/zinc/34/07/55/643340755.db2.gz QARKOQZKQVMHIW-UHFFFAOYSA-N 2 0 294.464 2.618 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c(O)c1 ZINC000877654091 643434398 /nfs/dbraw/zinc/43/43/98/643434398.db2.gz VHZGYVDTSYYVNE-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)ccc1N(C)C ZINC000879579511 644335893 /nfs/dbraw/zinc/33/58/93/644335893.db2.gz MZDPHXHVOSHDBQ-AEFFLSMTSA-N 2 0 287.451 2.587 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000128334859 644642221 /nfs/dbraw/zinc/64/22/21/644642221.db2.gz SFCWIETXZKWIKN-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP C[N@H+](Cc1c(O)cccc1Cl)C1CCC([NH3+])CC1 ZINC000128347193 644648100 /nfs/dbraw/zinc/64/81/00/644648100.db2.gz VLCFFTPDRMKCRQ-UHFFFAOYSA-N 2 0 268.788 2.747 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000131513984 645739193 /nfs/dbraw/zinc/73/91/93/645739193.db2.gz CBQXVMRBQLWJIG-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CCCSc2nccs2)CC[N@@H+]1C ZINC000132157468 645884460 /nfs/dbraw/zinc/88/44/60/645884460.db2.gz IAMYZGZJMCFDPA-VXGBXAGGSA-N 2 0 285.482 2.698 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(C)cc1O ZINC000925776527 648318781 /nfs/dbraw/zinc/31/87/81/648318781.db2.gz LARQDQFSVDRNII-OCCSQVGLSA-N 2 0 298.377 2.986 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2CC[NH3+])cc1 ZINC001235925167 778611265 /nfs/dbraw/zinc/61/12/65/778611265.db2.gz KANNANFGIQUKEC-INIZCTEOSA-N 2 0 275.440 2.846 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000383341856 770956723 /nfs/dbraw/zinc/95/67/23/770956723.db2.gz WMXREYDEHZRDGX-OAHLLOKOSA-N 2 0 274.408 2.701 20 10 CFCDRP Cc1cc(O)c(CN2CCC[C@]3(CC[NH2+]C3)C2)cc1Cl ZINC001234997362 778347908 /nfs/dbraw/zinc/34/79/08/778347908.db2.gz BQXYIIKKQXQTDC-MRXNPFEDSA-N 2 0 294.826 2.930 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC001235199305 778413155 /nfs/dbraw/zinc/41/31/55/778413155.db2.gz XUDZFXPLBUPNSE-UKRRQHHQSA-N 2 0 288.435 2.731 20 10 CFCDRP Cc1c(CN2C[C@H]3CCC[NH2+][C@H]3C2)c2ccccc2n1C ZINC001235208900 778415438 /nfs/dbraw/zinc/41/54/38/778415438.db2.gz AAIWQYQEVQOMFK-PBHICJAKSA-N 2 0 283.419 2.671 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001235893733 778595058 /nfs/dbraw/zinc/59/50/58/778595058.db2.gz RKEPWJZECQWEES-IEBWSBKVSA-N 2 0 299.462 2.861 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)c1 ZINC001235941653 778619448 /nfs/dbraw/zinc/61/94/48/778619448.db2.gz WQFVPNNZNKPNNC-ZFWWWQNUSA-N 2 0 288.435 2.731 20 10 CFCDRP CCC(CC)[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235959816 778628655 /nfs/dbraw/zinc/62/86/55/778628655.db2.gz KRVXHZLSTKVNAQ-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP CC[N@H+](CC[C@@H]1CCCC[NH2+]1)Cc1ccccc1O ZINC001236044538 778662604 /nfs/dbraw/zinc/66/26/04/778662604.db2.gz NKAZOHPXROYLOQ-HNNXBMFYSA-N 2 0 262.397 2.746 20 10 CFCDRP Oc1cc2ccccc2cc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236320944 778777824 /nfs/dbraw/zinc/77/78/24/778777824.db2.gz MNKZOAMIYPEOPI-CALCHBBNSA-N 2 0 296.414 2.977 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236320114 778777962 /nfs/dbraw/zinc/77/79/62/778777962.db2.gz BWEPACFOXDLSMC-BETUJISGSA-N 2 0 294.826 2.785 20 10 CFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@@H]2C1 ZINC001236836161 778960576 /nfs/dbraw/zinc/96/05/76/778960576.db2.gz YTNZGVUSBMJJFO-HDICACEKSA-N 2 0 296.414 2.929 20 10 CFCDRP CC(C)c1ccc(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c1 ZINC001237054707 779001410 /nfs/dbraw/zinc/00/14/10/779001410.db2.gz DUKUXAJKWRHCDM-SJLPKXTDSA-N 2 0 288.435 2.899 20 10 CFCDRP [NH3+][C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001205109540 779232815 /nfs/dbraw/zinc/23/28/15/779232815.db2.gz IAUUSRLOLCIKHX-CQSZACIVSA-N 2 0 270.376 2.859 20 10 CFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000700811351 780724327 /nfs/dbraw/zinc/72/43/27/780724327.db2.gz BVVNCYHHNUGHAO-ZFWWWQNUSA-N 2 0 274.408 2.701 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000278128288 283308208 /nfs/dbraw/zinc/30/82/08/283308208.db2.gz BWNDKGCUXWMNOQ-MSOLQXFVSA-N 2 0 287.451 2.989 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000092043021 375083761 /nfs/dbraw/zinc/08/37/61/375083761.db2.gz QWAZUXZWFILMDM-AEFFLSMTSA-N 2 0 287.451 2.669 20 10 CFCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)cc2)C1 ZINC000093769906 375307705 /nfs/dbraw/zinc/30/77/05/375307705.db2.gz SAGYOLUBCDNKQH-MRXNPFEDSA-N 2 0 275.440 2.526 20 10 CFCDRP CCOc1cccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)c1O ZINC000093770257 375311347 /nfs/dbraw/zinc/31/13/47/375311347.db2.gz LIDXXTICVUNSTM-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000574629998 335034833 /nfs/dbraw/zinc/03/48/33/335034833.db2.gz NAEQMCCQGQFXGJ-GJZGRUSLSA-N 2 0 285.435 2.964 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1C ZINC000129296660 377408789 /nfs/dbraw/zinc/40/87/89/377408789.db2.gz GHJOQUCWPIIMRC-RDJZCZTQSA-N 2 0 288.435 2.925 20 10 CFCDRP Oc1ccccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000179578195 380560629 /nfs/dbraw/zinc/56/06/29/380560629.db2.gz RZUHZXVIYGDUDT-INIZCTEOSA-N 2 0 274.408 2.843 20 10 CFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1[O-] ZINC000296625736 381477835 /nfs/dbraw/zinc/47/78/35/381477835.db2.gz XCDDNMPJFANVFK-HLVVYCRESA-N 2 0 278.371 2.807 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](C2CC2)CC1 ZINC000298071001 381577303 /nfs/dbraw/zinc/57/73/03/381577303.db2.gz LBUGPSWUQONOGZ-UHFFFAOYSA-N 2 0 287.451 2.989 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c(O)c1 ZINC000251014779 383384570 /nfs/dbraw/zinc/38/45/70/383384570.db2.gz LUCHVOCJUVLUGI-KKUMJFAQSA-N 2 0 274.408 2.978 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251148569 383385827 /nfs/dbraw/zinc/38/58/27/383385827.db2.gz GYWCQFKSRNUHLK-ZNMIVQPWSA-N 2 0 274.408 2.978 20 10 CFCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(Cl)ccc1O ZINC000273514749 385686080 /nfs/dbraw/zinc/68/60/80/385686080.db2.gz SHXIWEPFUUKDKI-LLVKDONJSA-N 2 0 280.799 2.958 20 10 CFCDRP C[C@H](C[NH2+]Cc1ccccc1O)C[NH+]1CCCCC1 ZINC000038041663 174043491 /nfs/dbraw/zinc/04/34/91/174043491.db2.gz SDQBRNMWWKZHCP-CQSZACIVSA-N 2 0 262.397 2.604 20 10 CFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423088947 330169224 /nfs/dbraw/zinc/16/92/24/330169224.db2.gz TXQWQDDFYTUEKP-XJKSGUPXSA-N 2 0 285.435 2.964 20 10 CFCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000292731392 520254673 /nfs/dbraw/zinc/25/46/73/520254673.db2.gz GQNXRTQNPLYBLI-QGZVFWFLSA-N 2 0 289.467 2.835 20 10 CFCDRP CCCC[NH+]1CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000226586698 520577333 /nfs/dbraw/zinc/57/73/33/520577333.db2.gz YZTNZTMPJZTTPI-UHFFFAOYSA-N 2 0 280.387 2.885 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(C)cc1O ZINC000293269744 522859530 /nfs/dbraw/zinc/85/95/30/522859530.db2.gz CIWDGTPCUYYRDA-DZGCQCFKSA-N 2 0 264.413 2.939 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649236 522865957 /nfs/dbraw/zinc/86/59/57/522865957.db2.gz JRAAACJKTCWZNW-CZUORRHYSA-N 2 0 274.408 2.917 20 10 CFCDRP CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccccc1O ZINC000049553308 522908291 /nfs/dbraw/zinc/90/82/91/522908291.db2.gz MUPSZENNNWUWFW-GXTWGEPZSA-N 2 0 250.386 2.773 20 10 CFCDRP CC[C@H](c1ccccc1O)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000312704257 522951728 /nfs/dbraw/zinc/95/17/28/522951728.db2.gz OIFPIWUPZYYZIK-NVXWUHKLSA-N 2 0 274.408 2.871 20 10 CFCDRP COc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1C ZINC000227330344 524069961 /nfs/dbraw/zinc/06/99/61/524069961.db2.gz OAMOBBZJWXJSMU-UHFFFAOYSA-N 2 0 276.424 2.825 20 10 CFCDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000036908285 524916043 /nfs/dbraw/zinc/91/60/43/524916043.db2.gz NIVRSMKUZWETNK-CPUCHLNUSA-N 2 0 275.440 2.571 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000217913847 525345904 /nfs/dbraw/zinc/34/59/04/525345904.db2.gz UFSRLXYMYSFJBE-GOEBONIOSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c1 ZINC000293346673 525362925 /nfs/dbraw/zinc/36/29/25/525362925.db2.gz GUEGPNQWQYJXCC-OLZOCXBDSA-N 2 0 250.386 2.549 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(F)ccc1O ZINC000157373641 525571391 /nfs/dbraw/zinc/57/13/91/525571391.db2.gz RAWUUUKHGQBCSA-IACUBPJLSA-N 2 0 278.371 2.809 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000296418812 526369028 /nfs/dbraw/zinc/36/90/28/526369028.db2.gz LJAATQSKKKXVQE-MRXNPFEDSA-N 2 0 286.419 2.844 20 10 CFCDRP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC000040623330 617638480 /nfs/dbraw/zinc/63/84/80/617638480.db2.gz XSNNIWRGEZQHTM-INIZCTEOSA-N 2 0 276.424 2.824 20 10 CFCDRP C[NH2+]CCC1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000070189058 625280911 /nfs/dbraw/zinc/28/09/11/625280911.db2.gz WOJXEGSYIMRAHA-UHFFFAOYSA-N 2 0 262.397 2.522 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)cc1 ZINC000925511357 618850387 /nfs/dbraw/zinc/85/03/87/618850387.db2.gz LSRDYXGOTSATIC-IXDOHACOSA-N 2 0 287.451 2.619 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCn3ccnc3C2)c(Cl)c1 ZINC000840938798 619078678 /nfs/dbraw/zinc/07/86/78/619078678.db2.gz ROTDAHBYYDWEKA-NSHDSACASA-N 2 0 291.782 2.655 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N(C)C)cc1 ZINC000925781368 619103630 /nfs/dbraw/zinc/10/36/30/619103630.db2.gz YHCCCRBNPCLDSR-OCCSQVGLSA-N 2 0 297.393 2.648 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000925799020 619120572 /nfs/dbraw/zinc/12/05/72/619120572.db2.gz SNPMFQVXUUINBU-HZSPNIEDSA-N 2 0 262.397 2.597 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(C)cc1O ZINC000925879529 619199680 /nfs/dbraw/zinc/19/96/80/619199680.db2.gz HCSWFGSQCOKFPC-VNHYZAJKSA-N 2 0 262.397 2.869 20 10 CFCDRP COc1cc(C)cc(C[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000894965335 619518509 /nfs/dbraw/zinc/51/85/09/619518509.db2.gz FCZTVZWFLIOVFL-UHFFFAOYSA-N 2 0 292.423 2.673 20 10 CFCDRP COc1cc(C)cc(C[NH2+]C2CCC([NH+](C)C)CC2)c1O ZINC000895033758 619529847 /nfs/dbraw/zinc/52/98/47/619529847.db2.gz GREROFQLYFBJDQ-UHFFFAOYSA-N 2 0 292.423 2.672 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000841027640 620255474 /nfs/dbraw/zinc/25/54/74/620255474.db2.gz DODTYNRMJNHMMA-BGYNLAARSA-N 2 0 287.451 2.873 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([NH2+]C3CCC3)CC2)c1O ZINC000897981990 620317642 /nfs/dbraw/zinc/31/76/42/620317642.db2.gz UEZAYJGNGNWOIR-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000841038576 620374977 /nfs/dbraw/zinc/37/49/77/620374977.db2.gz ZBYRMNNRRHABKT-QGZVFWFLSA-N 2 0 287.451 2.766 20 10 CFCDRP Cc1cc(C)c([C@@H](C)N[C@@H]2C[NH2+]CC2(C)C)c(O)c1 ZINC000902441185 621081244 /nfs/dbraw/zinc/08/12/44/621081244.db2.gz CNHITVAEOMQACZ-TZMCWYRMSA-N 2 0 262.397 2.658 20 10 CFCDRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000902487066 621112122 /nfs/dbraw/zinc/11/21/22/621112122.db2.gz JFAWQOANKYTVHD-NOLJZWGESA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841081361 621820706 /nfs/dbraw/zinc/82/07/06/621820706.db2.gz VNUMRUNITHSISX-OAHLLOKOSA-N 2 0 275.440 2.894 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087889 622312441 /nfs/dbraw/zinc/31/24/41/622312441.db2.gz RETVGDNEWGNPSI-ZBFHGGJFSA-N 2 0 274.408 2.665 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534386 622918261 /nfs/dbraw/zinc/91/82/61/622918261.db2.gz SLXZQRZXFDZYJI-QGZVFWFLSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000044534191 622918349 /nfs/dbraw/zinc/91/83/49/622918349.db2.gz YSAMYUWTTOGDLH-KBPBESRZSA-N 2 0 262.397 2.693 20 10 CFCDRP C[C@H](C[NH2+]Cc1cc(F)ccc1O)C[NH+]1CCCCC1 ZINC000226585460 623083807 /nfs/dbraw/zinc/08/38/07/623083807.db2.gz CYMIWBVDHPOKLJ-CYBMUJFWSA-N 2 0 280.387 2.743 20 10 CFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000227330708 623105572 /nfs/dbraw/zinc/10/55/72/623105572.db2.gz DSEZLPXNRNBEJV-UHFFFAOYSA-N 2 0 282.815 2.867 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000817959324 625963932 /nfs/dbraw/zinc/96/39/32/625963932.db2.gz ASRFDJINFSVCIU-LBPRGKRZSA-N 2 0 250.386 2.869 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)[C@H](C)[NH3+])c1O ZINC000817979216 625972331 /nfs/dbraw/zinc/97/23/31/625972331.db2.gz IVAAUJNMDYEXJU-AEJSXWLSSA-N 2 0 256.777 2.740 20 10 CFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921978287 626189701 /nfs/dbraw/zinc/18/97/01/626189701.db2.gz CZRQDOQDYWOJTP-UHFFFAOYSA-N 2 0 288.435 2.833 20 10 CFCDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922181108 626232805 /nfs/dbraw/zinc/23/28/05/626232805.db2.gz NBAJGNGSQKXUAO-OAHLLOKOSA-N 2 0 288.435 2.833 20 10 CFCDRP Cc1cc(C[NH2+][C@](C)(C[NH3+])C(C)C)ccc1N(C)C ZINC000923296443 626463747 /nfs/dbraw/zinc/46/37/47/626463747.db2.gz RWSQRQYBYMZGHH-MRXNPFEDSA-N 2 0 263.429 2.524 20 10 CFCDRP Cc1cc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)ccc1N(C)C ZINC000923348580 626467792 /nfs/dbraw/zinc/46/77/92/626467792.db2.gz ICQWFIDRIWGPBR-OAHLLOKOSA-N 2 0 275.440 2.622 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2ccc(N(C)C)c(C)c2)CC[C@H]1[NH3+] ZINC000923346475 626468442 /nfs/dbraw/zinc/46/84/42/626468442.db2.gz YSONQNWKNRLGDZ-JKSUJKDBSA-N 2 0 275.440 2.620 20 10 CFCDRP CCOc1cccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1O ZINC000839182903 626529965 /nfs/dbraw/zinc/52/99/65/626529965.db2.gz RIKBBZVJQCIPRF-AWEZNQCLSA-N 2 0 292.423 2.612 20 10 CFCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C)[C@@H](C)C1 ZINC000766029953 627172824 /nfs/dbraw/zinc/17/28/24/627172824.db2.gz