smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CC([NH2+]Cc2ccc(O)cc2O)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024041 1024299179 /nfs/dbraw/zinc/29/91/79/1024299179.db2.gz ZLKBUOVKJJUBJL-HOTGVXAUSA-N 2 0 340.467 3.629 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(O)cc2O)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024040 1024300404 /nfs/dbraw/zinc/30/04/04/1024300404.db2.gz ZLKBUOVKJJUBJL-HGKCTWBKSA-N 2 0 340.467 3.629 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(O)c1C ZINC000273409639 1027414919 /nfs/dbraw/zinc/41/49/19/1027414919.db2.gz PHLAYUBZYDIJDX-KRWDZBQOSA-N 2 0 342.483 3.800 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CCC2CC[NH+](CC)CC2)cc1F ZINC000742377255 1131718350 /nfs/dbraw/zinc/71/83/50/1131718350.db2.gz JZSRWGYJLVUEBQ-UHFFFAOYSA-N 2 0 335.511 3.884 20 10 EHCDRP CN(Cc1cccs1)c1ccc(C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC001177136375 1133034053 /nfs/dbraw/zinc/03/40/53/1133034053.db2.gz LYFHARVYXJQJHH-UHFFFAOYSA-N 2 0 343.540 3.960 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCCC2 ZINC000768463434 1133144013 /nfs/dbraw/zinc/14/40/13/1133144013.db2.gz TUPBJRJHYRPUAZ-RXVVDRJESA-N 2 0 340.511 3.720 20 10 EHCDRP C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769402610 1133278165 /nfs/dbraw/zinc/27/81/65/1133278165.db2.gz MXFWBSRBQIHFIN-QGZVFWFLSA-N 2 0 344.886 4.000 20 10 EHCDRP CCc1cc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748808 1134988695 /nfs/dbraw/zinc/98/86/95/1134988695.db2.gz UISYEMMXQDHXFZ-NRFANRHFSA-N 2 0 330.516 3.780 20 10 EHCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809767519 1135879882 /nfs/dbraw/zinc/87/98/82/1135879882.db2.gz NFYCSGRPFUIVSG-TZIWHRDSSA-N 2 0 327.516 3.593 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000810252436 1135948684 /nfs/dbraw/zinc/94/86/84/1135948684.db2.gz PFVOMHYDAACRRT-INIZCTEOSA-N 2 0 335.561 3.621 20 10 EHCDRP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000850120074 1136212191 /nfs/dbraw/zinc/21/21/91/1136212191.db2.gz VNWOFYAKWHYHQU-INIZCTEOSA-N 2 0 348.531 3.908 20 10 EHCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c(O)c1 ZINC000850482140 1136267701 /nfs/dbraw/zinc/26/77/01/1136267701.db2.gz HWZFGBIBAIFJFS-KRWDZBQOSA-N 2 0 346.515 3.551 20 10 EHCDRP Cc1cc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000853623165 1136550532 /nfs/dbraw/zinc/55/05/32/1136550532.db2.gz FRQWSLUBPDFICZ-SFHVURJKSA-N 2 0 348.531 3.541 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000817901606 1136844874 /nfs/dbraw/zinc/84/48/74/1136844874.db2.gz CRHXHHCRTCJDET-BHDDXSALSA-N 2 0 341.543 3.933 20 10 EHCDRP COc1ccc(N2CCC([NH2+][C@@H](C)C[C@@H]3CCCCC[NH2+]3)CC2)cc1 ZINC000817903902 1136844896 /nfs/dbraw/zinc/84/48/96/1136844896.db2.gz WUGFOEDIKHENRZ-HKUYNNGSSA-N 2 0 345.531 3.564 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1 ZINC000817978987 1136854918 /nfs/dbraw/zinc/85/49/18/1136854918.db2.gz GELHNFNRGCWNAC-VDZJLULYSA-N 2 0 342.458 3.884 20 10 EHCDRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817986531 1136855473 /nfs/dbraw/zinc/85/54/73/1136855473.db2.gz RFDYOJJMGPVBOM-OAHLLOKOSA-N 2 0 328.378 3.762 20 10 EHCDRP CC(C)(C)c1cc(C[NH2+]CC2([NH3+])CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000863645105 1137196452 /nfs/dbraw/zinc/19/64/52/1137196452.db2.gz BNUOPJLHCRWCIK-UHFFFAOYSA-N 2 0 348.531 3.585 20 10 EHCDRP CCC1([NH+](C)C)CC[NH+](Cc2c(O)ccc3ccc(OC)cc32)CC1 ZINC000872669850 1137582619 /nfs/dbraw/zinc/58/26/19/1137582619.db2.gz VIPGQAKXQRQKGN-UHFFFAOYSA-N 2 0 342.483 3.860 20 10 EHCDRP CCOCc1cc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)ccc1OC ZINC000873233009 1137594656 /nfs/dbraw/zinc/59/46/56/1137594656.db2.gz WCARXSNZUKUYEB-FQEVSTJZSA-N 2 0 346.515 3.634 20 10 EHCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cccc3c2CC[NH2+]C3)c1O ZINC000873236612 1137594777 /nfs/dbraw/zinc/59/47/77/1137594777.db2.gz YJZHCAGPLJHKFJ-ZDUSSCGKSA-N 2 0 330.859 3.851 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N2CCCCC2)cc1 ZINC000873259461 1137595596 /nfs/dbraw/zinc/59/55/96/1137595596.db2.gz FJGZSAWVSWULQK-XEYPJELSSA-N 2 0 327.516 3.858 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000186518359 1140207741 /nfs/dbraw/zinc/20/77/41/1140207741.db2.gz ZUJMGBVSBUKLKF-OWCLPIDISA-N 2 0 332.488 3.704 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874312 201115111 /nfs/dbraw/zinc/11/51/11/201115111.db2.gz RFPFCDWPSHWPCC-YYFZDKIDSA-N 2 0 328.431 3.875 20 10 EHCDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1O ZINC000227433984 1034001567 /nfs/dbraw/zinc/00/15/67/1034001567.db2.gz QKXWJKBRVJIVDX-ZDUSSCGKSA-N 2 0 343.309 3.755 20 10 EHCDRP Cc1nccn1CCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000762926857 1121528347 /nfs/dbraw/zinc/52/83/47/1121528347.db2.gz WPPJWDSNNSGQMJ-UHFFFAOYSA-N 2 0 325.412 3.583 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000739875996 1131511700 /nfs/dbraw/zinc/51/17/00/1131511700.db2.gz LMFQRVWFXRFMKL-KRWDZBQOSA-N 2 0 330.516 3.916 20 10 EHCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000769471869 1133297279 /nfs/dbraw/zinc/29/72/79/1133297279.db2.gz XPPGXPWCYYWZSW-RXVVDRJESA-N 2 0 329.532 3.982 20 10 EHCDRP COc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c(O)c1 ZINC000793390882 1134922136 /nfs/dbraw/zinc/92/21/36/1134922136.db2.gz TYJJNMXOBMCDDR-CRAIPNDOSA-N 2 0 332.488 3.534 20 10 EHCDRP C[C@H](C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000775679276 1135503745 /nfs/dbraw/zinc/50/37/45/1135503745.db2.gz UEHUCFJRLQQJPF-LJQANCHMSA-N 2 0 337.511 3.674 20 10 EHCDRP C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001201686082 1136056836 /nfs/dbraw/zinc/05/68/36/1136056836.db2.gz ZJPKMBICMMZCNS-FDDCHVKYSA-N 2 0 349.522 3.852 20 10 EHCDRP CC1CC[NH+](CCCC[NH2+]Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816535503 1136730807 /nfs/dbraw/zinc/73/08/07/1136730807.db2.gz QIUXOMQZJAQPKA-UHFFFAOYSA-N 2 0 328.859 3.786 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000817934094 1136846795 /nfs/dbraw/zinc/84/67/95/1136846795.db2.gz BXKNXPDTAQPEGY-JKSUJKDBSA-N 2 0 340.515 3.505 20 10 EHCDRP Nc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000817956939 1136851669 /nfs/dbraw/zinc/85/16/69/1136851669.db2.gz GGKMPKZGYNUHBV-KOUNCHBCSA-N 2 0 335.495 3.597 20 10 EHCDRP Cc1cc(O)c(C[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Cl ZINC000825166489 1137167558 /nfs/dbraw/zinc/16/75/58/1137167558.db2.gz BHEMLSAVLVZCGD-UHFFFAOYSA-N 2 0 348.874 3.584 20 10 EHCDRP Cc1cc(O)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000825404993 1137177031 /nfs/dbraw/zinc/17/70/31/1137177031.db2.gz AHDYWBCGBZHGBE-UHFFFAOYSA-N 2 0 345.874 3.755 20 10 EHCDRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000844923131 1137263132 /nfs/dbraw/zinc/26/31/32/1137263132.db2.gz HDDBGFYVSAEBDC-GFCCVEGCSA-N 2 0 349.272 3.725 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1O ZINC000873272289 1137595951 /nfs/dbraw/zinc/59/59/51/1137595951.db2.gz QGWLLLFLDYFCQY-RYUDHWBXSA-N 2 0 341.293 3.502 20 10 EHCDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000185352394 1140146399 /nfs/dbraw/zinc/14/63/99/1140146399.db2.gz CGMAOQXMDSOREH-HNNXBMFYSA-N 2 0 328.456 3.703 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000186518343 1140207784 /nfs/dbraw/zinc/20/77/84/1140207784.db2.gz ZUJMGBVSBUKLKF-ARFHVFGLSA-N 2 0 332.488 3.704 20 10 EHCDRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1O ZINC000037644085 522632055 /nfs/dbraw/zinc/63/20/55/522632055.db2.gz RHZLUOHKCQRDTP-DOMZBBRYSA-N 2 0 341.293 3.537 20 10 EHCDRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894158474 1018747036 /nfs/dbraw/zinc/74/70/36/1018747036.db2.gz RIDTYTAGJGMQOZ-UHFFFAOYSA-N 2 0 342.483 3.841 20 10 EHCDRP C[C@@H]1CC([NH2+]Cc2ccc(O)cc2O)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024042 1024300321 /nfs/dbraw/zinc/30/03/21/1024300321.db2.gz ZLKBUOVKJJUBJL-HZPDHXFCSA-N 2 0 340.467 3.629 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158113406 1025984585 /nfs/dbraw/zinc/98/45/85/1025984585.db2.gz SLLWUJHZUXXSKX-IAGOWNOFSA-N 2 0 333.495 3.808 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000236916730 1040186887 /nfs/dbraw/zinc/18/68/87/1040186887.db2.gz UZJWGKAZPDUYFD-KDURUIRLSA-N 2 0 347.547 3.512 20 10 EHCDRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001649010495 1120282705 /nfs/dbraw/zinc/28/27/05/1120282705.db2.gz WOWAXEUIZQQTSY-UHFFFAOYSA-N 2 0 338.495 3.869 20 10 EHCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792970179 1134833382 /nfs/dbraw/zinc/83/33/82/1134833382.db2.gz IKJGGVRWRYKSDA-UHFFFAOYSA-N 2 0 343.437 3.593 20 10 EHCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002788 1134837358 /nfs/dbraw/zinc/83/73/58/1134837358.db2.gz BWOBXWKYKPAFCE-HUUCEWRRSA-N 2 0 343.437 3.734 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]3c3cccc(F)c3)cc2)CC1 ZINC000775724762 1135580196 /nfs/dbraw/zinc/58/01/96/1135580196.db2.gz KLHZZVUVCPXPQJ-NRFANRHFSA-N 2 0 339.458 3.525 20 10 EHCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000747469342 1135638559 /nfs/dbraw/zinc/63/85/59/1135638559.db2.gz DSEZNJHPAGGPPT-LJQANCHMSA-N 2 0 348.531 3.757 20 10 EHCDRP Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000815151632 1136557600 /nfs/dbraw/zinc/55/76/00/1136557600.db2.gz RHOIPRUWXIQKGK-UHFFFAOYSA-N 2 0 337.511 3.772 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000817888618 1136841677 /nfs/dbraw/zinc/84/16/77/1136841677.db2.gz NLEJUESBLBRELZ-OAHLLOKOSA-N 2 0 326.488 3.546 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1O ZINC000817969199 1136853856 /nfs/dbraw/zinc/85/38/56/1136853856.db2.gz RNTKQUSDAMIDEM-NSHDSACASA-N 2 0 347.256 3.609 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCCC2)cc1 ZINC000817976941 1136854234 /nfs/dbraw/zinc/85/42/34/1136854234.db2.gz XJRVBHUSILBLGV-FXAWDEMLSA-N 2 0 327.516 3.860 20 10 EHCDRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1O ZINC000817976561 1136854303 /nfs/dbraw/zinc/85/43/03/1136854303.db2.gz NLTHIVNZVGRFKU-ZFWWWQNUSA-N 2 0 328.378 3.594 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000817979651 1136854730 /nfs/dbraw/zinc/85/47/30/1136854730.db2.gz MMRLLQRKTIIXMQ-ILZDJORESA-N 2 0 342.458 3.965 20 10 EHCDRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817981342 1136854968 /nfs/dbraw/zinc/85/49/68/1136854968.db2.gz REMXTAFGKBCAPA-UKRRQHHQSA-N 2 0 341.293 3.728 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1O ZINC000817981517 1136854989 /nfs/dbraw/zinc/85/49/89/1136854989.db2.gz SPGWFOJSHPZTJE-GXTWGEPZSA-N 2 0 341.293 3.646 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000185336870 1140145584 /nfs/dbraw/zinc/14/55/84/1140145584.db2.gz QKXCLFADIQJNAO-QGZVFWFLSA-N 2 0 342.483 3.882 20 10 EHCDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000185352416 1140146485 /nfs/dbraw/zinc/14/64/85/1140146485.db2.gz CGMAOQXMDSOREH-OAHLLOKOSA-N 2 0 328.456 3.703 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000166545824 1016649984 /nfs/dbraw/zinc/64/99/84/1016649984.db2.gz HRBWYJKZMZFNAM-PZJWPPBQSA-N 2 0 327.516 3.639 20 10 EHCDRP COc1cc(C)cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000894205657 1019170865 /nfs/dbraw/zinc/17/08/65/1019170865.db2.gz AFJKEUHNODMBLB-UHFFFAOYSA-N 2 0 342.483 3.839 20 10 EHCDRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C)cc1O ZINC000280291792 1020259654 /nfs/dbraw/zinc/25/96/54/1020259654.db2.gz ZFUDVBHEZOIBOO-FQEVSTJZSA-N 2 0 342.483 3.882 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000158113137 1025984437 /nfs/dbraw/zinc/98/44/37/1025984437.db2.gz SLLWUJHZUXXSKX-SJORKVTESA-N 2 0 333.495 3.808 20 10 EHCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271893505 1029216954 /nfs/dbraw/zinc/21/69/54/1029216954.db2.gz SNCBASOFDZCBEJ-INIZCTEOSA-N 2 0 331.479 3.729 20 10 EHCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165927904 1036809195 /nfs/dbraw/zinc/80/91/95/1036809195.db2.gz YDJSCJHJMZSEQH-GHTZIAJQSA-N 2 0 347.547 3.684 20 10 EHCDRP CCN(CCC[NH+](CC)CC)Cc1cc(Cl)cc(OC)c1O ZINC000318293213 1043309650 /nfs/dbraw/zinc/30/96/50/1043309650.db2.gz OBSORSMHWMGWRE-UHFFFAOYSA-N 2 0 328.884 3.608 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000185337546 1126868642 /nfs/dbraw/zinc/86/86/42/1126868642.db2.gz VZTOXHUNYUBHKL-QUCCMNQESA-N 2 0 338.495 3.916 20 10 EHCDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765406932 1127608344 /nfs/dbraw/zinc/60/83/44/1127608344.db2.gz WRDZNPKNNGGVKH-WFXMLNOXSA-N 2 0 347.547 3.683 20 10 EHCDRP CCOc1ccc(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c(O)c1 ZINC000922509060 1129557435 /nfs/dbraw/zinc/55/74/35/1129557435.db2.gz IHYKGXFLNMVQHV-UHFFFAOYSA-N 2 0 332.488 3.678 20 10 EHCDRP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000742375597 1131717720 /nfs/dbraw/zinc/71/77/20/1131717720.db2.gz SKQGXRDCGBLZKN-JXFKEZNVSA-N 2 0 325.500 3.975 20 10 EHCDRP CC[NH+]1CCC([NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)CC1 ZINC000743644590 1131955024 /nfs/dbraw/zinc/95/50/24/1131955024.db2.gz KIQDKMSQCHPARQ-UHFFFAOYSA-N 2 0 325.500 3.976 20 10 EHCDRP CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177641474 1133089903 /nfs/dbraw/zinc/08/99/03/1133089903.db2.gz DJXZQVITBVSEGW-TZIWHRDSSA-N 2 0 329.532 3.887 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OCC)cc2O)CC1 ZINC000768302662 1133122388 /nfs/dbraw/zinc/12/23/88/1133122388.db2.gz JKTHAIPWXQNTRK-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000771866957 1133603200 /nfs/dbraw/zinc/60/32/00/1133603200.db2.gz GFXYIXBZMAMSNO-FGZHOGPDSA-N 2 0 349.522 3.864 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001199336001 1135898985 /nfs/dbraw/zinc/89/89/85/1135898985.db2.gz FZYCXKYWAGPBOZ-HNNXBMFYSA-N 2 0 339.474 3.775 20 10 EHCDRP CSC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC[NH+](C)CC1 ZINC000810252173 1135948342 /nfs/dbraw/zinc/94/83/42/1135948342.db2.gz KQGVBQJKRAVMFQ-HNNXBMFYSA-N 2 0 348.556 3.749 20 10 EHCDRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000810252849 1135948779 /nfs/dbraw/zinc/94/87/79/1135948779.db2.gz VOXKQKQWOXSWGK-HNNXBMFYSA-N 2 0 342.936 3.914 20 10 EHCDRP [NH3+]C1CCC(N(c2ccc3c(c2)C[NH2+]C3)[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC001170645743 1136142737 /nfs/dbraw/zinc/14/27/37/1136142737.db2.gz GRGPDZFJVVGISP-ZYFYDLNSSA-N 2 0 347.506 3.922 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1O ZINC000817946798 1136849982 /nfs/dbraw/zinc/84/99/82/1136849982.db2.gz DYKYQTZJSJOXRN-FRRDWIJNSA-N 2 0 341.293 3.502 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)cc1 ZINC000817957341 1136851639 /nfs/dbraw/zinc/85/16/39/1136851639.db2.gz LCKRVBOPWMMDMS-DNVJHFABSA-N 2 0 349.522 3.844 20 10 EHCDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000817960858 1136852325 /nfs/dbraw/zinc/85/23/25/1136852325.db2.gz RTYNGCSIGOXIJN-NSHDSACASA-N 2 0 329.282 3.631 20 10 EHCDRP CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817966454 1136853200 /nfs/dbraw/zinc/85/32/00/1136853200.db2.gz OGKFQMAFQVVSPA-GDBMZVCRSA-N 2 0 341.293 3.585 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846167577 1137337377 /nfs/dbraw/zinc/33/73/77/1137337377.db2.gz KXYXHUFTZHJKAM-FUHWJXTLSA-N 2 0 340.467 3.574 20 10 EHCDRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000183425623 1140037599 /nfs/dbraw/zinc/03/75/99/1140037599.db2.gz BMYPUFKCHBCWCN-QGZVFWFLSA-N 2 0 342.483 3.964 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)[C@@H](C)C1 ZINC000280054359 1020038929 /nfs/dbraw/zinc/03/89/29/1020038929.db2.gz JUZXNMPHUFRTPF-IHPCNDPISA-N 2 0 348.531 3.878 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(O)c2O)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168029576 1024548330 /nfs/dbraw/zinc/54/83/30/1024548330.db2.gz TVAYILMKOLNEIF-HGKCTWBKSA-N 2 0 340.467 3.629 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1C ZINC000273351940 1027390601 /nfs/dbraw/zinc/39/06/01/1027390601.db2.gz CATRBFDFZANKQP-QGZVFWFLSA-N 2 0 339.483 3.971 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000160536623 1030829335 /nfs/dbraw/zinc/82/93/35/1030829335.db2.gz FIQAPUAYOFXFKW-KRWDZBQOSA-N 2 0 341.499 3.544 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1O ZINC000185337660 1126869231 /nfs/dbraw/zinc/86/92/31/1126869231.db2.gz RPESBYFSQGXUMI-FUHWJXTLSA-N 2 0 342.458 3.747 20 10 EHCDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765406926 1127608513 /nfs/dbraw/zinc/60/85/13/1127608513.db2.gz WRDZNPKNNGGVKH-OPYAIIAOSA-N 2 0 347.547 3.683 20 10 EHCDRP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000742375605 1131717426 /nfs/dbraw/zinc/71/74/26/1131717426.db2.gz SKQGXRDCGBLZKN-UZLBHIALSA-N 2 0 325.500 3.975 20 10 EHCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000769471867 1133297496 /nfs/dbraw/zinc/29/74/96/1133297496.db2.gz XPPGXPWCYYWZSW-GHTZIAJQSA-N 2 0 329.532 3.982 20 10 EHCDRP CCc1cc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793748811 1134988760 /nfs/dbraw/zinc/98/87/60/1134988760.db2.gz UISYEMMXQDHXFZ-OAQYLSRUSA-N 2 0 330.516 3.780 20 10 EHCDRP CC(C)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001199699929 1135924662 /nfs/dbraw/zinc/92/46/62/1135924662.db2.gz BAXQXMOBMAZWEP-UHFFFAOYSA-N 2 0 337.511 3.852 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810216385 1135938776 /nfs/dbraw/zinc/93/87/76/1135938776.db2.gz IRBKMTQYKSUTFS-WFASDCNBSA-N 2 0 330.394 3.794 20 10 EHCDRP COc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(O)c(C(C)(C)C)c1 ZINC000850160826 1136216144 /nfs/dbraw/zinc/21/61/44/1136216144.db2.gz SUQXDASUMHSCKN-ALOPSCKCSA-N 2 0 346.515 3.803 20 10 EHCDRP COc1cc(C[NH2+]CCCC[N@H+](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000850319348 1136234708 /nfs/dbraw/zinc/23/47/08/1136234708.db2.gz LFVYBVAASADABQ-UHFFFAOYSA-N 2 0 334.504 3.662 20 10 EHCDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CCCCC3)cc1)CC[NH2+]CC2 ZINC000818430971 1136874314 /nfs/dbraw/zinc/87/43/14/1136874314.db2.gz CEHHGGJIAFVXBI-SFHVURJKSA-N 2 0 327.516 3.641 20 10 EHCDRP COc1cc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000858245467 1136951911 /nfs/dbraw/zinc/95/19/11/1136951911.db2.gz JGIHNRUDMVHJDA-HNNXBMFYSA-N 2 0 334.504 3.520 20 10 EHCDRP CN(Cc1cccs1)c1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000823818621 1137114414 /nfs/dbraw/zinc/11/44/14/1137114414.db2.gz LCFBRIUOZKQMHD-UHFFFAOYSA-N 2 0 343.540 3.816 20 10 EHCDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(C)cc1O ZINC000794804492 1137255237 /nfs/dbraw/zinc/25/52/37/1137255237.db2.gz MXXAFPAXNCCPMS-LMMKCTJWSA-N 2 0 334.504 3.631 20 10 EHCDRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794804495 1137255276 /nfs/dbraw/zinc/25/52/76/1137255276.db2.gz MXXAFPAXNCCPMS-ZIFCJYIRSA-N 2 0 334.504 3.631 20 10 EHCDRP Cc1cccc(O)c1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000876990801 1137667175 /nfs/dbraw/zinc/66/71/75/1137667175.db2.gz MKHFKTQZWMKLAI-UHFFFAOYSA-N 2 0 330.497 3.764 20 10 EHCDRP C[C@H]([NH2+]C/C=C\C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1O ZINC000879650272 1137753728 /nfs/dbraw/zinc/75/37/28/1137753728.db2.gz SPINCFCSGOXIAP-FLELRFNZSA-N 2 0 326.440 3.655 20 10 EHCDRP Cc1cc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)s1 ZINC000883289476 1137852858 /nfs/dbraw/zinc/85/28/58/1137852858.db2.gz PUUDOBMREZABPK-INIZCTEOSA-N 2 0 343.540 3.968 20 10 EHCDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Br)ccc2O)C1 ZINC000185112028 1140136443 /nfs/dbraw/zinc/13/64/43/1140136443.db2.gz