QTDCAKTWJSKADM-YJBOKZPZSA-N 2 0 289.467 2.881 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC4)C3)cc2)CC1 ZINC000770672603 627540276 /nfs/dbraw/zinc/54/02/76/627540276.db2.gz AUAAMUOLXKUUKR-UHFFFAOYSA-N 2 0 299.462 2.814 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CC3(C)C)cc2)CC1 ZINC000771837804 627636114 /nfs/dbraw/zinc/63/61/14/627636114.db2.gz SBVBYYLTTAWJIP-MRXNPFEDSA-N 2 0 287.451 2.574 20 10 CFCDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775639275 628048830 /nfs/dbraw/zinc/04/88/30/628048830.db2.gz RVGRKAUSCWSXCD-INIZCTEOSA-N 2 0 287.451 2.813 20 10 CFCDRP CC[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775663240 628051324 /nfs/dbraw/zinc/05/13/24/628051324.db2.gz LIQCQILESCDFTD-KRWDZBQOSA-N 2 0 287.451 2.813 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2O)C[C@H]1C ZINC000779027973 628346874 /nfs/dbraw/zinc/34/68/74/628346874.db2.gz UKODJLYYVSNVTF-UKRRQHHQSA-N 2 0 262.397 2.697 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000835061592 629363696 /nfs/dbraw/zinc/36/36/96/629363696.db2.gz IDNWLNMPKBBNKJ-UHFFFAOYSA-N 2 0 275.440 2.717 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000841007980 631303446 /nfs/dbraw/zinc/30/34/46/631303446.db2.gz VZYGNYILEDGKPF-HUUCEWRRSA-N 2 0 276.424 2.992 20 10 CFCDRP CCC([NH3+])(CC)CNC/C=C/c1ccc(N(C)C)cc1 ZINC000841028360 631309250 /nfs/dbraw/zinc/30/92/50/631309250.db2.gz BRORTHQPUJGAAW-BQYQJAHWSA-N 2 0 275.440 2.873 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031012 631311509 /nfs/dbraw/zinc/31/15/09/631311509.db2.gz QTTQJDBQHNCAJN-GXFFZTMASA-N 2 0 298.814 2.661 20 10 CFCDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841031681 631312198 /nfs/dbraw/zinc/31/21/98/631312198.db2.gz VKYSBRWPFBAPEW-AEFFLSMTSA-N 2 0 287.451 2.894 20 10 CFCDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000841055794 631323688 /nfs/dbraw/zinc/32/36/88/631323688.db2.gz WQLHSYXZRFZPLR-JKSUJKDBSA-N 2 0 273.424 2.646 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1O ZINC000841057431 631323759 /nfs/dbraw/zinc/32/37/59/631323759.db2.gz MOVPPIHXADWUBJ-HNNXBMFYSA-N 2 0 282.815 2.833 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1O ZINC000841058486 631325642 /nfs/dbraw/zinc/32/56/42/631325642.db2.gz RYURJGGYBUMCOA-CHWSQXEVSA-N 2 0 268.788 2.714 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c1O ZINC000841078180 631332260 /nfs/dbraw/zinc/33/22/60/631332260.db2.gz FNXONBDOKUMUPM-CYBMUJFWSA-N 2 0 280.799 2.586 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H](C)CCCC[NH3+])c1O ZINC000841081690 631333021 /nfs/dbraw/zinc/33/30/21/631333021.db2.gz ZYHRABHKJURANG-SNVBAGLBSA-N 2 0 286.803 2.661 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000841081251 631333473 /nfs/dbraw/zinc/33/34/73/631333473.db2.gz ZLZRRVPUUSDRCN-KRWDZBQOSA-N 2 0 287.451 2.765 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1O ZINC000841083931 631334180 /nfs/dbraw/zinc/33/41/80/631334180.db2.gz UGWYXCAXRBPXJZ-HDJSIYSDSA-N 2 0 262.397 2.555 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1O ZINC000841086486 631335436 /nfs/dbraw/zinc/33/54/36/631335436.db2.gz JNPZJDZFRCUXIA-ZBFHGGJFSA-N 2 0 274.408 2.665 20 10 CFCDRP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CC[NH2+]CC1 ZINC000843045485 631813234 /nfs/dbraw/zinc/81/32/34/631813234.db2.gz JJVBVVOUQTXTEO-UHFFFAOYSA-N 2 0 287.451 2.861 20 10 CFCDRP CC[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000843050208 631815441 /nfs/dbraw/zinc/81/54/41/631815441.db2.gz BUDAEFNTNCHFKG-BHMLKFMNSA-N 2 0 287.451 2.825 20 10 CFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1[NH3+] ZINC000843051940 631816115 /nfs/dbraw/zinc/81/61/15/631816115.db2.gz MYUGFGNSRWFQJA-CRAIPNDOSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CCC([C@@H](C)[NH3+])CC2)cc1C ZINC000843051723 631816596 /nfs/dbraw/zinc/81/65/96/631816596.db2.gz CQKUKBVLIIFWDP-CYBMUJFWSA-N 2 0 262.397 2.568 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c(Cl)c1 ZINC000843051750 631817082 /nfs/dbraw/zinc/81/70/82/631817082.db2.gz KYXWOAGJQFFOIB-VXGBXAGGSA-N 2 0 282.815 2.913 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1F ZINC000843057082 631820044 /nfs/dbraw/zinc/82/00/44/631820044.db2.gz GAPDYGNNZQGMAU-DZGCQCFKSA-N 2 0 293.430 2.841 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc1C ZINC000843059061 631821727 /nfs/dbraw/zinc/82/17/27/631821727.db2.gz DULBQMYCOMWMEP-NUEKZKHPSA-N 2 0 274.408 2.568 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c(Cl)c1 ZINC000843059693 631823680 /nfs/dbraw/zinc/82/36/80/631823680.db2.gz PXDMPRQEZGDSRR-HUBLWGQQSA-N 2 0 294.826 2.913 20 10 CFCDRP Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1O ZINC000843112572 631838778 /nfs/dbraw/zinc/83/87/78/631838778.db2.gz HRVAIIIGBCOEEV-LBPRGKRZSA-N 2 0 282.815 2.915 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125532 631845346 /nfs/dbraw/zinc/84/53/46/631845346.db2.gz BAXZTEHLCIARMC-IRXDYDNUSA-N 2 0 287.451 2.574 20 10 CFCDRP CN1CCCc2cc(C[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)ccc21 ZINC000843342872 631932683 /nfs/dbraw/zinc/93/26/83/631932683.db2.gz QVJBSWQKYXDCJI-KZNAEPCWSA-N 2 0 299.462 2.547 20 10 CFCDRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000843343892 631933346 /nfs/dbraw/zinc/93/33/46/631933346.db2.gz KHEBAIRFXPKOLQ-OAHLLOKOSA-N 2 0 268.360 2.628 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000844220323 632136161 /nfs/dbraw/zinc/13/61/61/632136161.db2.gz DAUTXXHYKQHPIT-INIZCTEOSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c(F)c2)[C@H]1CC[NH3+] ZINC000844900661 632330999 /nfs/dbraw/zinc/33/09/99/632330999.db2.gz CIODMKMWLINTNP-BBRMVZONSA-N 2 0 293.430 2.841 20 10 CFCDRP CN(C)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000844905087 632332195 /nfs/dbraw/zinc/33/21/95/632332195.db2.gz VHSUBFOYJRWILG-UHFFFAOYSA-N 2 0 287.382 2.640 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)c1 ZINC000844923909 632337500 /nfs/dbraw/zinc/33/75/00/632337500.db2.gz IQDQEONZZFLTNW-CYBMUJFWSA-N 2 0 262.397 2.741 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC34CCCC4)cc2)CC1 ZINC000845999975 632611304 /nfs/dbraw/zinc/61/13/04/632611304.db2.gz MOHLVZBKJBSZKU-UHFFFAOYSA-N 2 0 299.462 2.957 20 10 CFCDRP [NH3+]C1(C[NH2+][C@@H]2CCc3cccc(O)c32)CCCCC1 ZINC000817938217 632743257 /nfs/dbraw/zinc/74/32/57/632743257.db2.gz GXNPZRXJZFVZSI-CYBMUJFWSA-N 2 0 260.381 2.631 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817940126 632744382 /nfs/dbraw/zinc/74/43/82/632744382.db2.gz FKEZBASTUGNHKZ-ZWNOBZJWSA-N 2 0 278.371 2.669 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c(O)c1 ZINC000817941258 632745042 /nfs/dbraw/zinc/74/50/42/632745042.db2.gz OVPCTJVCXUGXME-CYBMUJFWSA-N 2 0 262.397 2.659 20 10 CFCDRP CC[NH2+]CCC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000817942860 632746679 /nfs/dbraw/zinc/74/66/79/632746679.db2.gz FZOAWBHYFKTNNQ-MRXNPFEDSA-N 2 0 263.429 2.793 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)ccc1O ZINC000817949948 632750589 /nfs/dbraw/zinc/75/05/89/632750589.db2.gz UTGHRWQUEDEJEB-LBPRGKRZSA-N 2 0 288.366 2.883 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000817959907 632757960 /nfs/dbraw/zinc/75/79/60/632757960.db2.gz HBZNPSHHLOGHOH-LLVKDONJSA-N 2 0 266.385 2.569 20 10 CFCDRP CC[C@@H]([NH2+]CC(C)(C)[NH3+])c1cc(Cl)ccc1O ZINC000817959697 632758259 /nfs/dbraw/zinc/75/82/59/632758259.db2.gz GSXITRCHHKQLNM-LLVKDONJSA-N 2 0 256.777 2.824 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCC2)c2c1c(F)ccc2O ZINC000817965053 632763369 /nfs/dbraw/zinc/76/33/69/632763369.db2.gz ODXMKZITXVHQHJ-GXSJLCMTSA-N 2 0 264.344 2.551 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000817966122 632765075 /nfs/dbraw/zinc/76/50/75/632765075.db2.gz GVVOCNDZRSXXBE-CJNGLKHVSA-N 2 0 262.397 2.741 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c(O)c1 ZINC000817970279 632768586 /nfs/dbraw/zinc/76/85/86/632768586.db2.gz QMNBDHCDUDQSLO-HZSPNIEDSA-N 2 0 262.397 2.658 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(O)c1 ZINC000817970105 632768635 /nfs/dbraw/zinc/76/86/35/632768635.db2.gz LIGFPXPBXZTAIX-BFHYXJOUSA-N 2 0 262.397 2.930 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(O)c1C ZINC000817969922 632768928 /nfs/dbraw/zinc/76/89/28/632768928.db2.gz IICXXGRWWRSVOQ-BFHYXJOUSA-N 2 0 262.397 2.930 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000817969618 632768994 /nfs/dbraw/zinc/76/89/94/632768994.db2.gz FBUBCXWKAJCWDU-VHDGCEQUSA-N 2 0 262.397 2.739 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000817972648 632772480 /nfs/dbraw/zinc/77/24/80/632772480.db2.gz ZGFOHJTYSXDXKS-JQFCIGGWSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000817977604 632775154 /nfs/dbraw/zinc/77/51/54/632775154.db2.gz LHWVTDVFXVPUCQ-UMNHJUIQSA-N 2 0 266.360 2.797 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000817981427 632777703 /nfs/dbraw/zinc/77/77/03/632777703.db2.gz JFUSBLYDDCYHEA-LZWOXQAQSA-N 2 0 275.440 2.921 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1 ZINC000817986683 632781978 /nfs/dbraw/zinc/78/19/78/632781978.db2.gz STEXXNIBIIYOCS-ZDUSSCGKSA-N 2 0 260.381 2.661 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000817987019 632782171 /nfs/dbraw/zinc/78/21/71/632782171.db2.gz PDZGHYXZTNUURD-BYNSBNAKSA-N 2 0 274.408 2.739 20 10 CFCDRP Cc1ccc(O)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)c1 ZINC000818431963 632843171 /nfs/dbraw/zinc/84/31/71/632843171.db2.gz YECSUJWESSCVDK-CQSZACIVSA-N 2 0 274.408 2.665 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c1O ZINC000848910824 633395012 /nfs/dbraw/zinc/39/50/12/633395012.db2.gz ACGBRZBTBDWUPM-WBVHZDCISA-N 2 0 288.435 2.871 20 10 CFCDRP Oc1ccc(F)cc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849349540 633625797 /nfs/dbraw/zinc/62/57/97/633625797.db2.gz CKIKPHYZWNEDBN-AWEZNQCLSA-N 2 0 292.398 2.743 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000849350712 633626303 /nfs/dbraw/zinc/62/63/03/633626303.db2.gz SJOLKNBIRASJQZ-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1 ZINC000849350540 633626374 /nfs/dbraw/zinc/62/63/74/633626374.db2.gz PSOIVKMYYIBWAZ-MRXNPFEDSA-N 2 0 288.435 2.912 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCC(C)(C)F)cc2)CC1 ZINC000850375139 633963621 /nfs/dbraw/zinc/96/36/21/633963621.db2.gz VZUBQRSTRCVBTO-UHFFFAOYSA-N 2 0 293.430 2.666 20 10 CFCDRP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(N(C)C)cc1 ZINC000854222794 635262532 /nfs/dbraw/zinc/26/25/32/635262532.db2.gz KOYYQHKWNLZZHO-ZDUSSCGKSA-N 2 0 261.413 2.675 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)c2c1c(F)ccc2O ZINC000854224471 635263150 /nfs/dbraw/zinc/26/31/50/635263150.db2.gz XRIFTJCMELUFLD-PWSUYJOCSA-N 2 0 278.371 2.941 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC(CC4CC4)C3)cc2)CC1 ZINC000857066815 635923345 /nfs/dbraw/zinc/92/33/45/635923345.db2.gz WOYUSAHKSJJVQZ-UHFFFAOYSA-N 2 0 299.462 2.670 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000862482289 637397807 /nfs/dbraw/zinc/39/78/07/637397807.db2.gz GCLFYTKEINPBAP-INIZCTEOSA-N 2 0 289.467 2.883 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1C ZINC000872252758 641719362 /nfs/dbraw/zinc/71/93/62/641719362.db2.gz VKJQEGHIKFQWBP-HNNXBMFYSA-N 2 0 276.424 2.871 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1O ZINC000873240379 642091077 /nfs/dbraw/zinc/09/10/77/642091077.db2.gz PQHLSIJCZGTZKB-YDHLFZDLSA-N 2 0 262.397 2.950 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000873254579 642100014 /nfs/dbraw/zinc/10/00/14/642100014.db2.gz XIUOGRGCJSZWGW-BJJXKVORSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(Br)ccc1O ZINC000873258667 642103740 /nfs/dbraw/zinc/10/37/40/642103740.db2.gz USUNGDOUESJJOV-QXEWZRGKSA-N 2 0 299.212 2.543 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(Cl)ccc1O ZINC000873259089 642104557 /nfs/dbraw/zinc/10/45/57/642104557.db2.gz YXLPKCLRKAFIAC-GAFUQQFSSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(F)ccc1O ZINC000873271052 642112689 /nfs/dbraw/zinc/11/26/89/642112689.db2.gz DHLFTXSZCYFJSZ-QWRGUYRKSA-N 2 0 266.360 2.570 20 10 CFCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+]CC1CC1 ZINC000125504237 642650929 /nfs/dbraw/zinc/65/09/29/642650929.db2.gz AGAPRLLAJIRRIK-UHFFFAOYSA-N 2 0 299.462 2.718 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)cc2O)[C@@H](C)C1 ZINC000876763597 643000444 /nfs/dbraw/zinc/00/04/44/643000444.db2.gz LCHHFCJLJKPNNG-GOEBONIOSA-N 2 0 276.424 2.863 20 10 CFCDRP [NH3+]CCC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000128334614 644642386 /nfs/dbraw/zinc/64/23/86/644642386.db2.gz WDOAONYBULOJSW-UHFFFAOYSA-N 2 0 268.788 2.606 20 10 CFCDRP CC[NH2+]CC1CC[NH+](Cc2cccc(OCC)c2O)CC1 ZINC000129900742 645425901 /nfs/dbraw/zinc/42/59/01/645425901.db2.gz SWPJBAPXHYAEAP-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000133377383 646079289 /nfs/dbraw/zinc/07/92/89/646079289.db2.gz GNCSUOUPOMHSRM-INIZCTEOSA-N 2 0 263.429 2.558 20 10 CFCDRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000924647526 648017961 /nfs/dbraw/zinc/01/79/61/648017961.db2.gz HSTYFNWRVLQJMH-JJTKIYQPSA-N 2 0 299.462 2.717 20 10 CFCDRP CCC1([NH3+])CC[NH+]([C@H]2CCc3cccc(O)c32)CC1 ZINC000925759701 648311763 /nfs/dbraw/zinc/31/17/63/648311763.db2.gz KFZAESDMSULKOX-ZDUSSCGKSA-N 2 0 260.381 2.583 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000925784197 648321909 /nfs/dbraw/zinc/32/19/09/648321909.db2.gz IFAHCTLVJZHRHL-IOASZLSFSA-N 2 0 288.435 2.777 