YMVFLQLOYRAMHF-STQMWFEESA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1cc(O)c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1C(C)C ZINC000023847478 1020966918 /nfs/dbraw/zinc/96/69/18/1020966918.db2.gz ITKFVHKWJLXFDY-UHFFFAOYSA-N 2 0 325.456 3.541 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000902499575 1030934903 /nfs/dbraw/zinc/93/49/03/1030934903.db2.gz ABLURHSPTWZCRB-KLHJMIIUSA-N 2 0 338.451 3.607 20 10 EHCDRP CN(C)c1ccc([C@@H]([NH3+])CNCc2ccc(C(F)F)c(F)c2)cc1 ZINC000904354013 1031972386 /nfs/dbraw/zinc/97/23/86/1031972386.db2.gz UFZWHEFTCBFUQD-KRWDZBQOSA-N 2 0 337.389 3.619 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc(Br)ccc1O ZINC000227435076 1034002403 /nfs/dbraw/zinc/00/24/03/1034002403.db2.gz MWUBYAXQOFSKAZ-ZDUSSCGKSA-N 2 0 341.293 3.509 20 10 EHCDRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001648986294 1120323701 /nfs/dbraw/zinc/32/37/01/1120323701.db2.gz RDJMJOSWQRBZJA-INIZCTEOSA-N 2 0 331.529 3.814 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000769147938 1133232183 /nfs/dbraw/zinc/23/21/83/1133232183.db2.gz IXVKCTWCJFCJCP-ICSRJNTNSA-N 2 0 329.532 3.839 20 10 EHCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000770506215 1133436070 /nfs/dbraw/zinc/43/60/70/1133436070.db2.gz ZEZCULSJOMAONC-FPOVZHCZSA-N 2 0 336.479 3.879 20 10 EHCDRP CC[C@@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000771829009 1133602532 /nfs/dbraw/zinc/60/25/32/1133602532.db2.gz DWTBHWWKQIPIAZ-JOCHJYFZSA-N 2 0 337.511 3.853 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000775021929 1134221932 /nfs/dbraw/zinc/22/19/32/1134221932.db2.gz BEWRKWDDPBHXIZ-UHFFFAOYSA-N 2 0 327.516 3.641 20 10 EHCDRP C[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775647450 1135390548 /nfs/dbraw/zinc/39/05/48/1135390548.db2.gz WEEVZRIMKLFFBX-INIZCTEOSA-N 2 0 341.524 3.619 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815561151 1136610928 /nfs/dbraw/zinc/61/09/28/1136610928.db2.gz ZRNFZCLUXPUONW-XQQFMLRXSA-N 2 0 328.378 3.688 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Br)ccc1O ZINC000817949874 1136850682 /nfs/dbraw/zinc/85/06/82/1136850682.db2.gz SUQMBFQHVTYTKN-GFCCVEGCSA-N 2 0 349.272 3.507 20 10 EHCDRP CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817966464 1136853349 /nfs/dbraw/zinc/85/33/49/1136853349.db2.gz OJPBQIHOUUUDBW-HOCLYGCPSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000817980218 1136854877 /nfs/dbraw/zinc/85/48/77/1136854877.db2.gz SIUVGIKBLUKTJG-URLQWDBASA-N 2 0 328.431 3.575 20 10 EHCDRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817985083 1136855382 /nfs/dbraw/zinc/85/53/82/1136855382.db2.gz GRRBYLSLKZAIDM-OAHLLOKOSA-N 2 0 339.277 3.505 20 10 EHCDRP CCOCc1cc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1OC ZINC000865717257 1137306598 /nfs/dbraw/zinc/30/65/98/1137306598.db2.gz UMMDKLOOZXQIIJ-UHFFFAOYSA-N 2 0 348.531 3.832 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1O ZINC000846136253 1137338272 /nfs/dbraw/zinc/33/82/72/1137338272.db2.gz JVOCBQXMTCRTAI-MRXNPFEDSA-N 2 0 340.467 3.847 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000873270091 1137595890 /nfs/dbraw/zinc/59/58/90/1137595890.db2.gz WYTGIXHTEKLPIA-ABAIWWIYSA-N 2 0 341.293 3.584 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(C)cc1O ZINC000279994251 1019974950 /nfs/dbraw/zinc/97/49/50/1019974950.db2.gz FNJLZBFTJUOLKK-FQEVSTJZSA-N 2 0 342.483 3.882 20 10 EHCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(O)ccc3ccc(OC)cc32)C1 ZINC000173450293 1033339075 /nfs/dbraw/zinc/33/90/75/1033339075.db2.gz VMRMJCAEKYCUEQ-INIZCTEOSA-N 2 0 342.483 3.718 20 10 EHCDRP COc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000237223134 1039326683 /nfs/dbraw/zinc/32/66/83/1039326683.db2.gz UOQBATQJOHHMMZ-UHFFFAOYSA-N 2 0 328.456 3.531 20 10 EHCDRP COCC[N@H+](C)CCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000764907467 1127548665 /nfs/dbraw/zinc/54/86/65/1127548665.db2.gz HGUYFFZUZODMNO-LJQANCHMSA-N 2 0 347.547 3.686 20 10 EHCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC000768670755 1133168806 /nfs/dbraw/zinc/16/88/06/1133168806.db2.gz PZVKTZNEAGVLTB-UHFFFAOYSA-N 2 0 349.522 3.817 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)cc1C(C)C ZINC000746644659 1133960709 /nfs/dbraw/zinc/96/07/09/1133960709.db2.gz BPFMFEYGMXKPMJ-FBBABVLZSA-N 2 0 346.515 3.508 20 10 EHCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792938913 1134820944 /nfs/dbraw/zinc/82/09/44/1134820944.db2.gz GXJPZINQWVUCJJ-AWEZNQCLSA-N 2 0 343.437 3.593 20 10 EHCDRP C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775645087 1135392915 /nfs/dbraw/zinc/39/29/15/1135392915.db2.gz VNOGKDLAVYZUSQ-KRWDZBQOSA-N 2 0 341.474 3.771 20 10 EHCDRP CCS[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775698708 1135532419 /nfs/dbraw/zinc/53/24/19/1135532419.db2.gz WGGWBNUFTKYYGS-FQEVSTJZSA-N 2 0 347.572 3.546 20 10 EHCDRP COc1ccc(O)c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC000775734454 1135588944 /nfs/dbraw/zinc/58/89/44/1135588944.db2.gz QFJWGHUTRZAGOI-QGZVFWFLSA-N 2 0 346.515 3.877 20 10 EHCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000775740354 1135598695 /nfs/dbraw/zinc/59/86/95/1135598695.db2.gz VGXGBWKSPJOHQP-RDTXWAMCSA-N 2 0 334.891 3.803 20 10 EHCDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817984782 1136855421 /nfs/dbraw/zinc/85/54/21/1136855421.db2.gz ZYFQZJNBPBZQSQ-INIZCTEOSA-N 2 0 331.479 3.776 20 10 EHCDRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccc1F ZINC000824548360 1137144128 /nfs/dbraw/zinc/14/41/28/1137144128.db2.gz GXRAOSXUZARUKG-QGZVFWFLSA-N 2 0 341.474 3.737 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1O ZINC000846144596 1137338965 /nfs/dbraw/zinc/33/89/65/1137338965.db2.gz IAXZTHGPZILSFL-SJORKVTESA-N 2 0 342.483 3.962 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000122307834 1138256925 /nfs/dbraw/zinc/25/69/25/1138256925.db2.gz UNXOMXFMMLMFLJ-QGZVFWFLSA-N 2 0 341.499 3.544 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C)cc1O ZINC000279999590 1019981221 /nfs/dbraw/zinc/98/12/21/1019981221.db2.gz FUZJRYOYJFBJFY-LJQANCHMSA-N 2 0 342.483 3.882 20 10 EHCDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000067450058 1024555699 /nfs/dbraw/zinc/55/56/99/1024555699.db2.gz UPGKSXXMDHRFIL-UHFFFAOYSA-N 2 0 325.500 3.883 20 10 EHCDRP CC[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(F)(F)F ZINC000840960083 1028061536 /nfs/dbraw/zinc/06/15/36/1028061536.db2.gz FBTKRHIYBZROSJ-OAHLLOKOSA-N 2 0 343.437 3.507 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1CC[NH+](C)CC1 ZINC000157521777 1037672957 /nfs/dbraw/zinc/67/29/57/1037672957.db2.gz UGHAATPMZMDVKF-SFHVURJKSA-N 2 0 329.532 3.743 20 10 EHCDRP CCOc1ccc(O)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000237052955 1039297994 /nfs/dbraw/zinc/29/79/94/1039297994.db2.gz KXVBDPANZAZQAE-UHFFFAOYSA-N 2 0 342.483 3.921 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1O ZINC000185337679 1126869092 /nfs/dbraw/zinc/86/90/92/1126869092.db2.gz RPESBYFSQGXUMI-SJLPKXTDSA-N 2 0 342.458 3.747 20 10 EHCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315664 1133260110 /nfs/dbraw/zinc/26/01/10/1133260110.db2.gz KIUJIRUMMVDGPV-SFHVURJKSA-N 2 0 346.515 3.879 20 10 EHCDRP COc1cccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1O ZINC000769541489 1133300259 /nfs/dbraw/zinc/30/02/59/1133300259.db2.gz BYSULVDVIRGRSD-KRWDZBQOSA-N 2 0 346.515 3.877 20 10 EHCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(-c4ccccc4)ccc3O)CC[C@@H]21 ZINC000770353648 1133420334 /nfs/dbraw/zinc/42/03/34/1133420334.db2.gz SXPKVFCUSBGZQM-CTNGQTDRSA-N 2 0 336.479 3.975 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1Cl ZINC000774835606 1134036284 /nfs/dbraw/zinc/03/62/84/1134036284.db2.gz GWOQQBNQWCUBDA-INIZCTEOSA-N 2 0 343.902 3.943 20 10 EHCDRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810207855 1135943037 /nfs/dbraw/zinc/94/30/37/1135943037.db2.gz PTLVSGRREHNAQP-HNNXBMFYSA-N 2 0 330.394 3.938 20 10 EHCDRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1O ZINC000850516710 1136275922 /nfs/dbraw/zinc/27/59/22/1136275922.db2.gz LKPHCCORBVDWHJ-FQEVSTJZSA-N 2 0 339.483 3.740 20 10 EHCDRP C[C@H]1CCCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2Cl)C1 ZINC000817930284 1136852801 /nfs/dbraw/zinc/85/28/01/1136852801.db2.gz NSFNIXXVKBYESA-QTXGHNMQSA-N 2 0 347.934 3.949 20 10 EHCDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817980004 1136854736 /nfs/dbraw/zinc/85/47/36/1136854736.db2.gz GYWCDBPRAGLZSR-AEFFLSMTSA-N 2 0 333.495 3.999 20 10 EHCDRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817979732 1136855068 /nfs/dbraw/zinc/85/50/68/1136855068.db2.gz DRHDKAOXKGSIGG-UKRRQHHQSA-N 2 0 330.394 3.984 20 10 EHCDRP COc1cccc(C[N@@H+]2CCC[C@H](C[C@H]([NH3+])C3CCCC3)C2)c1O ZINC000873232251 1137594421 /nfs/dbraw/zinc/59/44/21/1137594421.db2.gz NSYOMCCGLUCDRL-QAPCUYQASA-N 2 0 332.488 3.520 20 10 EHCDRP COc1cc(Cl)cc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)c1O ZINC000877696958 1137686151 /nfs/dbraw/zinc/68/61/51/1137686151.db2.gz CVJAJKCLFMCPJV-UHFFFAOYSA-N 2 0 340.895 3.654 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)s1 ZINC000883289199 1137852860 /nfs/dbraw/zinc/85/28/60/1137852860.db2.gz HLMVXWIRXQYFMX-MRXNPFEDSA-N 2 0 329.513 3.659 20 10 EHCDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000273410847 1027416915 /nfs/dbraw/zinc/41/69/15/1027416915.db2.gz HUMSFNWBAFFJRR-LBPRGKRZSA-N 2 0 341.293 3.537 20 10 EHCDRP CCOc1cccc(C[NH2+]Cc2ccccc2C[NH+](CC)CC)c1O ZINC000236951616 1121469190 /nfs/dbraw/zinc/46/91/90/1121469190.db2.gz FIXIYSYZNAESJV-UHFFFAOYSA-N 2 0 342.483 3.923 20 10 EHCDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001178249310 1133145267 /nfs/dbraw/zinc/14/52/67/1133145267.db2.gz MHLLCRGTKPBRAN-HXUWFJFHSA-N 2 0 329.532 3.744 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000769147936 1133233129 /nfs/dbraw/zinc/23/31/29/1133233129.db2.gz IXVKCTWCJFCJCP-AZUAARDMSA-N 2 0 329.532 3.839 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000769149210 1133234890 /nfs/dbraw/zinc/23/48/90/1133234890.db2.gz YYUZDEZTAPJPTL-GOSISDBHSA-N 2 0 346.515 3.735 20 10 EHCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCc2ccccc21 ZINC000775648242 1135397496 /nfs/dbraw/zinc/39/74/96/1135397496.db2.gz RILSBCIVJAGOEE-JOCHJYFZSA-N 2 0 335.495 3.558 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001199336003 1135899265 /nfs/dbraw/zinc/89/92/65/1135899265.db2.gz FZYCXKYWAGPBOZ-OAHLLOKOSA-N 2 0 339.474 3.775 20 10 EHCDRP COc1cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850092765 1136209577 /nfs/dbraw/zinc/20/95/77/1136209577.db2.gz SAHBZCDCUTYIAW-UHFFFAOYSA-N 2 0 346.515 3.805 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239245 1136521005 /nfs/dbraw/zinc/52/10/05/1136521005.db2.gz CVASQHFETAXGTJ-HKUYNNGSSA-N 2 0 329.532 3.915 20 10 EHCDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241076 1136521540 /nfs/dbraw/zinc/52/15/40/1136521540.db2.gz UGJWCAGMNXFNAI-NQIIRXRSSA-N 2 0 329.532 3.915 20 10 EHCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000817899277 1136844794 /nfs/dbraw/zinc/84/47/94/1136844794.db2.gz NKOWKRIJFGIIEQ-NJDAHSKKSA-N 2 0 327.516 3.687 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])c1O ZINC000817975737 1136854404 /nfs/dbraw/zinc/85/44/04/1136854404.db2.gz AIAYUTPJCNRCGX-VXGBXAGGSA-N 2 0 329.282 3.631 20 10 EHCDRP CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000844926426 1137263335 /nfs/dbraw/zinc/26/33/35/1137263335.db2.gz UDIGECPBKKTGKE-OAHLLOKOSA-N 2 0 341.293 3.585 20 10 EHCDRP COc1ccc(N2CCC([NH2+]C3CCC(C)([NH+](C)C)CC3)CC2)cc1 ZINC000865764755 1137309894 /nfs/dbraw/zinc/30/98/94/1137309894.db2.gz AANIOALBECCWFG-UHFFFAOYSA-N 2 0 345.531 3.517 20 10 EHCDRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1 ZINC000876937013 1137665775 /nfs/dbraw/zinc/66/57/75/1137665775.db2.gz OYRJVKIMGBPHEN-UHFFFAOYSA-N 2 0 342.483 3.711 20 10 EHCDRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(N(C)C)cc1 ZINC000089215104 1138195903 /nfs/dbraw/zinc/19/59/03/1138195903.db2.gz ZGUUMOALLZPWKS-KRWDZBQOSA-N 2 0 338.499 3.715 20 10 EHCDRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)ccc1O ZINC000184933742 1140126195 /nfs/dbraw/zinc/12/61/95/1140126195.db2.gz IJYKILQPOGDTLI-HNNXBMFYSA-N 2 0 328.431 3.978 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cccs3)cc2F)CC1 ZINC000155267796 1016385037 /nfs/dbraw/zinc/38/50/37/1016385037.db2.gz MHHDQKAYWFFQDH-HNNXBMFYSA-N 2 0 347.503 3.880 20 10 EHCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)C1 ZINC001279231880 1025471385 /nfs/dbraw/zinc/47/13/85/1025471385.db2.gz XEOMKOGZOYGUIL-UHFFFAOYSA-N 2 0 327.516 3.595 20 10 EHCDRP Cc1cc(C[NH2+]CC2CC[NH+](C)CC2)c(C)n1-c1cccc(C)c1 ZINC000729682793 1028452549 /nfs/dbraw/zinc/45/25/49/1028452549.db2.gz MDLDIGBXHLNRAM-UHFFFAOYSA-N 2 0 325.500 3.834 20 10 EHCDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1O ZINC000227433977 1034001020 /nfs/dbraw/zinc/00/10/20/1034001020.db2.gz QKXWJKBRVJIVDX-CYBMUJFWSA-N 2 0 343.309 3.755 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC000185870208 1035552756 /nfs/dbraw/zinc/55/27/56/1035552756.db2.gz PKQBZDQKNGUWAF-MRXNPFEDSA-N 2 0 325.456 3.663 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)CC[N@@H+]1Cc1ccccc1 ZINC000080338646 1041159189 /nfs/dbraw/zinc/15/91/89/1041159189.db2.gz YHSDSXOQNBFBAS-UTKZUKDTSA-N 2 0 336.479 3.764 20 10 EHCDRP CC[C@@H]([NH2+]CC(C)(C)N1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000765857712 1128617020 /nfs/dbraw/zinc/61/70/20/1128617020.db2.gz DWNGAGCJXYJFHY-HXUWFJFHSA-N 2 0 347.547 3.683 20 10 EHCDRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733324639 1131025476 /nfs/dbraw/zinc/02/54/76/1131025476.db2.gz PPSBBJVXXVGAOC-IAGOWNOFSA-N 2 0 335.511 3.739 20 10 EHCDRP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000742375603 1131717867 /nfs/dbraw/zinc/71/78/67/1131717867.db2.gz SKQGXRDCGBLZKN-OXJNMPFZSA-N 2 0 325.500 3.975 20 10 EHCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169124021 1132665539 /nfs/dbraw/zinc/66/55/39/1132665539.db2.gz PJOJUOCAVOWUQZ-UIVXKWKOSA-N 2 0 328.500 3.847 20 10 EHCDRP CCN(CC)c1ccc(CN(C)C2CC[NH+](C(C)C)CC2)cc1F ZINC000768231844 1133115033 /nfs/dbraw/zinc/11/50/33/1133115033.db2.gz ZXSUWCRVIHAVJH-UHFFFAOYSA-N 2 0 335.511 3.977 20 10 EHCDRP Cc1cc(O)c(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1C ZINC000769148734 1133233713 /nfs/dbraw/zinc/23/37/13/1133233713.db2.gz QQGNSBUXJDIIPJ-IBGZPJMESA-N 2 0 330.516 3.953 20 10 EHCDRP CC[N@H+](Cc1ccc(N(C)C)c2ccccc12)C1CCN(C)CC1 ZINC001204242750 1133244229 /nfs/dbraw/zinc/24/42/29/1133244229.db2.gz RATHTMQHMDKYNE-UHFFFAOYSA-N 2 0 325.500 3.822 20 10 EHCDRP C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769402608 1133278435 /nfs/dbraw/zinc/27/84/35/1133278435.db2.gz MXFWBSRBQIHFIN-KRWDZBQOSA-N 2 0 344.886 4.000 20 10 EHCDRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]Cc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163575 1133626582 /nfs/dbraw/zinc/62/65/82/1133626582.db2.gz RZLHKKJBVPVLOL-DKUWSORSSA-N 2 0 348.490 3.907 20 10 EHCDRP CN(C)c1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002783 1134837632 /nfs/dbraw/zinc/83/76/32/1134837632.db2.gz BWOBXWKYKPAFCE-GJZGRUSLSA-N 2 0 343.437 3.734 20 10 EHCDRP Cc1ccc([C@H](C)[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775650007 1135417091 /nfs/dbraw/zinc/41/70/91/1135417091.db2.gz WOHQWYSRXPEYFI-IBGZPJMESA-N 2 0 337.511 3.940 20 10 EHCDRP C[C@@H](CC[NH2+]Cc1ccc(N(C)C)c(F)c1)[N@H+](C)Cc1ccccc1 ZINC001200940982 1135971241 /nfs/dbraw/zinc/97/12/41/1135971241.db2.gz BQTYIMONFOKYJP-KRWDZBQOSA-N 2 0 343.490 3.892 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(O)c1 ZINC000850516648 1136275636 /nfs/dbraw/zinc/27/56/36/1136275636.db2.gz HZYXQRNUEWWNHM-QGZVFWFLSA-N 2 0 339.483 3.658 20 10 EHCDRP Oc1c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc2ccccc21 ZINC000816521253 1136727016 /nfs/dbraw/zinc/72/70/16/1136727016.db2.gz KRMPHLQOUIKEAU-DYESRHJHSA-N 2 0 336.479 3.994 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000817888617 1136841503 /nfs/dbraw/zinc/84/15/03/1136841503.db2.gz NLEJUESBLBRELZ-HNNXBMFYSA-N 2 0 326.488 3.546 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)cc1 ZINC000817957344 1136851727 /nfs/dbraw/zinc/85/17/27/1136851727.db2.gz LCKRVBOPWMMDMS-YTFSRNRJSA-N 2 0 349.522 3.844 20 10 EHCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCCC2)cc1 ZINC000817976943 1136854468 /nfs/dbraw/zinc/85/44/68/1136854468.db2.gz XJRVBHUSILBLGV-XLIONFOSSA-N 2 0 327.516 3.860 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCC2)cc1 ZINC000817985841 1136855602 /nfs/dbraw/zinc/85/56/02/1136855602.db2.gz NITKKWNTNJODJO-MTFMMBMASA-N 2 0 327.516 3.716 20 10 EHCDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CCCCC3)cc1)CC[NH2+]CC2 ZINC000818430967 1136874303 /nfs/dbraw/zinc/87/43/03/1136874303.db2.gz CEHHGGJIAFVXBI-GOSISDBHSA-N 2 0 327.516 3.641 20 10 EHCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cccc3c2CC[NH2+]C3)c1O ZINC000873236609 1137594731 /nfs/dbraw/zinc/59/47/31/1137594731.db2.gz YJZHCAGPLJHKFJ-CYBMUJFWSA-N 2 0 330.859 3.851 20 10 EHCDRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183425492 1140037148 /nfs/dbraw/zinc/03/71/48/1140037148.db2.gz XKKUMGWMBZDRHY-KRWDZBQOSA-N 2 0 342.483 3.964 20 10 EHCDRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(C)cc1O ZINC000280265781 1020234634 /nfs/dbraw/zinc/23/46/34/1020234634.db2.gz XNXRHJHSBMZYFS-UFYCRDLUSA-N 2 0 346.515 3.509 20 10 EHCDRP Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000157919033 1033163887 /nfs/dbraw/zinc/16/38/87/1033163887.db2.gz PDMATAAOMUJRTK-DYESRHJHSA-N 2 0 336.479 3.994 20 10 EHCDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000131285911 1027758225 /nfs/dbraw/zinc/75/82/25/1027758225.db2.gz GYHTVHLRDUOAIZ-GOSISDBHSA-N 2 0 347.547 3.764 20 10 EHCDRP COc1ccc(N2CCC([NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)CC2)cc1 ZINC000159612902 1030292714 /nfs/dbraw/zinc/29/27/14/1030292714.db2.gz VFOCIKRGPMDRKR-UHFFFAOYSA-N 2 0 345.531 3.563 20 10 EHCDRP CCOc1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1O ZINC000768303527 1133122487 /nfs/dbraw/zinc/12/24/87/1133122487.db2.gz PXVQLKRIFYOCLR-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC(C)(C)C3)cc2)CC1 ZINC001178962726 1133216714 /nfs/dbraw/zinc/21/67/14/1133216714.db2.gz PTYPQICXIGAAFT-LJQANCHMSA-N 2 0 329.532 3.744 20 10 EHCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c(O)c1 ZINC000769148609 1133233404 /nfs/dbraw/zinc/23/34/04/1133233404.db2.gz OVACNUMFXCVMIQ-SFHVURJKSA-N 2 0 346.515 3.735 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1O ZINC000769149254 1133235222 /nfs/dbraw/zinc/23/52/22/1133235222.db2.gz ZMHCOJRQERLQSD-MSOLQXFVSA-N 2 0 346.515 3.877 20 10 EHCDRP CCOc1cccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1O ZINC000769516011 1133307784 /nfs/dbraw/zinc/30/77/84/1133307784.db2.gz XIPXGOCZADYKTG-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C)(c4ccccc4)C3)cc2)CC1 ZINC000771837015 1133597664 /nfs/dbraw/zinc/59/76/64/1133597664.db2.gz PZKCTDSGZXYZOF-UHFFFAOYSA-N 2 0 349.522 3.648 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)c3ccc(F)cc3)cc2)CC1 ZINC000771828164 1133602645 /nfs/dbraw/zinc/60/26/45/1133602645.db2.gz RXNXQPUWECAFSM-UHFFFAOYSA-N 2 0 341.474 3.602 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1F ZINC000775025973 1134228068 /nfs/dbraw/zinc/22/80/68/1134228068.db2.gz YBTBORANBNMEAE-UHFFFAOYSA-N 