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1O ZINC000925783140 648322304 /nfs/dbraw/zinc/32/23/04/648322304.db2.gz CQKJLQLPURNTOW-WOPDTQHZSA-N 2 0 282.815 2.860 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925787195 648324334 /nfs/dbraw/zinc/32/43/34/648324334.db2.gz XBNBWDLQPSBJND-HNCHTBHHSA-N 2 0 278.371 2.525 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)c1 ZINC000925845098 648342958 /nfs/dbraw/zinc/34/29/58/648342958.db2.gz KBXPEMTZTKMSFN-JCURWCKSSA-N 2 0 290.407 2.584 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(CC)c2O)C1 ZINC000693036268 770128754 /nfs/dbraw/zinc/12/87/54/770128754.db2.gz RNPWWSXWRPOHHD-CQSZACIVSA-N 2 0 276.424 2.776 20 10 CFCDRP Oc1cccc2c1[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CC2 ZINC000313193787 776236670 /nfs/dbraw/zinc/23/66/70/776236670.db2.gz MRUKYGANZKTCEU-SOUVJXGZSA-N 2 0 272.392 2.596 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c(O)c1 ZINC000925779387 776537042 /nfs/dbraw/zinc/53/70/42/776537042.db2.gz YIWORWRLANVEAW-STQMWFEESA-N 2 0 298.377 2.904 20 10 CFCDRP CN(C)c1ccc(CN2CC[C@H]3C[NH2+]C[C@H]32)c2ccccc21 ZINC001235006637 778351938 /nfs/dbraw/zinc/35/19/38/778351938.db2.gz KQXAFFPRDLCUIW-IFXJQAMLSA-N 2 0 295.430 2.700 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235424373 778486240 /nfs/dbraw/zinc/48/62/40/778486240.db2.gz HNOOKQIHZRSMQO-CVEARBPZSA-N 2 0 288.435 2.912 20 10 CFCDRP CC(C)[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)CC1CC1 ZINC001235694276 778539846 /nfs/dbraw/zinc/53/98/46/778539846.db2.gz AXFGZWPNNKFOBD-UHFFFAOYSA-N 2 0 287.451 2.717 20 10 CFCDRP Cc1cc(C[NH+]2CC(CC[NH3+])C2)c(C)n1-c1ccccc1 ZINC001235918528 778608900 /nfs/dbraw/zinc/60/89/00/778608900.db2.gz FBEMHGNFLYMSAA-UHFFFAOYSA-N 2 0 283.419 2.875 20 10 CFCDRP CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)c1 ZINC001235941651 778619118 /nfs/dbraw/zinc/61/91/18/778619118.db2.gz WQFVPNNZNKPNNC-HIFRSBDPSA-N 2 0 288.435 2.731 20 10 CFCDRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001205093586 779162515 /nfs/dbraw/zinc/16/25/15/779162515.db2.gz BRIUZZAFPLVQCL-MRXNPFEDSA-N 2 0 273.424 2.600 20 10 CFCDRP C[N@H+](CCCCCC[NH3+])Cc1c(O)cccc1Cl ZINC000710748251 781337303 /nfs/dbraw/zinc/33/73/03/781337303.db2.gz ASZOHVCZUYJLEL-UHFFFAOYSA-N 2 0 270.804 2.997 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000049554090 373310528 /nfs/dbraw/zinc/31/05/28/373310528.db2.gz ZNMRKVDZCLYOFO-ZIAGYGMSSA-N 2 0 263.429 2.743 20 10 CFCDRP CN1CCCc2cc(C[NH2+]C3CCN(C4CC4)CC3)ccc21 ZINC000263879294 383689630 /nfs/dbraw/zinc/68/96/30/383689630.db2.gz ACBPEDPGOWSGFS-UHFFFAOYSA-N 2 0 299.462 2.785 20 10 CFCDRP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccccc1O ZINC000128447761 377337752 /nfs/dbraw/zinc/33/77/52/377337752.db2.gz BIWOVCCBULHPCG-HNNXBMFYSA-N 2 0 262.397 2.698 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[NH+]4CCCC[C@H]4[C@H]3C2)cc1 ZINC000371403532 381616629 /nfs/dbraw/zinc/61/66/29/381616629.db2.gz SWRMTTUXGBAJAD-NEWSRXKRSA-N 2 0 299.462 2.669 20 10 CFCDRP C[C@@H]1CCC[N@@H+]1C1CCN(Cc2cccc(F)c2O)CC1 ZINC000378493348 382472899 /nfs/dbraw/zinc/47/28/99/382472899.db2.gz IOUXPQAOZSAOCW-CYBMUJFWSA-N 2 0 292.398 2.980 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H](c3nccn3C)C2)cc1C ZINC000366814182 382550892 /nfs/dbraw/zinc/55/08/92/382550892.db2.gz KNDWESMHQULQGT-AWEZNQCLSA-N 2 0 285.391 2.732 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(F)ccc1O ZINC000251750379 383395305 /nfs/dbraw/zinc/39/53/05/383395305.db2.gz RAWUUUKHGQBCSA-YUTCNCBUSA-N 2 0 278.371 2.809 20 10 CFCDRP CC[C@H]([NH2+]CCn1ccnc1C)c1ccc(N(C)C)cc1 ZINC000268799033 384663661 /nfs/dbraw/zinc/66/36/61/384663661.db2.gz ITOSKQSSXXZPDL-KRWDZBQOSA-N 2 0 286.423 2.998 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCC2)c(O)c1 ZINC000020129201 171016899 /nfs/dbraw/zinc/01/68/99/171016899.db2.gz GTAIMXNJXMHRRI-CQSZACIVSA-N 2 0 262.397 2.837 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000071406456 176155755 /nfs/dbraw/zinc/15/57/55/176155755.db2.gz VGIRGIDOSRSHLT-UHFFFAOYSA-N 2 0 262.397 2.666 20 10 CFCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)ccc3O)CC[C@H]21 ZINC000228183249 523833378 /nfs/dbraw/zinc/83/33/78/523833378.db2.gz XZIJPZZQSAQDIR-IUODEOHRSA-N 2 0 294.826 2.962 20 10 CFCDRP Cc1cccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1O ZINC000290454520 524408456 /nfs/dbraw/zinc/40/84/56/524408456.db2.gz MMEFLZRCZAHKAD-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1cccc(C[NH2+]CCC[NH+]2CCC(C)CC2)c1O ZINC000158079930 524433050 /nfs/dbraw/zinc/43/30/50/524433050.db2.gz ZLRHVRHBPGDBCK-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617919 524477368 /nfs/dbraw/zinc/47/73/68/524477368.db2.gz WAGUPFMIBCMRKV-QWRGUYRKSA-N 2 0 254.349 2.522 20 10 CFCDRP C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1)C[NH+]1CCCC1 ZINC000057993876 524486159 /nfs/dbraw/zinc/48/61/59/524486159.db2.gz FBRGKOQJYIIXFE-OAHLLOKOSA-N 2 0 275.440 2.574 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)c1 ZINC000062077812 524772131 /nfs/dbraw/zinc/77/21/31/524772131.db2.gz WCSMEJYHCCYKHA-KBPBESRZSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649273 524773118 /nfs/dbraw/zinc/77/31/18/524773118.db2.gz MQFWPARJOBDXRJ-QWHCGFSZSA-N 2 0 290.407 2.536 20 10 CFCDRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1cc(F)ccc1O ZINC000094616606 525414491 /nfs/dbraw/zinc/41/44/91/525414491.db2.gz MIYATHRIBVTAGO-LLVKDONJSA-N 2 0 268.376 2.770 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c(O)c1 ZINC000037649049 525727924 /nfs/dbraw/zinc/72/79/24/525727924.db2.gz IAACUQGPBGHZGM-KGLIPLIRSA-N 2 0 274.408 2.836 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)c(O)c1C ZINC000293266325 525729211 /nfs/dbraw/zinc/72/92/11/525729211.db2.gz CFDXFAPKNSZTIK-BXUZGUMPSA-N 2 0 264.413 2.857 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(O)c1 ZINC000157552651 525946501 /nfs/dbraw/zinc/94/65/01/525946501.db2.gz LUCHVOCJUVLUGI-SOUVJXGZSA-N 2 0 274.408 2.978 20 10 CFCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000743399132 574362698 /nfs/dbraw/zinc/36/26/98/574362698.db2.gz QREYFTPWEGUHMB-CQSZACIVSA-N 2 0 288.435 2.655 20 10 CFCDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccc(N(C)C)cc1 ZINC000843343763 617821198 /nfs/dbraw/zinc/82/11/98/617821198.db2.gz XRDMZDOMKNTVGY-CQSZACIVSA-N 2 0 263.429 2.922 20 10 CFCDRP CN1CCCc2cc(C[NH2+]CC3CC[NH+](C)CC3)ccc21 ZINC000050286904 618090069 /nfs/dbraw/zinc/09/00/69/618090069.db2.gz OGMXKBGKTFWCKT-UHFFFAOYSA-N 2 0 287.451 2.500 20 10 CFCDRP c1csc(SCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)n1 ZINC000166644144 618706854 /nfs/dbraw/zinc/70/68/54/618706854.db2.gz DJYGONWTAINUEW-CHWSQXEVSA-N 2 0 297.493 2.842 20 10 CFCDRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C12CCC2 ZINC000925542695 618902903 /nfs/dbraw/zinc/90/29/03/618902903.db2.gz IORRWGGJVAWGIZ-IAGOWNOFSA-N 2 0 285.435 2.646 20 10 CFCDRP Nc1ccc(CC[NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1 ZINC000925691925 618936626 /nfs/dbraw/zinc/93/66/26/618936626.db2.gz KVOODOUIPLHFQC-ROUUACIJSA-N 2 0 287.451 2.569 20 10 CFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(C)cc(OC)c2O)C1 ZINC000894212255 619265908 /nfs/dbraw/zinc/26/59/08/619265908.db2.gz XWBDBALYLOALNX-CQSZACIVSA-N 2 0 292.423 2.531 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cc(C)cc(OC)c1O ZINC000894776665 619462810 /nfs/dbraw/zinc/46/28/10/619462810.db2.gz JGHRXBSUGXFQRT-UHFFFAOYSA-N 2 0 294.439 2.873 20 10 CFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000841005787 620212013 /nfs/dbraw/zinc/21/20/13/620212013.db2.gz KDTSXOPIIXVLAX-NVXWUHKLSA-N 2 0 289.467 2.963 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H]4CCC[C@H]34)cc2)CC1 ZINC000897955569 620310940 /nfs/dbraw/zinc/31/09/40/620310940.db2.gz WPZRMNUMMSWFKB-YTQUADARSA-N 2 0 299.462 2.717 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@H]1CC[NH3+] ZINC000903978509 621494047 /nfs/dbraw/zinc/49/40/47/621494047.db2.gz OPXVCVSMWHIPDT-XQJUWPJRSA-N 2 0 287.451 2.683 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904305864 621569438 /nfs/dbraw/zinc/56/94/38/621569438.db2.gz VZQKJGDNHZUWII-IYBDPMFKSA-N 2 0 275.440 2.702 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c(O)c1 ZINC000044534195 622918053 /nfs/dbraw/zinc/91/80/53/622918053.db2.gz YSAMYUWTTOGDLH-UONOGXRCSA-N 2 0 262.397 2.693 20 10 CFCDRP COc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1C ZINC000057994472 623025247 /nfs/dbraw/zinc/02/52/47/623025247.db2.gz GTSMKANNEGAHEP-AWEZNQCLSA-N 2 0 276.424 2.825 20 10 CFCDRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC000227376312 623108673 /nfs/dbraw/zinc/10/86/73/623108673.db2.gz XPWOTPJIPXZJTA-ZFWWWQNUSA-N 2 0 262.397 2.576 20 10 CFCDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Br)cc1O ZINC000817936428 625963345 /nfs/dbraw/zinc/96/33/45/625963345.db2.gz OMSDMZNRNSOBBJ-VIFPVBQESA-N 2 0 299.212 2.557 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c(O)c1C ZINC000817977410 625973272 /nfs/dbraw/zinc/97/32/72/625973272.db2.gz JQLYPYWQWNUFPJ-YPMHNXCESA-N 2 0 250.386 2.787 20 10 CFCDRP CC(C)C(C)(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771843608 625985362 /nfs/dbraw/zinc/98/53/62/625985362.db2.gz IWMJRCNVDXQUBP-UHFFFAOYSA-N 2 0 289.467 2.963 20 10 CFCDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000839183100 626530002 /nfs/dbraw/zinc/53/00/02/626530002.db2.gz UAICPJSQCXKSIU-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)cc1C ZINC000843052736 626549330 /nfs/dbraw/zinc/54/93/30/626549330.db2.gz WANFKSAXZIHCAV-KBPBESRZSA-N 2 0 262.397 2.568 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C)[C@@H](C)C1 ZINC000766029951 627172538 /nfs/dbraw/zinc/17/25/38/627172538.db2.gz QTDCAKTWJSKADM-MAUKXSAKSA-N 2 0 289.467 2.881 20 10 CFCDRP CCOc1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c(O)c1 ZINC000768546980 627352654 /nfs/dbraw/zinc/35/26/54/627352654.db2.gz LUXFBBCROSTZKD-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP CC[NH+](CC)C[C@H]1CCN(Cc2c(O)cccc2OC)C1 ZINC000769502859 627448648 /nfs/dbraw/zinc/44/86/48/627448648.db2.gz BVUHFFLQINCXLO-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000771834880 627636013 /nfs/dbraw/zinc/63/60/13/627636013.db2.gz FRGSOLZBAHTEFH-OAHLLOKOSA-N 2 0 289.467 2.963 20 10 CFCDRP CC[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775663241 628050940 /nfs/dbraw/zinc/05/09/40/628050940.db2.gz LIQCQILESCDFTD-QGZVFWFLSA-N 2 0 287.451 2.813 20 10 CFCDRP C[C@H]1CC[C@H](C)[NH+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737527 628061411 /nfs/dbraw/zinc/06/14/11/628061411.db2.gz OGROOFYMKKRCTP-HOTGVXAUSA-N 2 0 287.451 2.811 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c(Cl)c1 ZINC000843128191 630823124 /nfs/dbraw/zinc/82/31/24/630823124.db2.gz IKZMFPQVLHTLDQ-ZJUUUORDSA-N 2 0 256.777 2.569 20 10 CFCDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000840810366 631228298 /nfs/dbraw/zinc/22/82/98/631228298.db2.gz SOAFTDIGRQQMSZ-OLZOCXBDSA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cc(F)ccc1O ZINC000840810367 631228517 /nfs/dbraw/zinc/22/85/17/631228517.db2.gz SOAFTDIGRQQMSZ-QWHCGFSZSA-N 2 0 280.387 2.914 20 10 CFCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840881616 631250032 /nfs/dbraw/zinc/25/00/32/631250032.db2.gz OWRBKIZFKKGEEH-LBPRGKRZSA-N 2 0 282.815 2.785 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(OCC)cc1O ZINC000809757911 631282364 /nfs/dbraw/zinc/28/23/64/631282364.db2.gz ZVXQDHAXLUWJLJ-UHFFFAOYSA-N 2 0 294.439 2.955 20 10 CFCDRP COc1ccc(O)c(CNCC[NH2+]C2CCCCCC2)c1 ZINC000841028242 631309395 /nfs/dbraw/zinc/30/93/95/631309395.db2.gz NCUGMIZJLORXOT-UHFFFAOYSA-N 2 0 292.423 2.803 20 10 CFCDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000841029249 631310358 /nfs/dbraw/zinc/31/03/58/631310358.db2.gz NAQAQFKKIKPQDT-GFCCVEGCSA-N 2 0 256.349 2.702 20 10 CFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841030981 631311942 /nfs/dbraw/zinc/31/19/42/631311942.db2.gz QNYJTPOSAWJIEE-DOTOQJQBSA-N 2 0 273.424 2.504 20 10 CFCDRP CCN(CC)c1ccc(CNC[C@H]2CCCC[NH2+]2)cc1 ZINC000841032939 631313019 /nfs/dbraw/zinc/31/30/19/631313019.db2.gz KFYOGUNIYVENDE-MRXNPFEDSA-N 2 0 275.440 2.765 20 10 CFCDRP CCOc1ccc(C[NH2+]CC2([NH3+])CCCCC2)c(O)c1 ZINC000841039172 631316325 /nfs/dbraw/zinc/31/63/25/631316325.db2.gz DROBCGHUVZHESW-UHFFFAOYSA-N 2 0 278.396 2.542 20 10 CFCDRP [NH3+]C1(C[NH2+]Cc2cc(F)ccc2O)CCCCCC1 ZINC000841042424 631319433 /nfs/dbraw/zinc/31/94/33/631319433.db2.gz HAPCGVYDTGMHFU-UHFFFAOYSA-N 2 0 266.360 2.673 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c1O ZINC000841057432 631323412 /nfs/dbraw/zinc/32/34/12/631323412.db2.gz MOVPPIHXADWUBJ-OAHLLOKOSA-N 2 0 282.815 2.833 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000841058131 631325692 /nfs/dbraw/zinc/32/56/92/631325692.db2.gz PXBNOWMEYIOWPR-MRXNPFEDSA-N 2 0 275.440 2.765 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+][C@H]2CC[NH2+]CC2(C)C)cc1 ZINC000841072985 631330690 /nfs/dbraw/zinc/33/06/90/631330690.db2.gz OLQUOQGYTICOEJ-RTRPANQVSA-N 2 0 287.451 2.744 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1F ZINC000841079635 631333249 /nfs/dbraw/zinc/33/32/49/631333249.db2.gz LBJHZYQAVYTKBO-ZDUSSCGKSA-N 2 0 281.419 2.889 20 10 CFCDRP [NH3+]CCC[C@H]([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000841087971 631336187 /nfs/dbraw/zinc/33/61/87/631336187.db2.gz WMXODZOFEIELRO-INIZCTEOSA-N 2 0 270.376 2.962 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000841100791 