2 0 333.495 3.636 20 10 EHCDRP C[C@H](c1ccccc1F)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648226 1135396864 /nfs/dbraw/zinc/39/68/64/1135396864.db2.gz AXJOTKDJVXQLNV-QGZVFWFLSA-N 2 0 341.474 3.771 20 10 EHCDRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001201686089 1136056891 /nfs/dbraw/zinc/05/68/91/1136056891.db2.gz ZJPKMBICMMZCNS-WZONZLPQSA-N 2 0 349.522 3.852 20 10 EHCDRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817965033 1136853311 /nfs/dbraw/zinc/85/33/11/1136853311.db2.gz NUHXRVQMYLKPLH-AWEZNQCLSA-N 2 0 341.293 3.585 20 10 EHCDRP Cc1cc(Br)c([O-])c(C[NH2+]C(C)(C)CCC[NH+](C)C)c1 ZINC000824913760 1137156392 /nfs/dbraw/zinc/15/63/92/1137156392.db2.gz DZKZAFHTZRSBLZ-UHFFFAOYSA-N 2 0 343.309 3.673 20 10 EHCDRP Cc1cc(C)c(O)c(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000794668557 1137222525 /nfs/dbraw/zinc/22/25/25/1137222525.db2.gz WHCONPSXYWPSHB-OYRHEFFESA-N 2 0 336.479 3.573 20 10 EHCDRP C[NH+](C)C1(C)CCC([NH2+]Cc2c(O)cccc2Br)CC1 ZINC000715563570 1137477293 /nfs/dbraw/zinc/47/72/93/1137477293.db2.gz WNKHKVBCVQNAJZ-UHFFFAOYSA-N 2 0 341.293 3.507 20 10 EHCDRP C[C@H]([NH2+]Cc1c([O-])cccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000896639544 1025792729 /nfs/dbraw/zinc/79/27/29/1025792729.db2.gz VXELNWKVHBKSGK-DOTOQJQBSA-N 2 0 328.431 3.532 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(N(C)C)cc1 ZINC000162499076 1028884777 /nfs/dbraw/zinc/88/47/77/1028884777.db2.gz GPRKJYDVNOHHRJ-KRWDZBQOSA-N 2 0 341.499 3.544 20 10 EHCDRP C[NH+](C)CCCC1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000766382307 1132524189 /nfs/dbraw/zinc/52/41/89/1132524189.db2.gz QQPIJEMRNUCFLZ-UHFFFAOYSA-N 2 0 348.531 3.949 20 10 EHCDRP CN(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)c(C(F)(F)F)c1 ZINC000792789781 1134789004 /nfs/dbraw/zinc/78/90/04/1134789004.db2.gz NLJNLVHKAFQLPU-UHFFFAOYSA-N 2 0 343.437 3.545 20 10 EHCDRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775701884 1135538978 /nfs/dbraw/zinc/53/89/78/1135538978.db2.gz OHUVFLGSJSFSFS-LMNJBCLMSA-N 2 0 327.516 3.591 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815561152 1136610948 /nfs/dbraw/zinc/61/09/48/1136610948.db2.gz ZRNFZCLUXPUONW-YNEHKIRRSA-N 2 0 328.378 3.688 20 10 EHCDRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578243 1136613794 /nfs/dbraw/zinc/61/37/94/1136613794.db2.gz KGBMLPNSHCLWFO-TZIWHRDSSA-N 2 0 338.495 3.998 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1F ZINC000817903703 1136844541 /nfs/dbraw/zinc/84/45/41/1136844541.db2.gz SQBHUFXLWQOHLL-CQSZACIVSA-N 2 0 344.478 3.685 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132282 1136942239 /nfs/dbraw/zinc/94/22/39/1136942239.db2.gz YSZXCRQYMBQAIF-LJQANCHMSA-N 2 0 329.532 3.885 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1F ZINC000844904486 1137261315 /nfs/dbraw/zinc/26/13/15/1137261315.db2.gz NVPXMDNBRQYQSU-UHFFFAOYSA-N 2 0 333.426 3.560 20 10 EHCDRP CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1O ZINC000873241745 1137595037 /nfs/dbraw/zinc/59/50/37/1137595037.db2.gz YPGPZNACZFYMHI-UXIGCNINSA-N 2 0 341.293 3.713 20 10 EHCDRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000873272885 1137596009 /nfs/dbraw/zinc/59/60/09/1137596009.db2.gz WYTGIXHTEKLPIA-XHDPSFHLSA-N 2 0 341.293 3.584 20 10 EHCDRP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(O)c1 ZINC000877033243 1137668215 /nfs/dbraw/zinc/66/82/15/1137668215.db2.gz SIDPXRPSYVJJEH-SEJPIABJSA-N 2 0 336.479 3.986 20 10 EHCDRP Cc1cccc2[nH]c(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cc21 ZINC000883283691 1137852493 /nfs/dbraw/zinc/85/24/93/1137852493.db2.gz OZOQBXYMRTVTIN-UHFFFAOYSA-N 2 0 348.494 3.518 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000883289151 1137852811 /nfs/dbraw/zinc/85/28/11/1137852811.db2.gz FYZFDRFMRYYXER-HNNXBMFYSA-N 2 0 345.437 3.567 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384994 1139088730 /nfs/dbraw/zinc/08/87/30/1139088730.db2.gz YEIFFRBBNYANTO-SJORKVTESA-N 2 0 345.506 3.951 20 10 EHCDRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000183425605 1140037225 /nfs/dbraw/zinc/03/72/25/1140037225.db2.gz BMYPUFKCHBCWCN-KRWDZBQOSA-N 2 0 342.483 3.964 20 10 EHCDRP [O-]c1cc(F)c(F)cc1C[NH+]1CCC2(C[NH+](C3CCCC3)C2)CC1 ZINC001279106758 1016099470 /nfs/dbraw/zinc/09/94/70/1016099470.db2.gz DOSGVIJIPXWCBW-UHFFFAOYSA-N 2 0 336.426 3.511 20 10 EHCDRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185075122 1126751025 /nfs/dbraw/zinc/75/10/25/1126751025.db2.gz CVDGNWLEPSKPRW-HNNXBMFYSA-N 2 0 328.500 3.796 20 10 EHCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657799 1132241367 /nfs/dbraw/zinc/24/13/67/1132241367.db2.gz UMRBKAGKMSZGNO-GHTZIAJQSA-N 2 0 337.511 3.895 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CCCC2 ZINC000768465483 1133144450 /nfs/dbraw/zinc/14/44/50/1133144450.db2.gz HSYLHHVFXHOHSO-KRWDZBQOSA-N 2 0 328.500 3.579 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)CCCC2 ZINC000768463432 1133144660 /nfs/dbraw/zinc/14/46/60/1133144660.db2.gz TUPBJRJHYRPUAZ-NQIIRXRSSA-N 2 0 340.511 3.720 20 10 EHCDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810216379 1135939183 /nfs/dbraw/zinc/93/91/83/1135939183.db2.gz IRBKMTQYKSUTFS-DOMZBBRYSA-N 2 0 330.394 3.794 20 10 EHCDRP CSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC[NH+](C)CC1 ZINC000810252175 1135948903 /nfs/dbraw/zinc/94/89/03/1135948903.db2.gz KQTILLTYJZNONS-GFCCVEGCSA-N 2 0 328.909 3.524 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c(O)c1C ZINC000850481754 1136267662 /nfs/dbraw/zinc/26/76/62/1136267662.db2.gz BBOKVKZAKBZJRK-QGZVFWFLSA-N 2 0 346.515 3.551 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(O)c1 ZINC000850516647 1136275974 /nfs/dbraw/zinc/27/59/74/1136275974.db2.gz HZYXQRNUEWWNHM-KRWDZBQOSA-N 2 0 339.483 3.658 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093129 1136508630 /nfs/dbraw/zinc/50/86/30/1136508630.db2.gz DCIFCCYJDNHUPY-NRFANRHFSA-N 2 0 341.543 3.889 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241075 1136521441 /nfs/dbraw/zinc/52/14/41/1136521441.db2.gz UGJWCAGMNXFNAI-GHTZIAJQSA-N 2 0 329.532 3.915 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1N(C)C ZINC000815074190 1136547171 /nfs/dbraw/zinc/54/71/71/1136547171.db2.gz LDUONBXRLRHGPX-WIYYLYMNSA-N 2 0 327.516 3.510 20 10 EHCDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964398 1136852334 /nfs/dbraw/zinc/85/23/34/1136852334.db2.gz BEWQNWDTYHUBHN-UZLBHIALSA-N 2 0 333.495 3.856 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1O ZINC000817981520 1136854945 /nfs/dbraw/zinc/85/49/45/1136854945.db2.gz SPGWFOJSHPZTJE-TZMCWYRMSA-N 2 0 341.293 3.646 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1O ZINC000846143942 1137338767 /nfs/dbraw/zinc/33/87/67/1137338767.db2.gz BFRHHIVNXNJRNI-KLAILNCOSA-N 2 0 332.488 3.849 20 10 EHCDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Br)ccc2O)C1 ZINC000185112007 1140136299 /nfs/dbraw/zinc/13/62/99/1140136299.db2.gz YMVFLQLOYRAMHF-QWHCGFSZSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874309 201114217 /nfs/dbraw/zinc/11/42/17/201114217.db2.gz RFPFCDWPSHWPCC-DKICVRJWSA-N 2 0 328.431 3.875 20 10 EHCDRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000155201444 1016293360 /nfs/dbraw/zinc/29/33/60/1016293360.db2.gz ZKKCXFTUPBJHLF-IBGZPJMESA-N 2 0 328.456 3.574 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c(O)c1C ZINC000273599591 1027513319 /nfs/dbraw/zinc/51/33/19/1027513319.db2.gz RPPSZXYJSMJAHX-NUJGCVRESA-N 2 0 334.504 3.549 20 10 EHCDRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765406923 1127608563 /nfs/dbraw/zinc/60/85/63/1127608563.db2.gz WRDZNPKNNGGVKH-LVCYWYKZSA-N 2 0 347.547 3.683 20 10 EHCDRP CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1cc(Br)ccc1O ZINC000083526331 1127641400 /nfs/dbraw/zinc/64/14/00/1127641400.db2.gz FQZZJZGUONYBMS-CQSZACIVSA-N 2 0 343.309 3.783 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H](C)C3)cc2F)CC1 ZINC000742369672 1131716206 /nfs/dbraw/zinc/71/62/06/1131716206.db2.gz CRWWISJJBCNWSR-FUHWJXTLSA-N 2 0 333.495 3.636 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000769515381 1133307051 /nfs/dbraw/zinc/30/70/51/1133307051.db2.gz PQFDWGIWGVYTKU-FQEVSTJZSA-N 2 0 329.532 3.697 20 10 EHCDRP CCOc1cccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)c1O ZINC000775364779 1134668122 /nfs/dbraw/zinc/66/81/22/1134668122.db2.gz MZQHSMBSEKEWMZ-UHFFFAOYSA-N 2 0 334.504 3.925 20 10 EHCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775645589 1135389549 /nfs/dbraw/zinc/38/95/49/1135389549.db2.gz BNAOFKHHWPYCEF-SFHVURJKSA-N 2 0 335.495 3.558 20 10 EHCDRP C[C@@H](C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000775679275 1135503730 /nfs/dbraw/zinc/50/37/30/1135503730.db2.gz UEHUCFJRLQQJPF-IBGZPJMESA-N 2 0 337.511 3.674 20 10 EHCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815561071 1136610800 /nfs/dbraw/zinc/61/08/00/1136610800.db2.gz XODFKVDHHCRYRE-FPOVZHCZSA-N 2 0 338.495 3.998 20 10 EHCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815561072 1136610936 /nfs/dbraw/zinc/61/09/36/1136610936.db2.gz XODFKVDHHCRYRE-PZJWPPBQSA-N 2 0 338.495 3.998 20 10 EHCDRP CCC([NH3+])(CC)C[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000817960857 1136852022 /nfs/dbraw/zinc/85/20/22/1136852022.db2.gz RTYNGCSIGOXIJN-LLVKDONJSA-N 2 0 329.282 3.631 20 10 EHCDRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1O ZINC000817976559 1136854553 /nfs/dbraw/zinc/85/45/53/1136854553.db2.gz NLTHIVNZVGRFKU-HIFRSBDPSA-N 2 0 328.378 3.594 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000817979650 1136854895 /nfs/dbraw/zinc/85/48/95/1136854895.db2.gz MMRLLQRKTIIXMQ-HQRMLTQVSA-N 2 0 342.458 3.965 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCC2)cc1 ZINC000817985838 1136855371 /nfs/dbraw/zinc/85/53/71/1136855371.db2.gz NITKKWNTNJODJO-IJXRJRJASA-N 2 0 327.516 3.716 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1O ZINC000817987764 1136855438 /nfs/dbraw/zinc/85/54/38/1136855438.db2.gz WTCSEUWAUPKMLY-GMZLATJGSA-N 2 0 342.405 3.840 20 10 EHCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000794698626 1137235562 /nfs/dbraw/zinc/23/55/62/1137235562.db2.gz ICXQURAQWWEZSQ-AWEZNQCLSA-N 2 0 343.437 3.591 20 10 EHCDRP CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000844924564 1137263242 /nfs/dbraw/zinc/26/32/42/1137263242.db2.gz LXSQHBSZXZWLDF-OAHLLOKOSA-N 2 0 330.394 3.841 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1O ZINC000846144584 1137338897 /nfs/dbraw/zinc/33/88/97/1137338897.db2.gz IAXZTHGPZILSFL-DLBZAZTESA-N 2 0 342.483 3.962 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1O ZINC000873269493 1137595744 /nfs/dbraw/zinc/59/57/44/1137595744.db2.gz QGWLLLFLDYFCQY-VXGBXAGGSA-N 2 0 341.293 3.502 20 10 EHCDRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(O)c1 ZINC000876990479 1137667191 /nfs/dbraw/zinc/66/71/91/1137667191.db2.gz DYJVWDGULOOQEL-UHFFFAOYSA-N 2 0 330.497 3.764 20 10 EHCDRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cccc(OC)c1O ZINC000074335616 1017997793 /nfs/dbraw/zinc/99/77/93/1017997793.db2.gz BBOAVQDVSCWYRX-UHFFFAOYSA-N 2 0 328.456 3.532 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](Cn1ccnc1)c1ccccc1 ZINC000895706878 1024742303 /nfs/dbraw/zinc/74/23/03/1024742303.db2.gz OJHKOGAOQJXLFV-NRFANRHFSA-N 2 0 334.467 3.789 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000195133546 1032045238 /nfs/dbraw/zinc/04/52/38/1032045238.db2.gz ZFRAFUZPLGEOIB-FUHWJXTLSA-N 2 0 340.467 3.574 20 10 EHCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000173491197 1033369257 /nfs/dbraw/zinc/36/92/57/1033369257.db2.gz JGTMJQOGRARIJU-HNNXBMFYSA-N 2 0 342.483 3.791 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000185659051 1126969460 /nfs/dbraw/zinc/96/94/60/1126969460.db2.gz LFILVUXYJIMSJN-INIZCTEOSA-N 2 0 334.504 3.810 20 10 EHCDRP CCOc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(O)c1 ZINC000769317600 1133260544 /nfs/dbraw/zinc/26/05/44/1133260544.db2.gz TVIDEUYKZMXATN-GOSISDBHSA-N 2 0 346.515 3.879 20 10 EHCDRP COc1cccc(O)c1C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000769544032 1133312163 /nfs/dbraw/zinc/31/21/63/1133312163.db2.gz RIKBMBRJMJCRMG-QGZVFWFLSA-N 2 0 346.515 3.877 20 10 EHCDRP CC1=CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000788688727 1134157708 /nfs/dbraw/zinc/15/77/08/1134157708.db2.gz GUMDWXYJWPEOMI-NRFANRHFSA-N 2 0 339.527 3.807 20 10 EHCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CCc2ccccc21 ZINC000775648247 1135396941 /nfs/dbraw/zinc/39/69/41/1135396941.db2.gz RILSBCIVJAGOEE-QFIPXVFZSA-N 2 0 335.495 3.558 20 10 EHCDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC000809576510 1135852733 /nfs/dbraw/zinc/85/27/33/1135852733.db2.gz BPBFYSJLDRWDGS-NRFANRHFSA-N 2 0 349.522 3.633 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2c1c(F)ccc2O ZINC000853240684 1136521562 /nfs/dbraw/zinc/52/15/62/1136521562.db2.gz RAKBXHMHOUQYKI-UNEWFSDZSA-N 2 0 332.463 3.791 20 10 EHCDRP Oc1c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc2ccccc21 ZINC000816521254 1136727095 /nfs/dbraw/zinc/72/70/95/1136727095.db2.gz KRMPHLQOUIKEAU-LAUBAEHRSA-N 2 0 336.479 3.994 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000817901609 1136844473 /nfs/dbraw/zinc/84/44/73/1136844473.db2.gz CRHXHHCRTCJDET-YPAWHYETSA-N 2 0 341.543 3.933 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817946914 1136849829 /nfs/dbraw/zinc/84/98/29/1136849829.db2.gz HSZKVOKKXLHLPU-JMSVASOKSA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Br)ccc1O ZINC000817949877 1136850443 /nfs/dbraw/zinc/85/04/43/1136850443.db2.gz SUQMBFQHVTYTKN-LBPRGKRZSA-N 2 0 349.272 3.507 20 10 EHCDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817948334 1136850605 /nfs/dbraw/zinc/85/06/05/1136850605.db2.gz XZAYDBWPZQTPQV-BQFCYCMXSA-N 2 0 333.495 3.855 20 10 EHCDRP CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817964388 1136851955 /nfs/dbraw/zinc/85/19/55/1136851955.db2.gz ARIZNWHZKMFMID-CQSZACIVSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964395 1136852110 /nfs/dbraw/zinc/85/21/10/1136852110.db2.gz BEWQNWDTYHUBHN-JXFKEZNVSA-N 2 0 333.495 3.856 20 10 EHCDRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1O ZINC000873241746 1137595053 /nfs/dbraw/zinc/59/50/53/1137595053.db2.gz YPGPZNACZFYMHI-WHOFXGATSA-N 2 0 341.293 3.713 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000160536744 1027591809 /nfs/dbraw/zinc/59/18/09/1027591809.db2.gz FIQAPUAYOFXFKW-QGZVFWFLSA-N 2 0 341.499 3.544 20 10 EHCDRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(OC)ccc2O)cc1 ZINC000236920037 1121467647 /nfs/dbraw/zinc/46/76/47/1121467647.db2.gz NTVUKUPATSUBID-UHFFFAOYSA-N 2 0 328.456 3.532 20 10 EHCDRP C[NH+](C)CC1CC[NH+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1 ZINC000738077081 1131460322 /nfs/dbraw/zinc/46/03/22/1131460322.db2.gz RVBFOOHRYFGIEK-UHFFFAOYSA-N 2 0 342.483 3.791 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4sccc43)cc2)CC1 ZINC000767191194 1132964017 /nfs/dbraw/zinc/96/40/17/1132964017.db2.gz XNLSKRSBVCGLGF-LJQANCHMSA-N 2 0 341.524 3.667 20 10 EHCDRP CCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177641472 1133089840 /nfs/dbraw/zinc/08/98/40/1133089840.db2.gz DJXZQVITBVSEGW-PZJWPPBQSA-N 2 0 329.532 3.887 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C(C)C ZINC000746381421 1133514583 /nfs/dbraw/zinc/51/45/83/1133514583.db2.gz IGOLQDMCHFOGPO-GOSISDBHSA-N 2 0 330.516 3.988 20 10 EHCDRP Cc1ccc(F)c(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000775169403 1134473364 /nfs/dbraw/zinc/47/33/64/1134473364.db2.gz XBQWIJVJRRSESA-UHFFFAOYSA-N 2 0 341.474 3.518 20 10 EHCDRP CCOc1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)c(O)c1 ZINC000775360694 1134665430 /nfs/dbraw/zinc/66/54/30/1134665430.db2.gz CIJCSMXUILQFNZ-UHFFFAOYSA-N 2 0 334.504 3.925 20 10 EHCDRP CC(C)[N@H+](Cc1cccs1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775650901 1135416010 /nfs/dbraw/zinc/41/60/10/1135416010.db2.gz HDJGNTKPTZUSNQ-UHFFFAOYSA-N 2 0 343.540 3.911 20 10 EHCDRP CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775735560 1135592254 /nfs/dbraw/zinc/59/22/54/1135592254.db2.gz SDXDVFAUCBFESM-WOJBJXKFSA-N 2 0 347.572 3.544 20 10 EHCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809767517 1135879918 /nfs/dbraw/zinc/87/99/18/1135879918.db2.gz NFYCSGRPFUIVSG-FPOVZHCZSA-N 2 0 327.516 3.593 20 10 EHCDRP CCOc1ccc(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)c(O)c1 ZINC000809739381 1135883535 /nfs/dbraw/zinc/88/35/35/1135883535.db2.gz IWHVCTDLZJNTBC-UHFFFAOYSA-N 2 0 342.483 3.875 20 10 EHCDRP C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001201686088 1136056844 /nfs/dbraw/zinc/05/68/44/1136056844.db2.gz ZJPKMBICMMZCNS-MBSDFSHPSA-N 2 0 349.522 3.852 20 10 EHCDRP COc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)c(O)c(C(C)(C)C)c1 ZINC000850315816 1136234507 /nfs/dbraw/zinc/23/45/07/1136234507.db2.gz OLGIJFKIVSFLGV-UHFFFAOYSA-N 2 0 336.520 3.908 20 10 EHCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239246 1136520984 /nfs/dbraw/zinc/52/09/84/1136520984.db2.gz CVASQHFETAXGTJ-IEBWSBKVSA-N 2 0 329.532 3.915 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000858490947 1136972721 /nfs/dbraw/zinc/97/27/21/1136972721.db2.gz SYZKACALRYLDEN-QWHCGFSZSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000858490945 1136972880 /nfs/dbraw/zinc/97/28/80/1136972880.db2.gz SYZKACALRYLDEN-CHWSQXEVSA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1O ZINC000873239140 1137594823 /nfs/dbraw/zinc/59/48/23/1137594823.db2.gz OPRDXWNOTZVTLN-OBJOEFQTSA-N 2 0 341.293 3.631 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000184901296 1140125359 /nfs/dbraw/zinc/12/53/59/1140125359.db2.gz PRJCAWLECGUVMA-MRXNPFEDSA-N 2 0 340.467 3.847 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000184933479 1140126276 /nfs/dbraw/zinc/12/62/76/1140126276.db2.gz WHJQINPGYIDTTB-INIZCTEOSA-N 2 0 340.467 3.847 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857610 1020074958 /nfs/dbraw/zinc/07/49/58/1020074958.db2.gz JHERGUYJBIHTRT-QXAKKESOSA-N 2 0 334.504 3.570 20 10 EHCDRP CN(C)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168003529 1024118503 /nfs/dbraw/zinc/11/85/03/1024118503.db2.gz OPLMYFFTXLKVDW-WCRBZPEASA-N 2 0 327.516 3.590 20 10 EHCDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001168004206 1024173483 /nfs/dbraw/zinc/17/34/83/1024173483.db2.gz RPWZGGPGUZSWBQ-CBQGHPETSA-N 2 0 341.543 3.980 20 10 EHCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224290 1026900302 /nfs/dbraw/zinc/90/03/02/1026900302.db2.gz JKHZSAPHTQALSN-DLBZAZTESA-N 2 0 333.495 3.808 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000160529130 1030826763 /nfs/dbraw/zinc/82/67/63/1030826763.db2.gz KTXGWJSIXNMANW-KRWDZBQOSA-N 2 0 341.499 3.544 20 10 EHCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165927786 1036808009 /nfs/dbraw/zinc/80/80/09/1036808009.db2.gz YDJSCJHJMZSEQH-RXVVDRJESA-N 2 0 347.547 3.684 20 10 EHCDRP C[NH+](CCCCC[N@@H+](C)Cc1ccccc1O)Cc1ccccc1O ZINC000172656734 1128773468 /nfs/dbraw/zinc/77/34/68/1128773468.db2.gz ZPMURPZSGLEUMA-UHFFFAOYSA-N 2 0 342.483 3.832 20 10 EHCDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(OC)c(C)cc1O ZINC000768453453 1133141366 /nfs/dbraw/zinc/14/13/66/1133141366.db2.gz XNVVRYYHVPPJRO-UHFFFAOYSA-N 2 0 342.483 3.793 20 10 EHCDRP Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1 ZINC000768671295 1133168941 /nfs/dbraw/zinc/16/89/41/1133168941.db2.gz