631339302 /nfs/dbraw/zinc/33/93/02/631339302.db2.gz KAOOYMULADRYAF-RDJZCZTQSA-N 2 0 289.467 2.950 20 10 CFCDRP C[NH2+]C[C@@H]1CCCN(Cc2c(O)cc(C)cc2Cl)C1 ZINC000843045280 631812051 /nfs/dbraw/zinc/81/20/51/631812051.db2.gz UECHKFNPFFUSIZ-LBPRGKRZSA-N 2 0 282.815 2.785 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CCC(C[NH3+])CC2)c1O ZINC000843047010 631813022 /nfs/dbraw/zinc/81/30/22/631813022.db2.gz DASJLAXCALOISW-UHFFFAOYSA-N 2 0 268.788 2.525 20 10 CFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1[NH3+] ZINC000843051943 631815799 /nfs/dbraw/zinc/81/57/99/631815799.db2.gz MYUGFGNSRWFQJA-YJBOKZPZSA-N 2 0 287.451 2.846 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000843052866 631816518 /nfs/dbraw/zinc/81/65/18/631816518.db2.gz WVPSDHHCFJVEIC-GOEBONIOSA-N 2 0 275.440 2.620 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@H+](C)C2CCC([NH3+])CC2)cc1 ZINC000843055080 631818454 /nfs/dbraw/zinc/81/84/54/631818454.db2.gz PSFAAXPKROAVHK-SNAWJCMRSA-N 2 0 287.451 2.968 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+](C)C[C@]2(C)CC[NH2+]C2)cc1 ZINC000843060438 631823276 /nfs/dbraw/zinc/82/32/76/631823276.db2.gz IYDDKIYVWAQRGB-GOSISDBHSA-N 2 0 289.467 2.964 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c(Cl)c1 ZINC000843059694 631823655 /nfs/dbraw/zinc/82/36/55/631823655.db2.gz PXDMPRQEZGDSRR-SLEUVZQESA-N 2 0 294.826 2.913 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000843118701 631839916 /nfs/dbraw/zinc/83/99/16/631839916.db2.gz MZQQEOUEIYILFD-JUGMSXHOSA-N 2 0 299.462 2.841 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000843121032 631840993 /nfs/dbraw/zinc/84/09/93/631840993.db2.gz YPIOVCXXWNXPOV-GOSISDBHSA-N 2 0 287.451 2.718 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2CC[NH3+])cc1 ZINC000843123917 631843307 /nfs/dbraw/zinc/84/33/07/631843307.db2.gz RRGKJDYWKMAZHQ-DUMMIQTOSA-N 2 0 287.451 2.969 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1 ZINC000843125523 631845287 /nfs/dbraw/zinc/84/52/87/631845287.db2.gz BAXZTEHLCIARMC-DLBZAZTESA-N 2 0 287.451 2.574 20 10 CFCDRP Oc1ccc(Cl)cc1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000843125891 631845601 /nfs/dbraw/zinc/84/56/01/631845601.db2.gz CCGOZSQRLJZRHT-UHFFFAOYSA-N 2 0 280.799 2.621 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CCCCCC[NH3+])c1O ZINC000843128541 631847477 /nfs/dbraw/zinc/84/74/77/631847477.db2.gz WVTUNKQBNALTCP-UHFFFAOYSA-N 2 0 286.803 2.663 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]CCCCCC[NH3+])cc1 ZINC000843129583 631848819 /nfs/dbraw/zinc/84/88/19/631848819.db2.gz PYVMDRRBJQOKHV-BQYQJAHWSA-N 2 0 275.440 2.875 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000843341400 631931296 /nfs/dbraw/zinc/93/12/96/631931296.db2.gz DOFOJUCFXKTMCO-RCCFBDPRSA-N 2 0 299.462 2.765 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000843341399 631931590 /nfs/dbraw/zinc/93/15/90/631931590.db2.gz DOFOJUCFXKTMCO-OKZBNKHCSA-N 2 0 299.462 2.765 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846138311 632643411 /nfs/dbraw/zinc/64/34/11/632643411.db2.gz QFOQULBRDRZNKD-CYBMUJFWSA-N 2 0 280.412 2.783 20 10 CFCDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846148173 632646952 /nfs/dbraw/zinc/64/69/52/632646952.db2.gz XXUVBTXSQXQFGF-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c1O ZINC000846151358 632647471 /nfs/dbraw/zinc/64/74/71/632647471.db2.gz XAYDQHKYCAAEPK-MJBXVCDLSA-N 2 0 292.423 2.924 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000817894373 632719618 /nfs/dbraw/zinc/71/96/18/632719618.db2.gz MGXZOJOLZXKJRI-IRXDYDNUSA-N 2 0 275.440 2.811 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])cc1 ZINC000817896917 632720916 /nfs/dbraw/zinc/72/09/16/632720916.db2.gz ZDNVXPMSWVRUHZ-CVEARBPZSA-N 2 0 261.413 2.502 20 10 CFCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000817895052 632720959 /nfs/dbraw/zinc/72/09/59/632720959.db2.gz UCXCJSXFKVIABZ-UHFFFAOYSA-N 2 0 275.440 2.668 20 10 CFCDRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901163 632725606 /nfs/dbraw/zinc/72/56/06/632725606.db2.gz STMHFHCRGCPBMX-WMLDXEAASA-N 2 0 287.451 2.547 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1F ZINC000817903723 632727133 /nfs/dbraw/zinc/72/71/33/632727133.db2.gz TVQOMIPYBKHMQT-OLZOCXBDSA-N 2 0 281.419 2.887 20 10 CFCDRP CC[C@H]([NH2+]CCC[NH3+])c1ccc(C(F)(F)F)cc1O ZINC000817938045 632743222 /nfs/dbraw/zinc/74/32/22/632743222.db2.gz CIYTUSDYJLYYIV-NSHDSACASA-N 2 0 276.302 2.801 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(C)cc1O ZINC000817945457 632747778 /nfs/dbraw/zinc/74/77/78/632747778.db2.gz DDKDSCISMXIGOZ-UKRRQHHQSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cc(Cl)ccc1O ZINC000817954706 632754444 /nfs/dbraw/zinc/75/44/44/632754444.db2.gz HHVVEXVUVZBUSU-GHMZBOCLSA-N 2 0 268.788 2.696 20 10 CFCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000817956683 632755378 /nfs/dbraw/zinc/75/53/78/632755378.db2.gz AOLCCLWYVDTAGU-FGTMMUONSA-N 2 0 287.451 2.712 20 10 CFCDRP CC[C@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(C)cc1O ZINC000817959183 632756551 /nfs/dbraw/zinc/75/65/51/632756551.db2.gz PZMXKUZXZYSRFK-KBPBESRZSA-N 2 0 250.386 2.725 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000817957859 632756668 /nfs/dbraw/zinc/75/66/68/632756668.db2.gz PZDHXBKYXJAVDN-UONOGXRCSA-N 2 0 262.397 2.741 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)c1ccc(C)cc1O ZINC000817959187 632757621 /nfs/dbraw/zinc/75/76/21/632757621.db2.gz PZMXKUZXZYSRFK-UONOGXRCSA-N 2 0 250.386 2.725 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)c1ccc(N(C)C)cc1 ZINC000817960379 632759481 /nfs/dbraw/zinc/75/94/81/632759481.db2.gz YMNSDVULONDWRC-CVEARBPZSA-N 2 0 263.429 2.777 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc2c(cc1O)CCCC2 ZINC000817963270 632761417 /nfs/dbraw/zinc/76/14/17/632761417.db2.gz SYXIEHUDKDUFFB-NWDGAFQWSA-N 2 0 262.397 2.516 20 10 CFCDRP CC[C@@H]([NH2+]CC1([NH3+])CCC1)c1ccc(N(C)C)cc1 ZINC000817964643 632762695 /nfs/dbraw/zinc/76/26/95/632762695.db2.gz HAHCDCVIIWGPIW-OAHLLOKOSA-N 2 0 261.413 2.675 20 10 CFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c1O ZINC000817963327 632763136 /nfs/dbraw/zinc/76/31/36/632763136.db2.gz UGUZFDMRRLWSPN-PSASIEDQSA-N 2 0 256.777 2.599 20 10 CFCDRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817965347 632764454 /nfs/dbraw/zinc/76/44/54/632764454.db2.gz PESWUDPWGXBORZ-GFCCVEGCSA-N 2 0 288.313 2.671 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(O)c1C ZINC000817967707 632766062 /nfs/dbraw/zinc/76/60/62/632766062.db2.gz BFXSEXHKEFWADB-KGLIPLIRSA-N 2 0 262.397 2.802 20 10 CFCDRP C[C@H]1C[C@@H]([NH2+]CC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817966982 632766194 /nfs/dbraw/zinc/76/61/94/632766194.db2.gz AZQIWXAUEKDAKW-GXFFZTMASA-N 2 0 276.355 2.589 20 10 CFCDRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(C)cc1O ZINC000817967414 632766360 /nfs/dbraw/zinc/76/63/60/632766360.db2.gz HQZTXXNUYGFDBR-OAHLLOKOSA-N 2 0 260.381 2.661 20 10 CFCDRP CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccccc1O ZINC000817966761 632766870 /nfs/dbraw/zinc/76/68/70/632766870.db2.gz VDHSRELNTHKTKQ-GDBMZVCRSA-N 2 0 262.397 2.823 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(F)ccc1O ZINC000817976231 632774141 /nfs/dbraw/zinc/77/41/41/632774141.db2.gz ILHDKGFVNMFOBI-WDEREUQCSA-N 2 0 254.349 2.699 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c(O)c1 ZINC000817976576 632774346 /nfs/dbraw/zinc/77/43/46/632774346.db2.gz ODRAGNMYNQQYBT-DZGCQCFKSA-N 2 0 274.408 2.802 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c(O)c1C ZINC000817976735 632774502 /nfs/dbraw/zinc/77/45/02/632774502.db2.gz SONMTOKVRMJITP-ZFWWWQNUSA-N 2 0 274.408 2.802 20 10 CFCDRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817977344 632775179 /nfs/dbraw/zinc/77/51/79/632775179.db2.gz HZYZETBETGBUEB-UTUOFQBUSA-N 2 0 258.365 2.932 20 10 CFCDRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000817977364 632775425 /nfs/dbraw/zinc/77/54/25/632775425.db2.gz ITXXJDBFRRQZFQ-UTUOFQBUSA-N 2 0 262.397 2.657 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000846698994 632777497 /nfs/dbraw/zinc/77/74/97/632777497.db2.gz OCZHUXKCRNRLKB-GDBMZVCRSA-N 2 0 275.440 2.844 20 10 CFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1O ZINC000817985614 632781703 /nfs/dbraw/zinc/78/17/03/632781703.db2.gz MHKREQMJOSXXJF-CHWSQXEVSA-N 2 0 260.381 2.718 20 10 CFCDRP Cc1cc(C)c([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c(O)c1 ZINC000817985069 632782167 /nfs/dbraw/zinc/78/21/67/632782167.db2.gz GMOWPOUZVNDGIC-AWEZNQCLSA-N 2 0 274.408 2.969 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000817985055 632782371 /nfs/dbraw/zinc/78/23/71/632782371.db2.gz GCOHKIHMFRIREP-KBPBESRZSA-N 2 0 272.392 2.644 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(O)c1C ZINC000848558358 633288906 /nfs/dbraw/zinc/28/89/06/633288906.db2.gz OYNGMMPBDNIJCL-KFWWJZLASA-N 2 0 276.424 3.000 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(N(C)C)cc1 ZINC000848559692 633289344 /nfs/dbraw/zinc/28/93/44/633289344.db2.gz XVPKJTXLCYHJHN-CPUCHLNUSA-N 2 0 275.440 2.743 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000111886421 635207665 /nfs/dbraw/zinc/20/76/65/635207665.db2.gz MDBJZHDTZVYMIR-UHFFFAOYSA-N 2 0 297.402 2.726 20 10 CFCDRP [NH3+][C@H](CC[NH2+][C@@H]1CCc2cccc(O)c21)Cc1ccccc1 ZINC000873235428 642088164 /nfs/dbraw/zinc/08/81/64/642088164.db2.gz OLQGPBRREXDWBF-IAGOWNOFSA-N 2 0 296.414 2.929 20 10 CFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1O ZINC000873245421 642093190 /nfs/dbraw/zinc/09/31/90/642093190.db2.gz QOJLKNQWNSVQIN-OLZOCXBDSA-N 2 0 262.397 2.821 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000873263879 642107079 /nfs/dbraw/zinc/10/70/79/642107079.db2.gz MLEWMUGQUALHCB-YIYPIFLZSA-N 2 0 290.407 2.582 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c(O)c1 ZINC000873270020 642111860 /nfs/dbraw/zinc/11/18/60/642111860.db2.gz WFQZVKCUSLIJPP-CHWSQXEVSA-N 2 0 262.397 2.739 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)cc2O)C1 ZINC000876774795 643005955 /nfs/dbraw/zinc/00/59/55/643005955.db2.gz HGXZAEQYRIFOGW-HNNXBMFYSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000876782589 643008058 /nfs/dbraw/zinc/00/80/58/643008058.db2.gz QXGMWEIIXRHRFW-MRXNPFEDSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000876946642 643075532 /nfs/dbraw/zinc/07/55/32/643075532.db2.gz UKFZJKJBZNZYDM-CYBMUJFWSA-N 2 0 262.397 2.522 20 10 CFCDRP CCC[NH+]1CCC(C[NH2+]Cc2c(C)cccc2O)CC1 ZINC000877019877 643106271 /nfs/dbraw/zinc/10/62/71/643106271.db2.gz TWAOAWKHOXUPFS-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP CC[NH+]1CCC(CC[NH2+]Cc2c(C)cccc2O)CC1 ZINC000877064038 643129239 /nfs/dbraw/zinc/12/92/39/643129239.db2.gz MLVWQJHAVPMRPR-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP CSC1(C[NH2+]Cc2ccc(C)cc2O)CC[NH+](C)CC1 ZINC000877539689 643343088 /nfs/dbraw/zinc/34/30/88/643343088.db2.gz RBKWLCRPBKLPNC-UHFFFAOYSA-N 2 0 294.464 2.618 20 10 CFCDRP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c(O)c1 ZINC000877644395 643428216 /nfs/dbraw/zinc/42/82/16/643428216.db2.gz UFNUXKQMMABDLI-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000128332252 644640697 /nfs/dbraw/zinc/64/06/97/644640697.db2.gz CARXKAHJBQOUOQ-NSHDSACASA-N 2 0 268.788 2.606 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1cc(Cl)ccc1O ZINC000133352839 646075185 /nfs/dbraw/zinc/07/51/85/646075185.db2.gz KHYFQBNVQBBQRU-CYBMUJFWSA-N 2 0 270.804 2.851 20 10 CFCDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1c([O-])cccc1F ZINC000886641202 647083444 /nfs/dbraw/zinc/08/34/44/647083444.db2.gz CHTSVACWMJNVAQ-OLZOCXBDSA-N 2 0 280.387 2.914 20 10 CFCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c2c1c(F)ccc2O ZINC000925787194 648324725 /nfs/dbraw/zinc/32/47/25/648324725.db2.gz XBNBWDLQPSBJND-DCQANWLSSA-N 2 0 278.371 2.525 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000692939309 769833704 /nfs/dbraw/zinc/83/37/04/769833704.db2.gz DDIKNJQOQHOVQE-OAHLLOKOSA-N 2 0 274.408 2.604 20 10 CFCDRP [NH3+]C[C@H]1CCCCN1Cc1ccc(C(F)(F)F)cc1O ZINC001204933285 776969517 /nfs/dbraw/zinc/96/95/17/776969517.db2.gz RAMQMPYDQRPLOX-GFCCVEGCSA-N 2 0 288.313 2.724 20 10 CFCDRP Cc1cc(C)c(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)c(O)c1 ZINC001231846769 777348223 /nfs/dbraw/zinc/34/82/23/777348223.db2.gz ORAYQILCJDHZIS-UHFFFAOYSA-N 2 0 288.435 2.927 20 10 CFCDRP Cc1cc(C)c(C[N@H+]2C[C@H]3CCCN(C)[C@H]3C2)c(O)c1 ZINC001231847981 777348853 /nfs/dbraw/zinc/34/88/53/777348853.db2.gz GOSKCBLFHMUZQN-ZBFHGGJFSA-N 2 0 274.408 2.535 20 10 CFCDRP C[NH+](C)C1CCC([N@@H+]2CCc3cccc(O)c3C2)CC1 ZINC001168327392 778434084 /nfs/dbraw/zinc/43/40/84/778434084.db2.gz MDSIIDNSZKJCFC-UHFFFAOYSA-N 2 0 274.408 2.623 20 10 CFCDRP CCN(CC)c1ccc(CN(C)[C@H]2CCC[NH2+]C2)cc1 ZINC001235342044 778460549 /nfs/dbraw/zinc/46/05/49/778460549.db2.gz GXYALMJXRXORQS-KRWDZBQOSA-N 2 0 275.440 2.717 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@H](C[NH3+])C2)c(C)n1-c1ccccc1 ZINC001235750683 778552035 /nfs/dbraw/zinc/55/20/35/778552035.db2.gz RRLHRUSYHZOWPT-MRXNPFEDSA-N 2 0 283.419 2.875 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)cc1 ZINC001235928540 778612932 /nfs/dbraw/zinc/61/29/32/778612932.db2.gz ACWGDBZASPHGEC-IRXDYDNUSA-N 2 0 287.451 2.574 20 10 CFCDRP CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236113967 778699444 /nfs/dbraw/zinc/69/94/44/778699444.db2.gz