YLLPYLVKHSMBOU-UHFFFAOYSA-N 2 0 349.522 3.817 20 10 EHCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471868 1133297097 /nfs/dbraw/zinc/29/70/97/1133297097.db2.gz XPPGXPWCYYWZSW-NQIIRXRSSA-N 2 0 329.532 3.982 20 10 EHCDRP COc1cccc(O)c1C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000769544031 1133312083 /nfs/dbraw/zinc/31/20/83/1133312083.db2.gz RIKBMBRJMJCRMG-KRWDZBQOSA-N 2 0 346.515 3.877 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C(C)C ZINC000746381422 1133514889 /nfs/dbraw/zinc/51/48/89/1133514889.db2.gz IGOLQDMCHFOGPO-SFHVURJKSA-N 2 0 330.516 3.988 20 10 EHCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c(O)c1 ZINC000850482141 1136267358 /nfs/dbraw/zinc/26/73/58/1136267358.db2.gz HWZFGBIBAIFJFS-QGZVFWFLSA-N 2 0 346.515 3.551 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1O ZINC000817946795 1136849934 /nfs/dbraw/zinc/84/99/34/1136849934.db2.gz DYKYQTZJSJOXRN-AGIUHOORSA-N 2 0 341.293 3.502 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1O ZINC000817975736 1136854271 /nfs/dbraw/zinc/85/42/71/1136854271.db2.gz AIAYUTPJCNRCGX-RYUDHWBXSA-N 2 0 329.282 3.631 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1O ZINC000155201333 1016293847 /nfs/dbraw/zinc/29/38/47/1016293847.db2.gz BJAFMMCNUUCIOV-LJQANCHMSA-N 2 0 328.456 3.574 20 10 EHCDRP CN(C)c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c2ccccc21 ZINC001279217813 1016980902 /nfs/dbraw/zinc/98/09/02/1016980902.db2.gz COXUWPMUBDFPCX-HDICACEKSA-N 2 0 337.511 3.679 20 10 EHCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(N(C)C)cc1 ZINC001167970958 1022385698 /nfs/dbraw/zinc/38/56/98/1022385698.db2.gz QRKBLWVIHOTMQT-SRBWVJFJSA-N 2 0 327.516 3.809 20 10 EHCDRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000162550367 1028977082 /nfs/dbraw/zinc/97/70/82/1028977082.db2.gz OYDGZNKUOVBUEU-KRWDZBQOSA-N 2 0 341.499 3.544 20 10 EHCDRP CN(C)c1ccc([C@H]([NH3+])CNCc2ccc(C(F)F)c(F)c2)cc1 ZINC000904354016 1031973124 /nfs/dbraw/zinc/97/31/24/1031973124.db2.gz UFZWHEFTCBFUQD-QGZVFWFLSA-N 2 0 337.389 3.619 20 10 EHCDRP C[C@@]1(C[NH2+]Cc2cc(F)ccc2O)CC[N@H+](Cc2ccccc2)C1 ZINC000379772889 1132518708 /nfs/dbraw/zinc/51/87/08/1132518708.db2.gz RXBVFVULUJZELO-FQEVSTJZSA-N 2 0 328.431 3.533 20 10 EHCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001190827884 1134755473 /nfs/dbraw/zinc/75/54/73/1134755473.db2.gz QHGPMIJZFGMHTH-HXUWFJFHSA-N 2 0 329.532 3.841 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1 ZINC000809756804 1135887812 /nfs/dbraw/zinc/88/78/12/1135887812.db2.gz TYCJMGVQQJFBHU-HXUWFJFHSA-N 2 0 329.532 3.697 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2c1c(F)ccc2O ZINC000853240681 1136521537 /nfs/dbraw/zinc/52/15/37/1136521537.db2.gz RAKBXHMHOUQYKI-FRFSOERESA-N 2 0 332.463 3.791 20 10 EHCDRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1O ZINC000817585237 1136825366 /nfs/dbraw/zinc/82/53/66/1136825366.db2.gz DETSRCCQIDVBOA-XGNXJENSSA-N 2 0 341.293 3.678 20 10 EHCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[C@H]1CCC[NH2+]C1 ZINC000817948335 1136850156 /nfs/dbraw/zinc/85/01/56/1136850156.db2.gz XZAYDBWPZQTPQV-JZXOWHBKSA-N 2 0 333.495 3.855 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC000817978791 1136854450 /nfs/dbraw/zinc/85/44/50/1136854450.db2.gz DRSCMVOUTNLWET-OXFYSEKESA-N 2 0 342.458 3.884 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000817980217 1136855055 /nfs/dbraw/zinc/85/50/55/1136855055.db2.gz SIUVGIKBLUKTJG-SIXWZSSISA-N 2 0 328.431 3.575 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000858490948 1136973005 /nfs/dbraw/zinc/97/30/05/1136973005.db2.gz SYZKACALRYLDEN-STQMWFEESA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1Cl ZINC000825125014 1137166410 /nfs/dbraw/zinc/16/64/10/1137166410.db2.gz CNBYWKFRGMFGOO-UHFFFAOYSA-N 2 0 348.874 3.584 20 10 EHCDRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000844923069 1137263228 /nfs/dbraw/zinc/26/32/28/1137263228.db2.gz GJKOBDGHHQWBPP-GFCCVEGCSA-N 2 0 349.272 3.725 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1O ZINC000846136252 1137338266 /nfs/dbraw/zinc/33/82/66/1137338266.db2.gz JVOCBQXMTCRTAI-INIZCTEOSA-N 2 0 340.467 3.847 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1O ZINC000037644083 522616066 /nfs/dbraw/zinc/61/60/66/522616066.db2.gz RHZLUOHKCQRDTP-WFASDCNBSA-N 2 0 341.293 3.537 20 10 EHCDRP COc1ccc(N2CCC([NH2+]CCC[N@@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000160267145 1015569123 /nfs/dbraw/zinc/56/91/23/1015569123.db2.gz UJNDNMYLBNVRMR-GOSISDBHSA-N 2 0 345.531 3.518 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1 ZINC000185870228 1035551166 /nfs/dbraw/zinc/55/11/66/1035551166.db2.gz PKQBZDQKNGUWAF-INIZCTEOSA-N 2 0 325.456 3.663 20 10 EHCDRP CCOc1ccc(N2CC[NH+]([C@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167833914 1043012711 /nfs/dbraw/zinc/01/27/11/1043012711.db2.gz FUSDPGVESRYNPV-LJQANCHMSA-N 2 0 347.547 3.718 20 10 EHCDRP Cc1cc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716045 1127525537 /nfs/dbraw/zinc/52/55/37/1127525537.db2.gz GOMITFPOVOSDHR-OXQOHEQNSA-N 2 0 325.500 3.709 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)c3cccc(F)c3)cc2)CC1 ZINC000771844234 1133598853 /nfs/dbraw/zinc/59/88/53/1133598853.db2.gz XPTGSGQDFPTKJZ-UHFFFAOYSA-N 2 0 341.474 3.602 20 10 EHCDRP Cc1cnccc1OC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000775201005 1134508983 /nfs/dbraw/zinc/50/89/83/1134508983.db2.gz AGNHXDIXBNYQSA-UHFFFAOYSA-N 2 0 332.831 3.792 20 10 EHCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC000809703503 1135874314 /nfs/dbraw/zinc/87/43/14/1135874314.db2.gz LDMSROCJULFMKC-JOCHJYFZSA-N 2 0 336.479 3.799 20 10 EHCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809767460 1135879591 /nfs/dbraw/zinc/87/95/91/1135879591.db2.gz LNYZZSDUHYVQHM-PZJWPPBQSA-N 2 0 336.479 3.975 20 10 EHCDRP [NH3+]CCN(c1ccc(C2([NH3+])CCC2)cc1)C12CC3CC(CC(C3)C1)C2 ZINC001170627338 1136053034 /nfs/dbraw/zinc/05/30/34/1136053034.db2.gz PIVKNASJNASADK-UHFFFAOYSA-N 2 0 339.527 3.758 20 10 EHCDRP COc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850280224 1136230305 /nfs/dbraw/zinc/23/03/05/1136230305.db2.gz JCUVPTFMECFDML-UHFFFAOYSA-N 2 0 346.515 3.662 20 10 EHCDRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000854230059 1136599996 /nfs/dbraw/zinc/59/99/96/1136599996.db2.gz FQUXMQWDFXFBMM-KGLIPLIRSA-N 2 0 329.282 3.569 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1O ZINC000817979579 1136854897 /nfs/dbraw/zinc/85/48/97/1136854897.db2.gz LXVHWYZLVSILKN-QIIPPGSGSA-N 2 0 346.421 3.714 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817987139 1136855658 /nfs/dbraw/zinc/85/56/58/1136855658.db2.gz WRVAEYMTTSLUNH-GDAAHCPNSA-N 2 0 345.506 3.855 20 10 EHCDRP Cc1ccc(O)c(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)c1 ZINC000862478541 1137146076 /nfs/dbraw/zinc/14/60/76/1137146076.db2.gz JEXRLWVTHVFSFY-SFHVURJKSA-N 2 0 338.495 3.886 20 10 EHCDRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000844923133 1137263173 /nfs/dbraw/zinc/26/31/73/1137263173.db2.gz HDDBGFYVSAEBDC-LBPRGKRZSA-N 2 0 349.272 3.725 20 10 EHCDRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000844924563 1137263196 /nfs/dbraw/zinc/26/31/96/1137263196.db2.gz LXSQHBSZXZWLDF-HNNXBMFYSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)cc(F)c1 ZINC000883289152 1137852838 /nfs/dbraw/zinc/85/28/38/1137852838.db2.gz FYZFDRFMRYYXER-OAHLLOKOSA-N 2 0 345.437 3.567 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000883289454 1137852890 /nfs/dbraw/zinc/85/28/90/1137852890.db2.gz PHAJQDUAPYGWSO-OAHLLOKOSA-N 2 0 345.437 3.567 20 10 EHCDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000185356737 1140146675 /nfs/dbraw/zinc/14/66/75/1140146675.db2.gz VLVPQJQEJNDIOD-LBPRGKRZSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@@H]1CC([NH2+]Cc2cccc(O)c2O)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168029578 1024548473 /nfs/dbraw/zinc/54/84/73/1024548473.db2.gz TVAYILMKOLNEIF-HZPDHXFCSA-N 2 0 340.467 3.629 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107843 1027649441 /nfs/dbraw/zinc/64/94/41/1027649441.db2.gz ORQLGIBNZSJDNK-ZWKOTPCHSA-N 2 0 342.527 3.967 20 10 EHCDRP CC[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)CC(F)(F)F ZINC000840960082 1028062009 /nfs/dbraw/zinc/06/20/09/1028062009.db2.gz FBTKRHIYBZROSJ-HNNXBMFYSA-N 2 0 343.437 3.507 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168352753 1030782539 /nfs/dbraw/zinc/78/25/39/1030782539.db2.gz CIAXGWOIPUYOJG-UHFFFAOYSA-N 2 0 327.516 3.641 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccccc3)cc2F)CC1 ZINC000173400526 1033302599 /nfs/dbraw/zinc/30/25/99/1033302599.db2.gz AHZYITNMRPONAT-KRWDZBQOSA-N 2 0 341.474 3.818 20 10 EHCDRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)CC1 ZINC000740004199 1131515856 /nfs/dbraw/zinc/51/58/56/1131515856.db2.gz IMWPTIQVKZIZSJ-UHFFFAOYSA-N 2 0 335.511 3.884 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4sccc43)cc2)CC1 ZINC000767191193 1132964703 /nfs/dbraw/zinc/96/47/03/1132964703.db2.gz XNLSKRSBVCGLGF-IBGZPJMESA-N 2 0 341.524 3.667 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@]3(C)CCCc4ccccc43)cc2)CC1 ZINC000771855478 1133607484 /nfs/dbraw/zinc/60/74/84/1133607484.db2.gz ZTIAIGDMOIHYAY-HSZRJFAPSA-N 2 0 349.522 3.780 20 10 EHCDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000774498859 1133689658 /nfs/dbraw/zinc/68/96/58/1133689658.db2.gz VGHVUYIVNPPOMF-HNNXBMFYSA-N 2 0 328.500 3.796 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC=C(C)CC3)cc2F)CC1 ZINC000788593205 1134149062 /nfs/dbraw/zinc/14/90/62/1134149062.db2.gz GOFRBNIVEAYYBP-GOSISDBHSA-N 2 0 331.479 3.556 20 10 EHCDRP CSC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC[NH+](C)CC1 