WXPFYUMWLASRKE-SFHVURJKSA-N 2 0 287.451 2.717 20 10 CFCDRP CCc1ccc(C[N@H+](CC)CCC[NH+](C)C)c(O)c1 ZINC001236789587 778930231 /nfs/dbraw/zinc/93/02/31/778930231.db2.gz ZKAGMSDCOREUJG-UHFFFAOYSA-N 2 0 264.413 2.728 20 10 CFCDRP CCC[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236932119 778982258 /nfs/dbraw/zinc/98/22/58/778982258.db2.gz NXYTZKJWGGDSLE-UHFFFAOYSA-N 2 0 293.430 2.809 20 10 CFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237385025 779089500 /nfs/dbraw/zinc/08/95/00/779089500.db2.gz ZGPNUFDWJNAAHM-IEBWSBKVSA-N 2 0 299.462 2.861 20 10 CFCDRP CN1CCCc2cc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)ccc21 ZINC001237391299 779092906 /nfs/dbraw/zinc/09/29/06/779092906.db2.gz KRVRMILKNVXTQS-ZWKOTPCHSA-N 2 0 299.462 2.643 20 10 CFCDRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c1O ZINC001237395595 779094867 /nfs/dbraw/zinc/09/48/67/779094867.db2.gz YBLMZDDCDUJCQT-GOEBONIOSA-N 2 0 274.408 2.583 20 10 CFCDRP Cc1cc(Cl)cc(CN2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c1O ZINC001237687503 779161195 /nfs/dbraw/zinc/16/11/95/779161195.db2.gz FDZUSRXNNNYBAO-CZUORRHYSA-N 2 0 294.826 2.738 20 10 CFCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH3+])CC2)c(Cl)c1 ZINC001205041183 780237286 /nfs/dbraw/zinc/23/72/86/780237286.db2.gz OGPPLQDJMLLGHS-UHFFFAOYSA-N 2 0 281.831 2.577 20 10 CFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCC[NH2+]C1CC1 ZINC001118122074 781407227 /nfs/dbraw/zinc/40/72/27/781407227.db2.gz OAXPKWIMFVIHRD-TZMCWYRMSA-N 2 0 274.408 2.981 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000083526332 374750396 /nfs/dbraw/zinc/75/03/96/374750396.db2.gz NFUMAIJNEOEWBD-LBPRGKRZSA-N 2 0 280.412 2.639 20 10 CFCDRP CCOc1ccc(O)c(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC000093089236 375184876 /nfs/dbraw/zinc/18/48/76/375184876.db2.gz ZYBKOBMQQOHYOQ-UHFFFAOYSA-N 2 0 292.423 2.565 20 10 CFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OC)c2O)C1 ZINC000093742313 375305586 /nfs/dbraw/zinc/30/55/86/375305586.db2.gz UHLDSXCRLMGUEP-AWEZNQCLSA-N 2 0 292.423 2.565 20 10 CFCDRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617920 375370352 /nfs/dbraw/zinc/37/03/52/375370352.db2.gz WAGUPFMIBCMRKV-MNOVXSKESA-N 2 0 254.349 2.522 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000113326833 376010893 /nfs/dbraw/zinc/01/08/93/376010893.db2.gz FEJSUNLQMORNDQ-GFCCVEGCSA-N 2 0 282.815 2.867 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000134037641 377978639 /nfs/dbraw/zinc/97/86/39/377978639.db2.gz HPQMKYLWXMLMHJ-UHFFFAOYSA-N 2 0 274.408 2.700 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(F)ccc2O)[C@H](C)C1 ZINC000180194780 380631752 /nfs/dbraw/zinc/63/17/52/380631752.db2.gz QDLGQPDIELSQJY-IUODEOHRSA-N 2 0 280.387 2.693 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)ccc2O)[C@H](C)C1 ZINC000180415580 380655434 /nfs/dbraw/zinc/65/54/34/380655434.db2.gz GEBDGPOYYLIVMD-CZUORRHYSA-N 2 0 292.423 2.563 20 10 CFCDRP C[C@@H]([NH2+]C1CCN(C)CC1)c1cc(Cl)ccc1O ZINC000184897363 381493581 /nfs/dbraw/zinc/49/35/81/381493581.db2.gz FXVXUEHGBVQKSH-SNVBAGLBSA-N 2 0 268.788 2.790 20 10 CFCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(OC)ccc2O)C1 ZINC000185112350 381537300 /nfs/dbraw/zinc/53/73/00/381537300.db2.gz ILHYCAGRCIOXGZ-UONOGXRCSA-N 2 0 292.423 2.783 20 10 CFCDRP C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3O)[C@@H]2C1 ZINC000359909369 381673026 /nfs/dbraw/zinc/67/30/26/381673026.db2.gz YXXNKVGQUCWZQB-SMDDNHRTSA-N 2 0 280.799 2.572 20 10 CFCDRP Oc1cccc2c1[C@@H]([NH2+]CCC[NH+]1CCCCC1)CC2 ZINC000296086537 285396753 /nfs/dbraw/zinc/39/67/53/285396753.db2.gz SVUDZGGBWKRDTP-HNNXBMFYSA-N 2 0 274.408 2.845 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000363168342 267078609 /nfs/dbraw/zinc/07/86/09/267078609.db2.gz XFOLWUCWIUHMMF-JKSUJKDBSA-N 2 0 274.408 2.725 20 10 CFCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(Cl)ccc2O)C1 ZINC000367709620 267111767 /nfs/dbraw/zinc/11/17/67/267111767.db2.gz XFKLNTHCHSLZDN-SWLSCSKDSA-N 2 0 294.826 2.962 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296138371 273635934 /nfs/dbraw/zinc/63/59/34/273635934.db2.gz WCLAQFRWZQZJRB-AWEZNQCLSA-N 2 0 262.397 2.701 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(C)ccc2O)C1 ZINC000037644333 521717663 /nfs/dbraw/zinc/71/76/63/521717663.db2.gz OCPRUPXQDXCWMO-UONOGXRCSA-N 2 0 262.397 2.693 20 10 CFCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(C)c(C)cc2O)C1 ZINC000173499875 520254066 /nfs/dbraw/zinc/25/40/66/520254066.db2.gz QIKZLBSCILGRGX-OAHLLOKOSA-N 2 0 276.424 2.783 20 10 CFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1cccc(C)c1O ZINC000290421451 521653359 /nfs/dbraw/zinc/65/33/59/521653359.db2.gz KRUGWKJGGMJISW-UHFFFAOYSA-N 2 0 264.413 2.864 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000173363258 521715531 /nfs/dbraw/zinc/71/55/31/521715531.db2.gz MOYFMZYVSNBCSG-RHSMWYFYSA-N 2 0 275.440 2.573 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037649274 524762589 /nfs/dbraw/zinc/76/25/89/524762589.db2.gz MQFWPARJOBDXRJ-CHWSQXEVSA-N 2 0 290.407 2.536 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1C ZINC000292075695 525318087 /nfs/dbraw/zinc/31/80/87/525318087.db2.gz LWUIWICQHZKJBS-QGZVFWFLSA-N 2 0 274.408 2.537 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1C ZINC000293527804 525319748 /nfs/dbraw/zinc/31/97/48/525319748.db2.gz BPCYHJIPMKBEGF-GOSISDBHSA-N 2 0 288.435 2.927 20 10 CFCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N(C)C)cc1 ZINC000271818946 525322146 /nfs/dbraw/zinc/32/21/46/525322146.db2.gz CBSSYKFJLHAKNE-AWEZNQCLSA-N 2 0 273.424 2.665 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1 ZINC000071408206 525350670 /nfs/dbraw/zinc/35/06/70/525350670.db2.gz YMVSUXLZUNTGFW-OAHLLOKOSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)c1 ZINC000293346680 525364142 /nfs/dbraw/zinc/36/41/42/525364142.db2.gz GUEGPNQWQYJXCC-STQMWFEESA-N 2 0 250.386 2.549 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(F)ccc1O ZINC000094617609 525390048 /nfs/dbraw/zinc/39/00/48/525390048.db2.gz ABRPQGHDDUTMEP-RYUDHWBXSA-N 2 0 278.371 2.666 20 10 CFCDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(F)ccc1O ZINC000168758955 525430658 /nfs/dbraw/zinc/43/06/58/525430658.db2.gz BIUHLVOJGIPWNN-GFCCVEGCSA-N 2 0 280.387 2.914 20 10 CFCDRP C[NH+](C)CC1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000738076794 574156874 /nfs/dbraw/zinc/15/68/74/574156874.db2.gz NHWDJXJAISQPCU-UHFFFAOYSA-N 2 0 288.435 2.655 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(OC)c(C)c2)CC1 ZINC000044517827 618027005 /nfs/dbraw/zinc/02/70/05/618027005.db2.gz BXQCHBJEXMGEDL-UHFFFAOYSA-N 2 0 276.424 2.825 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CC[C@H](C)[NH+](C)C)cc1Cl ZINC000895292271 618514735 /nfs/dbraw/zinc/51/47/35/618514735.db2.gz OVGOYLDXKUIBQK-NSHDSACASA-N 2 0 270.804 2.784 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)cc1 ZINC000925511356 618850330 /nfs/dbraw/zinc/85/03/30/618850330.db2.gz LSRDYXGOTSATIC-IKGGRYGDSA-N 2 0 287.451 2.619 20 10 CFCDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000312813054 618954174 /nfs/dbraw/zinc/95/41/74/618954174.db2.gz LVCPTUAFEIBVKG-CQSZACIVSA-N 2 0 274.408 2.701 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)c1 ZINC000182472193 625312371 /nfs/dbraw/zinc/31/23/71/625312371.db2.gz XWACFAHBTGACOV-CHWSQXEVSA-N 2 0 278.396 2.536 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000925799024 619120611 /nfs/dbraw/zinc/12/06/11/619120611.db2.gz SNPMFQVXUUINBU-MGPQQGTHSA-N 2 0 262.397 2.597 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094616716 619132402 /nfs/dbraw/zinc/13/24/02/619132402.db2.gz AHJCAXNOEGYFMI-GFCCVEGCSA-N 2 0 268.376 2.914 20 10 CFCDRP C[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000898224518 620358660 /nfs/dbraw/zinc/35/86/60/620358660.db2.gz ZNDHMESFDJFEMS-VQIMIIECSA-N 2 0 299.462 2.883 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+]CC2([NH3+])CCCCC2)c1O ZINC000841039651 620381421 /nfs/dbraw/zinc/38/14/21/620381421.db2.gz YBFLLKBUCMCDDY-UHFFFAOYSA-N 2 0 298.814 2.805 20 10 CFCDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000841058668 620423533 /nfs/dbraw/zinc/42/35/33/620423533.db2.gz VBHWYNHQYKTRSB-IUCAKERBSA-N 2 0 272.751 2.544 20 10 CFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CC2([NH3+])CC2)c1O ZINC000902407789 621056325 /nfs/dbraw/zinc/05/63/25/621056325.db2.gz UVZXPGOJTWYFRC-VIFPVBQESA-N 2 0 299.212 2.605 20 10 CFCDRP CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCC[NH2+]C1 ZINC000903726959 621428401 /nfs/dbraw/zinc/42/84/01/621428401.db2.gz PONZPKGLTYRYJF-HNNXBMFYSA-N 2 0 276.424 2.994 20 10 CFCDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904409847 621590998 /nfs/dbraw/zinc/59/09/98/621590998.db2.gz KCDQFCXBNUHBOE-KRWDZBQOSA-N 2 0 287.451 2.848 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[C@@H]1C[NH3+] ZINC000904409999 621591217 /nfs/dbraw/zinc/59/12/17/621591217.db2.gz LHQSRZXRXWGBKA-XQJUWPJRSA-N 2 0 287.451 2.683 20 10 CFCDRP CCOc1ccc(O)c(C[NH2+][C@@H]2Cc3ccccc3[C@H]2N)c1 ZINC000904462293 621596839 /nfs/dbraw/zinc/59/68/39/621596839.db2.gz UBOWHDRJMDFAFZ-SJLPKXTDSA-N 2 0 298.386 2.505 20 10 CFCDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000841081360 621819556 /nfs/dbraw/zinc/81/95/56/621819556.db2.gz VNUMRUNITHSISX-HNNXBMFYSA-N 2 0 275.440 2.894 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1F ZINC000841085239 622219691 /nfs/dbraw/zinc/21/96/91/622219691.db2.gz XJIWBZRHRCIKRM-DZGCQCFKSA-N 2 0 293.430 2.889 20 10 CFCDRP CCOc1cccc(C[NH2+]CC2CC[NH+](CC)CC2)c1O ZINC000044517494 622918645 /nfs/dbraw/zinc/91/86/45/622918645.db2.gz KAAVMGRSZLQSTA-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1cc(F)ccc1O ZINC000157651873 623043791 /nfs/dbraw/zinc/04/37/91/623043791.db2.gz VVICQYPDAIUQFK-NTZNESFSSA-N 2 0 266.360 2.665 20 10 CFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c1O ZINC000841101601 623051415 /nfs/dbraw/zinc/05/14/15/623051415.db2.gz WKHSIZFNKNBNHL-GWCFXTLKSA-N 2 0 282.815 2.771 20 10 CFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)[C@H](C)C1 ZINC000174628853 623444215 /nfs/dbraw/zinc/44/42/15/623444215.db2.gz FLCOYASYLRYODY-CZUORRHYSA-N 2 0 293.430 2.712 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825126918 623634956 /nfs/dbraw/zinc/63/49/56/623634956.db2.gz UGJHXTRGUCXTED-GFCCVEGCSA-N 2 0 282.815 2.785 20 10 CFCDRP CC[C@@H]([NH2+]C[C@@H]1CCCN1C)c1ccc(N(C)C)cc1 ZINC000154578365 624396956 /nfs/dbraw/zinc/39/69/56/624396956.db2.gz NFZWZTVKJYAHDU-DLBZAZTESA-N 2 0 275.440 2.888 20 10 CFCDRP Cc1cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)ccc1N(C)C ZINC000923284571 626462367 /nfs/dbraw/zinc/46/23/67/626462367.db2.gz PLIZVAWCQSMLOB-CQSZACIVSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)ccc1N(C)C ZINC000923335464 626467053 /nfs/dbraw/zinc/46/70/53/626467053.db2.gz PGDSFQJNHMRYJR-MRXNPFEDSA-N 2 0 275.440 2.635 20 10 CFCDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768446734 627344376 /nfs/dbraw/zinc/34/43/76/627344376.db2.gz ODJUOBXUCFAXMC-CQSZACIVSA-N 2 0 288.435 2.655 20 10 CFCDRP CCC1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCC1 ZINC000771842684 627636470 /nfs/dbraw/zinc/63/64/70/627636470.db2.gz JZFOJSTZUQZTHX-UHFFFAOYSA-N 2 0 287.451 2.861 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC000852105848 634660781 /nfs/dbraw/zinc/66/07/81/634660781.db2.gz OUGAGVSQFXOVID-SFHVURJKSA-N 2 0 287.451 2.670 20 10 CFCDRP COc1cccc(O)c1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000791010676 629280456 /nfs/dbraw/zinc/28/04/56/629280456.db2.gz IAFLSMYSUXSVAE-UHFFFAOYSA-N 2 0 292.423 2.612 20 10 CFCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000835036927 629331026 /nfs/dbraw/zinc/33/10/26/629331026.db2.gz RTGCTZMPTRIOPN-IDOMTICXSA-N 2 0 299.462 2.840 20 10 CFCDRP CN(C)c1ccc(/C=C\C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000835053588 629353624 /nfs/dbraw/zinc/35/36/24/629353624.db2.gz DTLUOAPHBIWRHX-NGODHXKHSA-N 2 0 299.462 2.981 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000841064074 631327909 /nfs/dbraw/zinc/32/79/09/631327909.db2.gz OWFLLHSXWWZJDQ-YOEHRIQHSA-N 2 0 275.440 2.620 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)c1O ZINC000841072614 631330562 /nfs/dbraw/zinc/33/05/62/631330562.db2.gz LMMOYDRZIZSZHY-ZDUSSCGKSA-N 2 0 282.815 2.832 20 10 CFCDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000841078305 631332019 /nfs/dbraw/zinc/33/20/19/631332019.db2.gz FLAZTVUOCQCNIT-OAHLLOKOSA-N 2 0 275.440 2.894 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1C ZINC000841086760 631336220 /nfs/dbraw/zinc/33/62/20/631336220.db2.gz LLVCDEGIHNYLMD-DOTOQJQBSA-N 2 0 288.435 2.973 20 10 CFCDRP C[C@@H]([NH3+])C1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000843048823 631815030 /nfs/dbraw/zinc/81/50/30/631815030.db2.gz ZNMDMWNQOWOYTL-FOSCPCJNSA-N 2 0 287.451 2.825 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2c(O)cc(C)cc2Cl)CC[C@@H]1[NH3+] ZINC000843050378 631815432 /nfs/dbraw/zinc/81/54/32/631815432.db2.gz FDIMQEKKKLSCJC-FZMZJTMJSA-N 2 0 282.815 2.913 20 10 CFCDRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1cc(Cl)ccc1O ZINC000843053956 631817528 /nfs/dbraw/zinc/81/75/28/631817528.db2.gz NCAGBUAWNBIODP-AGUYFDCRSA-N 2 0 280.799 2.890 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c(Cl)c1 ZINC000843057368 631819629 /nfs/dbraw/zinc/81/96/29/631819629.db2.gz JOENMUUXKJLNOY-WDEREUQCSA-N 2 0 268.788 2.523 20 10 CFCDRP CCOCc1cc(C[NH2+]C2CCC([NH3+])CC2)ccc1OC ZINC000843108051 631837704 /nfs/dbraw/zinc/83/77/04/631837704.db2.gz XMOFEAQMFCPZGQ-UHFFFAOYSA-N 2 0 292.423 2.591 20 10 CFCDRP Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124765 631842623 /nfs/dbraw/zinc/84/26/23/631842623.db2.gz GKULBCZUJAZPPV-QWHCGFSZSA-N 2 0 294.826 2.867 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@H]2CC[NH3+])cc1 ZINC000843123919 631842697 /nfs/dbraw/zinc/84/26/97/631842697.db2.gz RRGKJDYWKMAZHQ-QWNKOJSDSA-N 2 0 287.451 2.969 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1C ZINC000843123741 631843750 /nfs/dbraw/zinc/84/37/50/631843750.db2.gz OZSXTKIWJCDBGX-KRWDZBQOSA-N 2 0 274.408 2.585 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1O ZINC000843126248 631844974 /nfs/dbraw/zinc/84/49/74/631844974.db2.gz GXYYHCUQTHSLEE-CVEARBPZSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843126760 631846355 /nfs/dbraw/zinc/84/63/55/631846355.db2.gz MRAQHEGMOJGERP-CVEARBPZSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c1 ZINC000843127930 631848021 /nfs/dbraw/zinc/84/80/21/631848021.db2.gz UQMATVGBAQDJTC-HNNXBMFYSA-N 2 0 274.408 2.522 20 10 CFCDRP [NH3+]CCCCCCCN1CCCc2cc(C[NH3+])ccc21 ZINC000843349818 631934216 /nfs/dbraw/zinc/93/42/16/631934216.db2.gz FAAHNYYVOCTVLU-UHFFFAOYSA-N 2 0 275.440 2.807 20 10 CFCDRP COc1cccc(O)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815151498 632218123 /nfs/dbraw/zinc/21/81/23/632218123.db2.gz QQGRQNYTNCUNIP-UHFFFAOYSA-N 2 0 292.423 2.757 20 10 CFCDRP Cc1cccc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1O ZINC000844900619 632330814 /nfs/dbraw/zinc/33/08/14/632330814.db2.gz BKQITRZWBPRRTP-DOMZBBRYSA-N 2 0 262.397 2.650 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])cc1C ZINC000844902290 632331188 /nfs/dbraw/zinc/33/11/88/632331188.db2.gz OUDBFODJYIUSRL-MLGOLLRUSA-N 2 0 276.424 2.958 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)c1O ZINC000846135326 632642320 /nfs/dbraw/zinc/64/23/20/632642320.db2.gz CLSDCSNPVKPGQY-CQSZACIVSA-N 2 0 292.423 2.927 20 10 CFCDRP COc1cccc([C@H](C)[NH2+]CCC[NH+]2CCCC2)c1O ZINC000846137601 632643181 /nfs/dbraw/zinc/64/31/81/632643181.db2.gz TYTLKHRMFXCIHD-ZDUSSCGKSA-N 2 0 278.396 2.537 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1O ZINC000846172393 632653899 /nfs/dbraw/zinc/65/38/99/632653899.db2.gz LUNNYFCNAHYSIC-IYXRBSQSSA-N 2 0 292.423 2.924 20 10 CFCDRP Cc1cccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817865749 632715647 /nfs/dbraw/zinc/71/56/47/632715647.db2.gz NOBLHGCWSCOEPP-NFAWXSAZSA-N 2 0 262.397 2.506 20 10 CFCDRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901164 632725514 /nfs/dbraw/zinc/72/55/14/632725514.db2.gz STMHFHCRGCPBMX-YOEHRIQHSA-N 2 0 287.451 2.547 20 10 CFCDRP C[C@@H]([NH2+]CCC[NH3+])c1ccc(N2CCCCC2)cc1 ZINC000817938166 632742700 /nfs/dbraw/zinc/74/27/00/632742700.db2.gz FZPFGRHLCMVJQV-CQSZACIVSA-N 2 0 261.413 2.676 20 10 CFCDRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000817937668 632742879 /nfs/dbraw/zinc/74/28/79/632742879.db2.gz ZKOGGUICJFXASI-MRXNPFEDSA-N 2 0 261.413 2.545 20 10 CFCDRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(C)cc1O ZINC000817940084 632744192 /nfs/dbraw/zinc/74/41/92/632744192.db2.gz DPJXLJGAVOHUFS-OAHLLOKOSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cc(Cl)ccc1O ZINC000817939751 632744201 /nfs/dbraw/zinc/74/42/01/632744201.db2.gz BOZOTVDEUYHYNA-SNVBAGLBSA-N 2 0 268.788 2.696 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cc2c(cc1O)CCCC2 ZINC000817945980 632748015 /nfs/dbraw/zinc/74/80/15/632748015.db2.gz PDKKBTZHIBLONH-KGLIPLIRSA-N 2 0 288.435 2.921 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC000817946820 632748571 /nfs/dbraw/zinc/74/85/71/632748571.db2.gz FNHNFXGVZIHLFE-GRYCIOLGSA-N 2 0 266.360 2.570 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCC[NH2+]C1 ZINC000817947803 632749758 /nfs/dbraw/zinc/74/97/58/632749758.db2.gz RPESSGDBNMBFIF-LZWOXQAQSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(N(C)C)cc1 ZINC000817947804 632749847 /nfs/dbraw/zinc/74/98/47/632749847.db2.gz RPESSGDBNMBFIF-OFQRWUPVSA-N 2 0 275.440 2.791 20 10 CFCDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccccc1O ZINC000817949560 632750339 /nfs/dbraw/zinc/75/03/39/632750339.db2.gz RHTCEALXJRIKPS-CYBMUJFWSA-N 2 0 270.376 2.744 20 10 CFCDRP CC(C)[NH2+]CCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000817952972 632752631 /nfs/dbraw/zinc/75/26/31/632752631.db2.gz JXJVEVYCVWEHDW-NSHDSACASA-N 2 0 254.349 2.570 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(O)c1 ZINC000817954703 632755122 /nfs/dbraw/zinc/75/51/22/632755122.db2.gz HHGMQCWWRRTNRB-KGLIPLIRSA-N 2 0 262.397 2.659 20 10 CFCDRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000817959864 632757920 /nfs/dbraw/zinc/75/79/20/632757920.db2.gz WBWKBFGGPWYZOH-JOYOIKCWSA-N 2 0 256.777 2.680 20 10 CFCDRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1cc(Cl)ccc1O ZINC000817962210 632761859 /nfs/dbraw/zinc/76/18/59/632761859.db2.gz IYQWBNMUKSLOSM-CABZTGNLSA-N 2 0 256.777 2.681 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c(O)c1 ZINC000817964631 632763359 /nfs/dbraw/zinc/76/33/59/632763359.db2.gz GMUUYMBMMKKHGF-ZDUSSCGKSA-N 2 0 262.397 2.741 20 10 CFCDRP C[C@H]1C[C@H]([NH2+]CC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817966981 632766412 /nfs/dbraw/zinc/76/64/12/632766412.db2.gz AZQIWXAUEKDAKW-GWCFXTLKSA-N 2 0 276.355 2.589 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(C)cc1O ZINC000817969617 632768409 /nfs/dbraw/zinc/76/84/09/632768409.db2.gz FBUBCXWKAJCWDU-SNPRPXQTSA-N 2 0 262.397 2.739 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)c(O)c1C ZINC000817971631 632770717 /nfs/dbraw/zinc/77/07/17/632770717.db2.gz OMCMBZYEFYNWAX-ZLDLUXBVSA-N 2 0 262.397 2.658 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000817972293 632771815 /nfs/dbraw/zinc/77/18/15/632771815.db2.gz VXPYIEKGKFERCJ-OFQRWUPVSA-N 2 0 275.440 2.934 20 10 CFCDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000817976437 632774119 /nfs/dbraw/zinc/77/41/19/632774119.db2.gz XWUVHWMLEXCOMN-KBPBESRZSA-N 2 0 263.429 2.921 20 10 CFCDRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976187 632774250 /nfs/dbraw/zinc/77/42/50/632774250.db2.gz HQTAOCIBAHRVJU-IRXDYDNUSA-N 2 0 287.451 2.935 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000817976726 632774545 /nfs/dbraw/zinc/77/45/45/632774545.db2.gz SJKBPJYHPMRINI-BBRMVZONSA-N 2 0 273.424 2.545 20 10 CFCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000817976532 632774655 /nfs/dbraw/zinc/77/46/55/632774655.db2.gz NCYKVUJSMLZOLF-RYUDHWBXSA-N 2 0 266.385 2.569 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1O ZINC000817977061 632775035 /nfs/dbraw/zinc/77/50/35/632775035.db2.gz ZXCPDHIVAWLFGC-HZMBPMFUSA-N 2 0 280.799 2.838 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@H](C)[NH3+] ZINC000817977343 632775140 /nfs/dbraw/zinc/77/51/40/632775140.db2.gz HZYZETBETGBUEB-TUAOUCFPSA-N 2 0 258.365 2.932 20 10 CFCDRP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817979381 632775954 /nfs/dbraw/zinc/77/59/54/632775954.db2.gz JYHSKPKDKPFPTG-DGCLKSJQSA-N 2 0 258.365 2.933 20 10 CFCDRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(C)cc1O ZINC000817978167 632776242 /nfs/dbraw/zinc/77/62/42/632776242.db2.gz XUFYZVXOOIJHRV-GXTWGEPZSA-N 2 0 250.386 2.869 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c(O)c1C ZINC000817981960 632778889 /nfs/dbraw/zinc/77/88/89/632778889.db2.gz OVRHPVUGSRKDCA-BFHYXJOUSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(F)ccc1O ZINC000817985151 632782253 /nfs/dbraw/zinc/78/22/53/632782253.db2.gz BDNQDCNYQHBZOC-CIQGVGRVSA-N 2 0 278.371 2.570 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C)CC=CC3)cc2)CC1 ZINC000848561275 633290010 /nfs/dbraw/zinc/29/00/10/633290010.db2.gz UGQSBQSZPFVHRS-UHFFFAOYSA-N 2 0 285.435 2.637 20 10 CFCDRP [NH3+]C1(C[NH2+]Cc2cc(Br)ccc2O)CCCC1 ZINC000849349648 633626263 /nfs/dbraw/zinc/62/62/63/633626263.db2.gz FZAVGFITFIDUCN-UHFFFAOYSA-N 2 0 299.212 2.516 20 10 CFCDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc(Cl)c1[O-] ZINC000853247442 634950694 /nfs/dbraw/zinc/95/06/94/634950694.db2.gz PMQBSCPHNVVMJG-GFCCVEGCSA-N 2 0 256.777 2.509 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000858491319 636270560 /nfs/dbraw/zinc/27/05/60/636270560.db2.gz FDWWDIXEOATVQN-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP CC[C@H]([NH2+]CC1([NH3+])CCOCC1)c1cc(Cl)ccc1O ZINC000863541352 637688790 /nfs/dbraw/zinc/68/87/90/637688790.db2.gz LEWWULCTRNKVMA-ZDUSSCGKSA-N 2 0 298.814 2.594 20 10 CFCDRP C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CC[NH+](C)CC1 ZINC000122483730 639108002 /nfs/dbraw/zinc/10/80/02/639108002.db2.gz YIEITURRYYHVSS-ZDUSSCGKSA-N 2 0 293.430 2.712 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000872250771 641717809 /nfs/dbraw/zinc/71/78/09/641717809.db2.gz AWAQRSLGJAMXEG-OAHLLOKOSA-N 2 0 275.440 2.620 20 10 CFCDRP CCOc1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c(O)c1 ZINC000872252456 641717902 /nfs/dbraw/zinc/71/79/02/641717902.db2.gz RBVLUBOBLXMAJT-AWEZNQCLSA-N 2 0 292.423 2.659 20 10 CFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000873215429 642071435 /nfs/dbraw/zinc/07/14/35/642071435.db2.gz DSZKMHRSMOHDNM-GDBMZVCRSA-N 2 0 275.440 2.559 20 10 CFCDRP CN(C)c1ccc(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)cc1 ZINC000873223121 642075875 /nfs/dbraw/zinc/07/58/75/642075875.db2.gz IBWBCNMWPJGDIX-GOSISDBHSA-N 2 0 289.467 2.950 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(N(C)C)cc1 ZINC000873254580 642100305 /nfs/dbraw/zinc/10/03/05/642100305.db2.gz XIUOGRGCJSZWGW-IVMMDQJWSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N(C)C)cc1 ZINC000873260332 642105147 /nfs/dbraw/zinc/10/51/47/642105147.db2.gz YPUKPJVLURWNAR-DIECFANBSA-N 2 0 287.451 2.934 20 10 CFCDRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc(N(C)C)cc1 ZINC000873269135 642111868 /nfs/dbraw/zinc/11/18/68/642111868.db2.gz CZKORHLMLSGMLW-KGLIPLIRSA-N 2 0 275.440 2.791 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000125554629 642669267 /nfs/dbraw/zinc/66/92/67/642669267.db2.gz HPMPCZLXXDRIAF-KRWDZBQOSA-N 2 0 289.467 2.916 20 10 CFCDRP Cc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(O)c1 ZINC000876813882 643021729 /nfs/dbraw/zinc/02/17/29/643021729.db2.gz YBIDGHCJUCYTHS-HOCLYGCPSA-N 2 0 274.408 2.617 20 10 CFCDRP Cc1ccc(C[NH2+]CCC[NH+]2CCCCC2)c(O)c1 ZINC000876900218 643056997 /nfs/dbraw/zinc/05/69/97/643056997.db2.gz GLDQITKWRMAMBZ-UHFFFAOYSA-N 2 0 262.397 2.666 20 10 CFCDRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c(O)c1 ZINC000877074031 643136655 /nfs/dbraw/zinc/13/66/55/643136655.db2.gz YBBKBJFKVNAYMC-GJZGRUSLSA-N 2 0 262.397 2.663 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1 ZINC000877711413 643476979 /nfs/dbraw/zinc/47/69/79/643476979.db2.gz HSFIYMPTOLMFSR-UHFFFAOYSA-N 2 0 292.423 2.753 20 10 CFCDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cc(F)ccc1O ZINC000925847332 648343552 /nfs/dbraw/zinc/34/35/52/648343552.db2.gz UMUMEHLRIOARTJ-HFBAOOFYSA-N 2 0 278.371 2.714 20 10 CFCDRP Oc1ccccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000692939305 769833160 /nfs/dbraw/zinc/83/31/60/769833160.db2.gz DDIKNJQOQHOVQE-HNNXBMFYSA-N 2 0 274.408 2.604 20 10 CFCDRP Cc1cc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001234980196 778345224 /nfs/dbraw/zinc/34/52/24/778345224.db2.gz VBXPFDVOZBCCRY-HDICACEKSA-N 2 0 295.430 2.745 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC001235187064 778406656 /nfs/dbraw/zinc/40/66/56/778406656.db2.gz RQKSGJJAMBSJJV-SJORKVTESA-N 2 0 287.451 2.574 20 10 CFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H]1C ZINC001235695703 778540762 /nfs/dbraw/zinc/54/07/62/778540762.db2.gz ZTXLAVFZSCLFPI-HZPDHXFCSA-N 2 0 287.451 2.717 20 10 CFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001235893736 778594983 /nfs/dbraw/zinc/59/49/83/778594983.db2.gz RKEPWJZECQWEES-PKOBYXMFSA-N 2 0 299.462 2.861 20 10 CFCDRP CC(C)(C)C[N@H+](Cc1ccc(N)cc1)C1CC[NH2+]CC1 ZINC001236459792 778834003 /nfs/dbraw/zinc/83/40/03/778834003.db2.gz ZCNFDCOAVVEEOX-UHFFFAOYSA-N 2 0 275.440 2.869 20 10 CFCDRP CCOc1ccc(CN2CCC([N@H+](C)CC)CC2)c(O)c1 ZINC001237048624 778998162 /nfs/dbraw/zinc/99/81/62/778998162.db2.gz UXELDWHPRIVBMP-UHFFFAOYSA-N 2 0 292.423 2.707 20 10 CFCDRP Cc1cc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c(O)c1 ZINC001237404631 779097264 /nfs/dbraw/zinc/09/72/64/779097264.db2.gz ODLWUAHCDFQJEL-ZBFHGGJFSA-N 2 0 274.408 2.583 20 10 CFCDRP CCc1cccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1O ZINC000700801950 780724652 /nfs/dbraw/zinc/72/46/52/780724652.db2.gz GPWNCPLCCFFFIK-CQSZACIVSA-N 2 0 276.424 2.776 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1O ZINC000700832396 780728987 /nfs/dbraw/zinc/72/89/87/780728987.db2.gz XNGHXWOESUKOGW-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP C[N@H+](CCCCCC[NH3+])Cc1cc(Cl)ccc1O ZINC000710751548 781337248 /nfs/dbraw/zinc/33/72/48/781337248.db2.gz SXVUWYVGOORYAW-UHFFFAOYSA-N 2 0 270.804 2.997 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N(C)C)cc1 ZINC000037648825 372683792 /nfs/dbraw/zinc/68/37/92/372683792.db2.gz MOASRXMIFMCJEC-GJZGRUSLSA-N 2 0 287.451 2.888 20 10 CFCDRP CCOc1cccc(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)c1O ZINC000093770258 375311504 /nfs/dbraw/zinc/31/15/04/375311504.db2.gz LIDXXTICVUNSTM-CQSZACIVSA-N 2 0 292.423 2.565 20 10 CFCDRP Cc1cccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1O ZINC000124715260 377079675 /nfs/dbraw/zinc/07/96/75/377079675.db2.gz DBFIQVLRJVHXSW-CYBMUJFWSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1O ZINC000180392462 380651365 /nfs/dbraw/zinc/65/13/65/380651365.db2.gz IEOIYIHMLZOREE-HNNXBMFYSA-N 2 0 274.408 2.618 20 10 CFCDRP C[N@@H+]1CC[C@]2(CCN(Cc3cc(Cl)ccc3O)C2)C1 ZINC000368318455 380990282 /nfs/dbraw/zinc/99/02/82/380990282.db2.gz SGXNPNMAUIDJPF-HNNXBMFYSA-N 2 0 280.799 2.573 20 10 CFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)c(F)c1[O-] ZINC000296642421 381484980 /nfs/dbraw/zinc/48/49/80/381484980.db2.gz YDWXOYNVWLKFMI-YEJSDXFRSA-N 2 0 296.361 2.946 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672051 381699592 /nfs/dbraw/zinc/69/95/92/381699592.db2.gz JULNFZHBOKVGFW-IHRRRGAJSA-N 2 0 274.408 2.976 20 10 CFCDRP COc1ccc(O)c(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c1 ZINC000038041893 174044387 /nfs/dbraw/zinc/04/43/87/174044387.db2.gz KKTOONPXOURIPU-CQSZACIVSA-N 2 0 292.423 2.612 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1 ZINC000071409362 176156609 /nfs/dbraw/zinc/15/66/09/176156609.db2.gz KJWQEHBENTVXDU-CQSZACIVSA-N 2 0 262.397 2.522 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c1 ZINC000071409365 176156724 /nfs/dbraw/zinc/15/67/24/176156724.db2.gz KJWQEHBENTVXDU-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP C[NH+]1CCC(CC[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000297900686 277026157 /nfs/dbraw/zinc/02/61/57/277026157.db2.gz WDVHSYXDUZIPQM-OAHLLOKOSA-N 2 0 274.408 2.701 20 10 CFCDRP C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C[NH+](C)C ZINC000291756743 278283411 /nfs/dbraw/zinc/28/34/11/278283411.db2.gz QXUVCKDAFLKGTO-INIZCTEOSA-N 2 0 289.467 2.964 20 10 CFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](CC)c1ccccc1O ZINC000156291287 520293116 /nfs/dbraw/zinc/29/31/16/520293116.db2.gz NODQQYWVZOGZEE-GOEBONIOSA-N 2 0 294.439 2.790 20 10 CFCDRP CCCC[NH+]1CCC([NH2+]Cc2cccc(OC)c2O)CC1 ZINC000037150367 520578096 /nfs/dbraw/zinc/57/80/96/520578096.db2.gz LIINDRMQQHLFGC-UHFFFAOYSA-N 2 0 292.423 2.755 20 10 CFCDRP CC[NH+](CC)CCC[NH2+]Cc1cccc(C)c1O ZINC000083383763 520623121 /nfs/dbraw/zinc/62/31/21/520623121.db2.gz POBLIBNKLASABG-UHFFFAOYSA-N 2 0 250.386 2.522 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000019943070 520623761 /nfs/dbraw/zinc/62/37/61/520623761.db2.gz XCBZTBNKRUPYMA-ZDUSSCGKSA-N 2 0 280.412 2.783 20 10 CFCDRP CN(C)c1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc1 ZINC000161306449 522168897 /nfs/dbraw/zinc/16/88/97/522168897.db2.gz YDCGQXALGNFSRB-INIZCTEOSA-N 2 0 275.440 2.526 20 10 CFCDRP CN(C)c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000105454858 522206872 /nfs/dbraw/zinc/20/68/72/522206872.db2.gz CDVIEVKRURZKOH-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000293734409 524749348 /nfs/dbraw/zinc/74/93/48/524749348.db2.gz QIIJEGWWDAHAHE-KBPBESRZSA-N 2 0 263.429 2.601 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1O ZINC000037649181 525416297 /nfs/dbraw/zinc/41/62/97/525416297.db2.gz HLZGDGBDCXBCRA-QWHCGFSZSA-N 2 0 260.381 2.527 20 10 CFCDRP Cc1nccn1CCC[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000756433910 574236446 /nfs/dbraw/zinc/23/64/46/574236446.db2.gz RBTZGCMQCLSVDG-NSHDSACASA-N 2 0 277.343 2.777 20 10 CFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000044517293 618027344 /nfs/dbraw/zinc/02/73/44/618027344.db2.gz WJVAKEBDOWZQMH-UHFFFAOYSA-N 2 0 275.440 2.574 20 10 CFCDRP CCC[NH+]1CCC([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000313375375 618984711 /nfs/dbraw/zinc/98/47/11/618984711.db2.gz QMLBVDCDNZDEMF-HNNXBMFYSA-N 2 0 274.408 2.844 20 10 CFCDRP Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])c(O)c1C ZINC000925736481 619046356 /nfs/dbraw/zinc/04/63/56/619046356.db2.gz AHTXSQIHCZPAQE-GFCCVEGCSA-N 2 0 250.386 2.787 20 10 CFCDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000925842770 619175802 /nfs/dbraw/zinc/17/58/02/619175802.db2.gz NMQGUHWFQGXSBV-BMGDILEWSA-N 2 0 287.451 2.935 20 10 CFCDRP Cc1ccc(O)c(C[NH+]2CCC([NH2+]C3CCC3)CC2)c1 ZINC000897980615 620317615 /nfs/dbraw/zinc/31/76/15/620317615.db2.gz AEABJRZRGGOANZ-UHFFFAOYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(Cl)c1 ZINC000841058789 620423168 /nfs/dbraw/zinc/42/31/68/620423168.db2.gz VMWKFSLMKZXLFN-WDEREUQCSA-N 2 0 268.788 2.714 20 10 CFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1O ZINC000902484578 621111143 /nfs/dbraw/zinc/11/11/43/621111143.db2.gz GHRPUKWWWLXIAI-NHCYSSNCSA-N 2 0 268.788 2.742 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(N(C)C)cc1 ZINC000902487067 621111900 /nfs/dbraw/zinc/11/19/00/621111900.db2.gz JFAWQOANKYTVHD-XNRPHZJLSA-N 2 0 261.413 2.531 20 10 CFCDRP C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[C@H]1C[NH3+] ZINC000904409994 621591225 /nfs/dbraw/zinc/59/12/25/621591225.db2.gz LHQSRZXRXWGBKA-BUZJKLBMSA-N 2 0 287.451 2.683 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000904411262 621592317 /nfs/dbraw/zinc/59/23/17/621592317.db2.gz SVUBETLFVPXIIH-MRXNPFEDSA-N 2 0 275.440 2.704 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000071408267 625515311 /nfs/dbraw/zinc/51/53/11/625515311.db2.gz VFXSPFFDFOWZEO-CQSZACIVSA-N 2 0 262.397 2.521 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c(Cl)c1 ZINC000841083401 622200630 /nfs/dbraw/zinc/20/06/30/622200630.db2.gz BVPMOZQSCJHGRM-WDEREUQCSA-N 2 0 268.788 2.571 20 10 CFCDRP CN(C)c1ccc(/C=C\CN[C@@H](C[NH3+])C(C)(C)C)cc1 ZINC000841087758 622300472 /nfs/dbraw/zinc/30/04/72/622300472.db2.gz SJPOOOVQCROAHW-WLMCBFPDSA-N 2 0 275.440 2.729 20 10 CFCDRP COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])c1O ZINC000229103728 623182930 /nfs/dbraw/zinc/18/29/30/623182930.db2.gz ATUKJJWVTINZGS-CYBMUJFWSA-N 2 0 298.814 2.758 20 10 CFCDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070169792 625279067 /nfs/dbraw/zinc/27/90/67/625279067.db2.gz MGQYVAGNFUYJMT-NSHDSACASA-N 2 0 268.788 2.606 20 10 CFCDRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000070171454 625279435 /nfs/dbraw/zinc/27/94/35/625279435.db2.gz WHFPGBGPZBOMQO-MNOVXSKESA-N 2 0 268.788 2.605 20 10 CFCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922285146 626259380 /nfs/dbraw/zinc/25/93/80/626259380.db2.gz WHEGKYIWYXLFPJ-MRXNPFEDSA-N 2 0 288.435 2.833 20 10 CFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3cccc(O)c32)C1 ZINC000840808433 626482538 /nfs/dbraw/zinc/48/25/38/626482538.db2.gz CDKBLBYCQQYCIP-ZFWWWQNUSA-N 2 0 274.408 2.701 20 10 CFCDRP Cc1cccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c1O ZINC000839179922 626529744 /nfs/dbraw/zinc/52/97/44/626529744.db2.gz AXCKKRSJTGHXQX-AWEZNQCLSA-N 2 0 262.397 2.522 20 10 CFCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1 ZINC000839182167 626529951 /nfs/dbraw/zinc/52/99/51/626529951.db2.gz LFPHLMFUENYQTK-ZIAGYGMSSA-N 2 0 292.423 2.783 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CC3(C)C)cc2)CC1 ZINC000771837802 627635830 /nfs/dbraw/zinc/63/58/30/627635830.db2.gz SBVBYYLTTAWJIP-INIZCTEOSA-N 2 0 287.451 2.574 20 10 CFCDRP C[N@H+](Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775642665 628049219 /nfs/dbraw/zinc/04/92/19/628049219.db2.gz JGEBDLVYGBGMRO-UHFFFAOYSA-N 2 0 299.418 2.663 20 10 CFCDRP C[N@H+](Cc1ccoc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775663552 628051966 /nfs/dbraw/zinc/05/19/66/628051966.db2.gz MYQTVQYIYRKMAN-UHFFFAOYSA-N 2 0 299.418 2.663 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835035830 629329132 /nfs/dbraw/zinc/32/91/32/629329132.db2.gz MFLPELNTDZZRBI-KEGWNNHHSA-N 2 0 287.451 2.697 20 10 CFCDRP C[N@H+](CCCC[NH2+]Cc1ccc2c(c1)CCO2)C1CC1 ZINC000835060586 629363085 /nfs/dbraw/zinc/36/30/85/629363085.db2.gz BSNJSKMDFMVUPK-UHFFFAOYSA-N 2 0 274.408 2.586 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)c1 ZINC000793768263 629592983 /nfs/dbraw/zinc/59/29/83/629592983.db2.gz QPUZGKKCYSQSCP-KRWDZBQOSA-N 2 0 274.408 2.537 20 10 CFCDRP CC1=C(C)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000796019172 629864366 /nfs/dbraw/zinc/86/43/66/629864366.db2.gz YRZRFKMOULOQKQ-UHFFFAOYSA-N 2 0 299.462 2.981 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCCCCC[NH3+])c(Cl)c1 ZINC000843129159 630832686 /nfs/dbraw/zinc/83/26/86/630832686.db2.gz MXPVWWCZGQTPME-UHFFFAOYSA-N 2 0 270.804 2.963 20 10 CFCDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccc1O ZINC000840808608 631228097 /nfs/dbraw/zinc/22/80/97/631228097.db2.gz NASNRKSNCDVLEZ-KBPBESRZSA-N 2 0 262.397 2.775 20 10 CFCDRP C[C@H]1C[C@H](C[N@H+](C)Cc2ccc(N(C)C)cc2)CC[NH2+]1 ZINC000841002665 631299928 /nfs/dbraw/zinc/29/99/28/631299928.db2.gz ASUAEYWAYJBLRG-GOEBONIOSA-N 2 0 275.440 2.573 20 10 CFCDRP COc1cccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1O ZINC000841028753 631311151 /nfs/dbraw/zinc/31/11/51/631311151.db2.gz ICJMXGJXTYXORN-GFCCVEGCSA-N 2 0 286.375 2.710 20 10 CFCDRP C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCC[NH2+]C1 ZINC000841033284 631314100 /nfs/dbraw/zinc/31/41/00/631314100.db2.gz MMNZESGLCDLANK-NXEZZACHSA-N 2 0 286.778 2.662 20 10 CFCDRP CCN(CC)c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1F ZINC000841057723 631324446 /nfs/dbraw/zinc/32/44/46/631324446.db2.gz MNCXMAPYHBAXLS-HNNXBMFYSA-N 2 0 293.430 2.904 20 10 CFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(Cl)c1 ZINC000841058786 631325259 /nfs/dbraw/zinc/32/52/59/631325259.db2.gz VMWKFSLMKZXLFN-GHMZBOCLSA-N 2 0 268.788 2.714 20 10 CFCDRP Cc1cc(O)c(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1C ZINC000841073104 631331077 /nfs/dbraw/zinc/33/10/77/631331077.db2.gz QCQPVKXATZJEKO-HNNXBMFYSA-N 2 0 262.397 2.631 20 10 CFCDRP CCOc1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c(O)c1 ZINC000841078688 631332095 /nfs/dbraw/zinc/33/20/95/631332095.db2.gz IIGIXJQXRNUPKK-HDJSIYSDSA-N 2 0 292.423 2.646 20 10 CFCDRP Cc1cc(Cl)cc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1O ZINC000841085217 631333914 /nfs/dbraw/zinc/33/39/14/631333914.db2.gz XBFPUDYCUBPQMR-GWCFXTLKSA-N 2 0 268.788 2.571 20 10 CFCDRP Cc1cccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1O ZINC000841086485 631334863 /nfs/dbraw/zinc/33/48/63/631334863.db2.gz JNPZJDZFRCUXIA-HOCLYGCPSA-N 2 0 274.408 2.665 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000841090078 631337541 /nfs/dbraw/zinc/33/75/41/631337541.db2.gz VDAINVIKYGNKLS-CQSZACIVSA-N 2 0 291.414 2.656 20 10 CFCDRP Cc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c(Cl)c1 ZINC000841099669 631339771 /nfs/dbraw/zinc/33/97/71/631339771.db2.gz NCZMUEWWVZQDGE-VXGBXAGGSA-N 2 0 282.815 2.771 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000841100789 631340101 /nfs/dbraw/zinc/34/01/01/631340101.db2.gz KAOOYMULADRYAF-DOTOQJQBSA-N 2 0 289.467 2.950 20 10 CFCDRP CC[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000843050209 631815051 /nfs/dbraw/zinc/81/50/51/631815051.db2.gz BUDAEFNTNCHFKG-GOVFWEMJSA-N 2 0 287.451 2.825 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([NH2+]CC3CC3)CC2)c1O ZINC000843054606 631818438 /nfs/dbraw/zinc/81/84/38/631818438.db2.gz WIDVHHGDAOHLMQ-UHFFFAOYSA-N 2 0 274.408 2.665 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1F ZINC000843057050 631820226 /nfs/dbraw/zinc/82/02/26/631820226.db2.gz FULYQOUAXOLNGW-DZGCQCFKSA-N 2 0 293.430 2.841 20 10 CFCDRP CN(C)c1ccc(/C=C/C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000843060231 631822987 /nfs/dbraw/zinc/82/29/87/631822987.db2.gz YLITUSGMFGAFPG-WWEPYPCMSA-N 2 0 299.462 2.825 20 10 CFCDRP CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@]1(C)CC[NH2+]C1 ZINC000843061050 631823864 /nfs/dbraw/zinc/82/38/64/631823864.db2.gz YGHFVFYZGFNWTA-GOSISDBHSA-N 2 0 289.467 2.963 20 10 CFCDRP CCCC[N@H+](Cc1ccccc1O)C[C@@]1(C)CC[NH2+]C1 ZINC000843119581 631841515 /nfs/dbraw/zinc/84/15/15/631841515.db2.gz UCHIVLVCHMMWEH-KRWDZBQOSA-N 2 0 276.424 2.994 20 10 CFCDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1C ZINC000843124693 631843725 /nfs/dbraw/zinc/84/37/25/631843725.db2.gz FLRUHRKFHUTZJB-CVEARBPZSA-N 2 0 288.435 2.831 20 10 CFCDRP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124607 631844013 /nfs/dbraw/zinc/84/40/13/631844013.db2.gz DBIJWJRUIDDPKW-QWHCGFSZSA-N 2 0 294.826 2.867 20 10 CFCDRP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000843126257 631845454 /nfs/dbraw/zinc/84/54/54/631845454.db2.gz HAFCPTHIUUOXSD-PKOBYXMFSA-N 2 0 299.462 2.861 20 10 CFCDRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cc(Cl)ccc1O ZINC000844924297 632338947 /nfs/dbraw/zinc/33/89/47/632338947.db2.gz XUEFRMWVMCBHGC-JTQLQIEISA-N 2 0 268.788 2.825 20 10 CFCDRP C[NH+](C)CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816543432 632480607 /nfs/dbraw/zinc/48/06/07/632480607.db2.gz ATRRGGHAWGAVPQ-UHFFFAOYSA-N 2 0 272.392 2.977 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(C4CCC4)CC3)cc2)CC1 ZINC000846055137 632625300 /nfs/dbraw/zinc/62/53/00/632625300.db2.gz JELCLTAEXABIAB-UHFFFAOYSA-N 2 0 299.462 2.861 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1O ZINC000846139474 632643394 /nfs/dbraw/zinc/64/33/94/632643394.db2.gz NVNVXWSZMQHTGX-CHWSQXEVSA-N 2 0 290.407 2.536 20 10 CFCDRP CC[NH+](CC)CCC[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846138314 632644017 /nfs/dbraw/zinc/64/40/17/632644017.db2.gz QFOQULBRDRZNKD-ZDUSSCGKSA-N 2 0 280.412 2.783 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)c1O ZINC000846144863 632646325 /nfs/dbraw/zinc/64/63/25/632646325.db2.gz KRCVAGUMMSDHTB-CYBMUJFWSA-N 2 0 292.423 2.783 20 10 CFCDRP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1O ZINC000846169128 632652445 /nfs/dbraw/zinc/65/24/45/632652445.db2.gz OZKSSYGZGFQVNB-CYBMUJFWSA-N 2 0 292.423 2.926 20 10 CFCDRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C[NH3+] ZINC000817864824 632714630 /nfs/dbraw/zinc/71/46/30/632714630.db2.gz CWPJDKCJXQOWKN-NQBHXWOUSA-N 2 0 282.815 2.851 20 10 CFCDRP c1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc2c1OCC2 ZINC000817902377 632725095 /nfs/dbraw/zinc/72/50/95/632725095.db2.gz OYVWILSOAGTAMQ-IXDOHACOSA-N 2 0 286.419 2.632 20 10 CFCDRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817901162 632726086 /nfs/dbraw/zinc/72/60/86/632726086.db2.gz STMHFHCRGCPBMX-RHSMWYFYSA-N 2 0 287.451 2.547 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000817946862 632748535 /nfs/dbraw/zinc/74/85/35/632748535.db2.gz GQFROLGHRNLLBH-IHRRRGAJSA-N 2 0 262.397 2.739 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000817946552 632748674 /nfs/dbraw/zinc/74/86/74/632748674.db2.gz ZBCGOYIHMVRCRH-CABCVRRESA-N 2 0 275.440 2.793 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000817955509 632755036 /nfs/dbraw/zinc/75/50/36/632755036.db2.gz XRGSMTNUEWCOJK-HUUCEWRRSA-N 2 0 275.440 2.793 20 10 CFCDRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccccc1O ZINC000817959472 632757731 /nfs/dbraw/zinc/75/77/31/632757731.db2.gz GIAGYMVPTJKZNI-AEGPPILISA-N 2 0 262.397 2.950 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000817959323 632758094 /nfs/dbraw/zinc/75/80/94/632758094.db2.gz ASRFDJINFSVCIU-GFCCVEGCSA-N 2 0 250.386 2.869 20 10 CFCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000817960962 632759071 /nfs/dbraw/zinc/75/90/71/632759071.db2.gz VENZLKBUIKHQOL-ZDUSSCGKSA-N 2 0 263.429 2.921 20 10 CFCDRP C[C@@H]1C[C@@H]([NH2+]CC2=CC[NH2+]CC2)c2c1c(F)ccc2O ZINC000817966984 632766572 /nfs/dbraw/zinc/76/65/72/632766572.db2.gz AZQIWXAUEKDAKW-ZWNOBZJWSA-N 2 0 276.355 2.589 20 10 CFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000817968203 632767565 /nfs/dbraw/zinc/76/75/65/632767565.db2.gz HJZZBIGZMWKFKP-ZBFHGGJFSA-N 2 0 275.440 2.935 20 10 CFCDRP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(C)cc1O ZINC000817969069 632767588 /nfs/dbraw/zinc/76/75/88/632767588.db2.gz QQNPUUZKISJSOK-DZGCQCFKSA-N 2 0 262.397 2.883 20 10 CFCDRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(F)ccc1O ZINC000817975096 632773493 /nfs/dbraw/zinc/77/34/93/632773493.db2.gz INFVDGGMZODOGH-AVGNSLFASA-N 2 0 280.387 2.947 20 10 CFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c(O)c1 ZINC000817976578 632774154 /nfs/dbraw/zinc/77/41/54/632774154.db2.gz ODRAGNMYNQQYBT-UKRRQHHQSA-N 2 0 274.408 2.802 20 10 CFCDRP CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccccc1O ZINC000817976124 632774609 /nfs/dbraw/zinc/77/46/09/632774609.db2.gz GOBBMQUAUSAFNO-TZMCWYRMSA-N 2 0 250.386 2.950 20 10 CFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000817981426 632777997 /nfs/dbraw/zinc/77/79/97/632777997.db2.gz JFUSBLYDDCYHEA-DZKIICNBSA-N 2 0 275.440 2.921 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c(O)c1C ZINC000817981966 632778620 /nfs/dbraw/zinc/77/86/20/632778620.db2.gz OVRHPVUGSRKDCA-MJBXVCDLSA-N 2 0 262.397 2.787 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)ccc1O ZINC000817982225 632778891 /nfs/dbraw/zinc/77/88/91/632778891.db2.gz PQDFLXIIGUYQQC-NHCYSSNCSA-N 2 0 268.788 2.824 20 10 CFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1O ZINC000817985621 632781919 /nfs/dbraw/zinc/78/19/19/632781919.db2.gz MHKREQMJOSXXJF-STQMWFEESA-N 2 0 260.381 2.718 20 10 CFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000817986582 632782224 /nfs/dbraw/zinc/78/22/24/632782224.db2.gz RWSZHGUGGOYNMX-PQEBFOHHSA-N 2 0 287.451 2.791 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000848905273 633392361 /nfs/dbraw/zinc/39/23/61/633392361.db2.gz FWEBVOGVMZVRPZ-MRXNPFEDSA-N 2 0 276.424 2.871 20 10 CFCDRP CCc1cccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c1O ZINC000848910822 633395717 /nfs/dbraw/zinc/39/57/17/633395717.db2.gz ACGBRZBTBDWUPM-RDJZCZTQSA-N 2 0 288.435 2.871 20 10 CFCDRP Cc1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1O ZINC000849349491 633625816 /nfs/dbraw/zinc/62/58/16/633625816.db2.gz AYJJXMAQEOPMHQ-INIZCTEOSA-N 2 0 288.435 2.912 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3=CCCC3)cc2)CC1 ZINC000850396086 633976001 /nfs/dbraw/zinc/97/60/01/633976001.db2.gz PEWFSINCVADBJG-UHFFFAOYSA-N 2 0 285.435 2.638 20 10 CFCDRP Cc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000858239691 636160722 /nfs/dbraw/zinc/16/07/22/636160722.db2.gz SEIDHKZEQMYUSW-AWEZNQCLSA-N 2 0 262.397 2.663 20 10 CFCDRP Cc1ccc(O)c(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000862478645 637396095 /nfs/dbraw/zinc/39/60/95/637396095.db2.gz KXIFXLXQASTWRU-UHFFFAOYSA-N 2 0 297.402 2.854 20 10 CFCDRP Cc1ccc([C@H](C)N[C@@H]2CC[C@@H](C)[NH2+]C2)c(O)c1C ZINC000863547035 637692652 /nfs/dbraw/zinc/69/26/52/637692652.db2.gz OEKIZSXSWRYNLJ-KWCYVHTRSA-N 2 0 262.397 2.800 20 10 CFCDRP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1C ZINC000872725580 641913025 /nfs/dbraw/zinc/91/30/25/641913025.db2.gz URFICMOMJJRURD-ZBFHGGJFSA-N 2 0 274.408 2.535 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1 ZINC000872725739 641913621 /nfs/dbraw/zinc/91/36/21/641913621.db2.gz VTCHLGBRRXMEMT-GDBMZVCRSA-N 2 0 274.408 2.535 20 10 CFCDRP COc1cc(Cl)cc(C[NH2+][C@H](C)C2CC[NH2+]CC2)c1O ZINC000873221346 642074462 /nfs/dbraw/zinc/07/44/62/642074462.db2.gz QVMWPAFXUJFWQA-SNVBAGLBSA-N 2 0 298.814 2.532 20 10 CFCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223830 642078386 /nfs/dbraw/zinc/07/83/86/642078386.db2.gz SYCNQHJLFIDVER-KRWDZBQOSA-N 2 0 276.424 2.898 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2ccccc2c1O ZINC000873250727 642096576 /nfs/dbraw/zinc/09/65/76/642096576.db2.gz INNRXYUMRGMCSZ-BZPMIXESSA-N 2 0 270.376 2.933 20 10 CFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(F)ccc1O ZINC000873264447 642108323 /nfs/dbraw/zinc/10/83/23/642108323.db2.gz PPFRGYBGIDRMJK-MHDGFBEUSA-N 2 0 278.371 2.713 20 10 CFCDRP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000873271666 642112678 /nfs/dbraw/zinc/11/26/78/642112678.db2.gz JGENCYVNDYPSFS-QWHCGFSZSA-N 2 0 262.397 2.739 20 10 CFCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC000876771226 643003497 /nfs/dbraw/zinc/00/34/97/643003497.db2.gz PCOIHRDOJCVULO-OAHLLOKOSA-N 2 0 276.424 2.864 20 10 CFCDRP Cc1cccc(O)c1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000876782588 643007296 /nfs/dbraw/zinc/00/72/96/643007296.db2.gz QXGMWEIIXRHRFW-INIZCTEOSA-N 2 0 288.435 2.864 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000876899471 643056942 /nfs/dbraw/zinc/05/69/42/643056942.db2.gz ZKHFTMPUGOBJAF-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(C)cc2O)CC1 ZINC000877062803 643129408 /nfs/dbraw/zinc/12/94/08/643129408.db2.gz CPNMQMSXAYNGFK-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000877473164 643291601 /nfs/dbraw/zinc/29/16/01/643291601.db2.gz DXHIUCISTGGCAE-UHFFFAOYSA-N 2 0 276.424 2.912 20 10 CFCDRP CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000877477380 643295020 /nfs/dbraw/zinc/29/50/20/643295020.db2.gz CCLHQOCHBKRFSC-PBHICJAKSA-N 2 0 275.440 2.844 20 10 CFCDRP Cc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC000877642921 643426975 /nfs/dbraw/zinc/42/69/75/643426975.db2.gz XKVACXPBMYIJLD-UHFFFAOYSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cccc(O)c1C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000877656726 643436424 /nfs/dbraw/zinc/43/64/24/643436424.db2.gz QETFSULDSMNTJD-HNNXBMFYSA-N 2 0 274.408 2.807 20 10 CFCDRP Cc1cc(C)c(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000246459556 650869865 /nfs/dbraw/zinc/86/98/65/650869865.db2.gz JDGKOANHJCWGMI-RDJZCZTQSA-N 2 0 288.435 2.925 20 10 CFCDRP CC[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@@H]1[NH3+] ZINC000128353492 644650718 /nfs/dbraw/zinc/65/07/18/644650718.db2.gz ZOCTVEPQTDJNGK-GWCFXTLKSA-N 2 0 268.788 2.605 20 10 CFCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250359797 650973832 /nfs/dbraw/zinc/97/38/32/650973832.db2.gz RWLKYKQVGMHHCR-RCCFBDPRSA-N 2 0 287.451 2.763 20 10 CFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C3CC3)C3CC3)cc2)CC1 ZINC000883289284 645723777 /nfs/dbraw/zinc/72/37/77/645723777.db2.gz JXCULYRRGLMCLC-UHFFFAOYSA-N 2 0 299.462 2.717 20 10 CFCDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1c([O-])cccc1F ZINC000886641204 647083144 /nfs/dbraw/zinc/08/31/44/647083144.db2.gz CHTSVACWMJNVAQ-STQMWFEESA-N 2 0 280.387 2.914 20 10 CFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c(O)c1C ZINC000925882439 648354696 /nfs/dbraw/zinc/35/46/96/648354696.db2.gz LWUPXBMHEPYIDP-MJBXVCDLSA-N 2 0 262.397 2.787 20 10 CFCDRP CCN(CC)c1ccc(CN2CC[NH2+][C@@H](C)CC2)cc1 ZINC001210475039 770292131 /nfs/dbraw/zinc/29/21/31/770292131.db2.gz KTLDBLJKLSBPFS-HNNXBMFYSA-N 2 0 275.440 2.717 20 10 CFCDRP Cc1cc(C)c(C[NH+]2CCC(C[NH+](C)C)CC2)c(O)c1 ZINC001231843911 777347208 /nfs/dbraw/zinc/34/72/08/777347208.db2.gz CRBZYPLCARYVQR-UHFFFAOYSA-N 2 0 276.424 2.783 20 10 CFCDRP CCC[NH+]1C[C@H]2C[NH+](Cc3c(C)cc(C)cc3O)C[C@@H]2C1 ZINC001231851073 777350649 /nfs/dbraw/zinc/35/06/49/777350649.db2.gz ZDDQNONTRGJVFC-HOTGVXAUSA-N 2 0 288.435 2.783 20 10 CFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC001235193880 778409012 /nfs/dbraw/zinc/40/90/12/778409012.db2.gz RQKSGJJAMBSJJV-IAGOWNOFSA-N 2 0 287.451 2.574 20 10 CFCDRP Cc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(O)c1 ZINC001235424376 778485642 /nfs/dbraw/zinc/48/56/42/778485642.db2.gz HNOOKQIHZRSMQO-HZPDHXFCSA-N 2 0 288.435 2.912 20 10 CFCDRP Cc1cc(C)c(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(O)c1 ZINC001168366586 778584250 /nfs/dbraw/zinc/58/42/50/778584250.db2.gz XMMQFQOGLQCDGN-UHFFFAOYSA-N 2 0 288.435 2.973 20 10 CFCDRP c1c(C[NH+]2CCC[NH2+]CCC2)cc2c3c1CCCN3CCC2 ZINC001236239048 778749294 /nfs/dbraw/zinc/74/92/94/778749294.db2.gz CYNJNGQJSHAOHE-UHFFFAOYSA-N 2 0 299.462 2.571 20 10 CFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)C[C@H]2C1 ZINC001236836162 778961171 /nfs/dbraw/zinc/96/11/71/778961171.db2.gz YTNZGVUSBMJJFO-QZTJIDSGSA-N 2 0 296.414 2.929 20 10 CFCDRP Cc1cc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)ccc1N(C)C ZINC001237386792 779091074 /nfs/dbraw/zinc/09/10/74/779091074.db2.gz AHJGWQBPACCMMO-IAGOWNOFSA-N 2 0 287.451 2.635 20 10 CFCDRP Cc1cccc(O)c1C[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001237487325 779118663 /nfs/dbraw/zinc/11/86/63/779118663.db2.gz HYLDCJHMDYDGMD-UHFFFAOYSA-N 2 0 274.408 2.618 20 10 CFCDRP CC[N@H+](C)C1CC[NH+](Cc2c(C)cccc2O)CC1 ZINC001237495381 779120530 /nfs/dbraw/zinc/12/05/30/779120530.db2.gz QUSULFGLCZCNIJ-UHFFFAOYSA-N 2 0 262.397 2.617 20 10 CFCDRP Cc1cc(Cl)cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c1O ZINC001237689894 779163016 /nfs/dbraw/zinc/16/30/16/779163016.db2.gz SCEBDWFEUXQKEO-UHFFFAOYSA-N 2 0 294.826 2.882 20 10 CFCDRP Cc1cc(F)cc(CN2CCC([N@H+](C)C3CC3)CC2)c1O ZINC001238069391 779245087 /nfs/dbraw/zinc/24/50/87/779245087.db2.gz ZAWYZQLVWGAUAB-UHFFFAOYSA-N 2 0 292.398 2.898 20 10 CFCDRP CCOc1cccc(C[N@H+](C)CCCCCC[NH3+])c1O ZINC000710684162 781335203 /nfs/dbraw/zinc/33/52/03/781335203.db2.gz UUJXKYSUKBUZQP-UHFFFAOYSA-N 2 0 280.412 2.742 20 10 CFCDRP CCOc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1O ZINC000295064410 199326074 /nfs/dbraw/zinc/32/60/74/199326074.db2.gz QNNAYMXQBSPZNV-GOOCMWNKSA-N 2 0 290.407 2.506 20 10 CFCDRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccccc1O ZINC000037643962 372677751 /nfs/dbraw/zinc/67/77/51/372677751.db2.gz WIOIGWIIPLFCEA-UKRRQHHQSA-N 2 0 262.397 2.775 20 10 CFCDRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc(C)cc1O ZINC000293272209 522623589 /nfs/dbraw/zinc/62/35/89/522623589.db2.gz CIWDGTPCUYYRDA-ZFWWWQNUSA-N 2 0 264.413 2.939 20 10 CFCDRP COc1cccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c1O ZINC000093660103 375289769 /nfs/dbraw/zinc/28/97/69/375289769.db2.gz CNDPNLKRGGSMFH-OAHLLOKOSA-N 2 0 292.423 2.707 20 10 CFCDRP Oc1cccc(Cl)c1CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000129920724 377490285 /nfs/dbraw/zinc/49/02/85/377490285.db2.gz DMRWFWGGLCYIIS-ZDUSSCGKSA-N 2 0 294.826 2.963 20 10 CFCDRP CC[C@@H]([NH2+]CCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000151932601 378374458 /nfs/dbraw/zinc/37/44/58/378374458.db2.gz UKHAIXDBEBJHNG-MRXNPFEDSA-N 2 0 263.429 2.745 20 10 CFCDRP Oc1ccc(F)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000179932072 380599601 /nfs/dbraw/zinc/59/96/01/380599601.db2.gz BOUIMJNIMQQUKT-UHFFFAOYSA-N 2 0 292.398 2.839 20 10 CFCDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1 ZINC000297836850 381573855 /nfs/dbraw/zinc/57/38/55/381573855.db2.gz SEJDHMXNPZNZOA-RBSFLKMASA-N 2 0 274.408 2.842 20 10 CFCDRP Cc1cccc(C[NH2+]Cc2cnc3n2CCCC3)c1O ZINC000367440091 382569929 /nfs/dbraw/zinc/56/99/29/382569929.db2.gz ZLLCUDDWDVBQAH-UHFFFAOYSA-N 2 0 271.364 2.523 20 10 CFCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000249382011 383342089 /nfs/dbraw/zinc/34/20/89/383342089.db2.gz STCIYGMACBTKHJ-HUUCEWRRSA-N 2 0 275.440 2.745 20 10 CFCDRP Cc1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000035628828 172307843 /nfs/dbraw/zinc/30/78/43/172307843.db2.gz BZBLUIDSMANCMR-AWEZNQCLSA-N 2 0 262.397 2.837 20 10 CFCDRP