ZINC000810171225 1135930531 /nfs/dbraw/zinc/93/05/31/1135930531.db2.gz XDRMKSWGVXOOKZ-UHFFFAOYSA-N 2 0 347.572 3.594 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000850584714 1136293764 /nfs/dbraw/zinc/29/37/64/1136293764.db2.gz TZJRRKCCZLBQCE-KRWDZBQOSA-N 2 0 329.532 3.915 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Br)cc1O ZINC000817976240 1136854134 /nfs/dbraw/zinc/85/41/34/1136854134.db2.gz WMURYONPCGRBDM-JHJVBQTASA-N 2 0 341.293 3.570 20 10 EHCDRP CN(Cc1cccs1)c1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000823840913 1137115873 /nfs/dbraw/zinc/11/58/73/1137115873.db2.gz DEZVGBVCXTVUGA-GOSISDBHSA-N 2 0 343.540 3.816 20 10 EHCDRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(Br)cc2O)c1 ZINC000825421869 1137177363 /nfs/dbraw/zinc/17/73/63/1137177363.db2.gz HNNUPWSAAWHDQF-UHFFFAOYSA-N 2 0 349.272 3.506 20 10 EHCDRP COc1cccc(C[N@@H+]2CCC[C@@H](C[C@H]([NH3+])C3CCCC3)C2)c1O ZINC000873232252 1137594474 /nfs/dbraw/zinc/59/44/74/1137594474.db2.gz NSYOMCCGLUCDRL-YJBOKZPZSA-N 2 0 332.488 3.520 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N2CCCCC2)cc1 ZINC000873259460 1137595570 /nfs/dbraw/zinc/59/55/70/1137595570.db2.gz FJGZSAWVSWULQK-IZBJGVDFSA-N 2 0 327.516 3.858 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)ccc1O ZINC000184901492 1140125109 /nfs/dbraw/zinc/12/51/09/1140125109.db2.gz UGWAHLHKDKSVMT-OAHLLOKOSA-N 2 0 328.431 3.978 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857714 1020074642 /nfs/dbraw/zinc/07/46/42/1020074642.db2.gz JHERGUYJBIHTRT-WDSOQIARSA-N 2 0 334.504 3.570 20 10 EHCDRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000020129063 1025774539 /nfs/dbraw/zinc/77/45/39/1025774539.db2.gz CXBOXAMCDFLSQF-HNNXBMFYSA-N 2 0 341.293 3.681 20 10 EHCDRP CCOc1ccc(N2CC[NH+]([C@@H](C)CCC[NH+](CC)CC)CC2)cc1 ZINC001167833913 1043012900 /nfs/dbraw/zinc/01/29/00/1043012900.db2.gz FUSDPGVESRYNPV-IBGZPJMESA-N 2 0 347.547 3.718 20 10 EHCDRP Cc1cc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716041 1127525567 /nfs/dbraw/zinc/52/55/67/1127525567.db2.gz GOMITFPOVOSDHR-JXFKEZNVSA-N 2 0 325.500 3.709 20 10 EHCDRP CN(C)c1ccc(/C=C/C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000922845358 1129691681 /nfs/dbraw/zinc/69/16/81/1129691681.db2.gz OUMRJYBNZQBIJS-GQCTYLIASA-N 2 0 327.516 3.762 20 10 EHCDRP Oc1cc2c(cc1C[NH+]1CCC(C[NH+]3CCCC3)CC1)CCCC2 ZINC000768446469 1133140074 /nfs/dbraw/zinc/14/00/74/1133140074.db2.gz KMHHFXSITRRTTI-UHFFFAOYSA-N 2 0 328.500 3.579 20 10 EHCDRP C[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775642133 1135381457 /nfs/dbraw/zinc/38/14/57/1135381457.db2.gz GUIJKONXTYQRSZ-UHFFFAOYSA-N 2 0 343.902 3.724 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2cc(OC)ccc2O)CC1)CC1CC1 ZINC000775759744 1135653848 /nfs/dbraw/zinc/65/38/48/1135653848.db2.gz HXXDLBOJYXMJIJ-UHFFFAOYSA-N 2 0 346.515 3.735 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccsc3C)cc2F)CC1 ZINC000815124406 1136554134 /nfs/dbraw/zinc/55/41/34/1136554134.db2.gz WNCIFBMQNMKYGT-UHFFFAOYSA-N 2 0 347.503 3.627 20 10 EHCDRP Oc1c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc2ccccc21 ZINC000816521255 1136726839 /nfs/dbraw/zinc/72/68/39/1136726839.db2.gz KRMPHLQOUIKEAU-UTKZUKDTSA-N 2 0 336.479 3.994 20 10 EHCDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817980007 1136854883 /nfs/dbraw/zinc/85/48/83/1136854883.db2.gz GYWCDBPRAGLZSR-WMZOPIPTSA-N 2 0 333.495 3.999 20 10 EHCDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817980005 1136854922 /nfs/dbraw/zinc/85/49/22/1136854922.db2.gz GYWCDBPRAGLZSR-FUHWJXTLSA-N 2 0 333.495 3.999 20 10 EHCDRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000844926425 1137263424 /nfs/dbraw/zinc/26/34/24/1137263424.db2.gz UDIGECPBKKTGKE-HNNXBMFYSA-N 2 0 341.293 3.585 20 10 EHCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)c3cccnc3c1[O-])C2 ZINC001172104635 1137536476 /nfs/dbraw/zinc/53/64/76/1137536476.db2.gz DPFJAQOSPPXBKM-QKDCVEJESA-N 2 0 345.874 3.699 20 10 EHCDRP CC[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1O ZINC000873234315 1137594673 /nfs/dbraw/zinc/59/46/73/1137594673.db2.gz BDAWOMYEQNYDJL-SFHVURJKSA-N 2 0 330.859 3.932 20 10 EHCDRP CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000873270092 1137595887 /nfs/dbraw/zinc/59/58/87/1137595887.db2.gz WYTGIXHTEKLPIA-IAQYHMDHSA-N 2 0 341.293 3.584 20 10 EHCDRP COc1cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000825699289 1137607424 /nfs/dbraw/zinc/60/74/24/1137607424.db2.gz SZTXSKWMWQQJSM-INIZCTEOSA-N 2 0 334.504 3.614 20 10 EHCDRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(N(C)C)cc1 ZINC000122307608 1138256932 /nfs/dbraw/zinc/25/69/32/1138256932.db2.gz UNXOMXFMMLMFLJ-KRWDZBQOSA-N 2 0 341.499 3.544 20 10 EHCDRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)ccc1O ZINC000184933765 1140126331 /nfs/dbraw/zinc/12/63/31/1140126331.db2.gz IJYKILQPOGDTLI-OAHLLOKOSA-N 2 0 328.431 3.978 20 10 EHCDRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000185314515 1140144312 /nfs/dbraw/zinc/14/43/12/1140144312.db2.gz KHAFGLUVTBNAHV-MRXNPFEDSA-N 2 0 342.483 3.697 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000185634433 1140160273 /nfs/dbraw/zinc/16/02/73/1140160273.db2.gz AQLJGWWUWFZYRA-HNNXBMFYSA-N 2 0 332.488 3.849 20 10 EHCDRP c1cc(N2CCCC2)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167964866 1021613527 /nfs/dbraw/zinc/61/35/27/1021613527.db2.gz ZARVZUPILOGAAR-XDNSSPFJSA-N 2 0 339.527 3.782 20 10 EHCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000761191062 1034372350 /nfs/dbraw/zinc/37/23/50/1034372350.db2.gz KFFHZBMLHKKOMT-UHFFFAOYSA-N 2 0 340.895 3.608 20 10 EHCDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CCCCC3)c(C)c2)C1 ZINC000827991788 1034390614 /nfs/dbraw/zinc/39/06/14/1034390614.db2.gz WOQXSTGWXCBLPB-FQEVSTJZSA-N 2 0 329.532 3.759 20 10 EHCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)CC[N@@H+]1Cc1ccccc1 ZINC000080338650 1041149447 /nfs/dbraw/zinc/14/94/47/1041149447.db2.gz YHSDSXOQNBFBAS-UWJYYQICSA-N 2 0 336.479 3.764 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1O ZINC000769318320 1133260774 /nfs/dbraw/zinc/26/07/74/1133260774.db2.gz UUQCSALYLHIWHS-GOSISDBHSA-N 2 0 346.515 3.879 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3cccs3)cc2)CC1 ZINC000775645491 1135389677 /nfs/dbraw/zinc/38/96/77/1135389677.db2.gz ALJHKGCVEACBSW-LJQANCHMSA-N 2 0 341.524 3.837 20 10 EHCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642401 1136743446 /nfs/dbraw/zinc/74/34/46/1136743446.db2.gz YMDRXAOOFMICBZ-OAQYLSRUSA-N 2 0 327.516 3.595 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817947143 1136850267 /nfs/dbraw/zinc/85/02/67/1136850267.db2.gz LFQCSCJGHXGQFZ-ZOWXZIJZSA-N 2 0 330.394 3.840 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1O ZINC000817964865 1136852330 /nfs/dbraw/zinc/85/23/30/1136852330.db2.gz LQUPXHDXRNAAES-GFCCVEGCSA-N 2 0 341.293 3.503 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1O ZINC000846140007 1137338344 /nfs/dbraw/zinc/33/83/44/1137338344.db2.gz CXMXAIMKRBZJQD-ULQDDVLXSA-N 2 0 334.504 3.810 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000122259762 1138256243 /nfs/dbraw/zinc/25/62/43/1138256243.db2.gz WWJSXRCRFGDMCE-LQWHRVPQSA-N 2 0 347.547 3.540 20 10 EHCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185671137 1140161965 /nfs/dbraw/zinc/16/19/65/1140161965.db2.gz WJNBCQTXNNTETG-NVXWUHKLSA-N 2 0 330.472 3.553 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1O ZINC000037644084 522855547 /nfs/dbraw/zinc/85/55/47/522855547.db2.gz RHZLUOHKCQRDTP-SWLSCSKDSA-N 2 0 341.293 3.537 20 10 EHCDRP CCN1CCC([NH2+][C@@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000275299913 1016335967 /nfs/dbraw/zinc/33/59/67/1016335967.db2.gz HUXWTRDRVQINFR-LBPRGKRZSA-N 2 0 341.293 3.598 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(O)c1C ZINC000273409640 1027413624 /nfs/dbraw/zinc/41/36/24/1027413624.db2.gz PHLAYUBZYDIJDX-QGZVFWFLSA-N 2 0 342.483 3.800 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1O ZINC000185337639 1126869085 /nfs/dbraw/zinc/86/90/85/1126869085.db2.gz RPESBYFSQGXUMI-AEFFLSMTSA-N 2 0 342.458 3.747 20 10 EHCDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733324638 1131025318 /nfs/dbraw/zinc/02/53/18/1131025318.db2.gz PPSBBJVXXVGAOC-CALCHBBNSA-N 2 0 335.511 3.739 20 10 EHCDRP Cc1cc(C[NH+]2CCC(OCC[NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000738209030 1131464272 /nfs/dbraw/zinc/46/42/72/1131464272.db2.gz MPWBXHILPQYWJM-UHFFFAOYSA-N 2 0 348.531 3.541 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379636044 1132177947 /nfs/dbraw/zinc/17/79/47/1132177947.db2.gz WXMJZNCBOXBMBP-IAGOWNOFSA-N 2 0 342.483 3.962 20 10 EHCDRP CC[C@](C)([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000771829010 1133602248 /nfs/dbraw/zinc/60/22/48/1133602248.db2.gz DWTBHWWKQIPIAZ-QFIPXVFZSA-N 2 0 337.511 3.853 20 10 EHCDRP C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775680471 1135504284 /nfs/dbraw/zinc/50/42/84/1135504284.db2.gz FUCMHWGPQVDXGV-SFHVURJKSA-N 2 0 335.495 3.558 20 10 EHCDRP COc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000850323870 1136235085 /nfs/dbraw/zinc/23/50/85/1136235085.db2.gz HIHAWYWHNXBNIN-OAHLLOKOSA-N 2 0 334.504 3.520 20 10 EHCDRP CC[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000850583952 1136293518 /nfs/dbraw/zinc/29/35/18/1136293518.db2.gz OSOPMAASEOEOQR-NRFANRHFSA-N 2 0 329.532 3.915 20 10 EHCDRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CCC2 ZINC000813790119 1136363058 /nfs/dbraw/zinc/36/30/58/1136363058.db2.gz GYNZVDMVXRVYNC-HSZRJFAPSA-N 2 0 349.522 3.914 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000817957984 1136852264 /nfs/dbraw/zinc/85/22/64/1136852264.db2.gz RTRHUFPJEVXNMH-MDNUFGMLSA-N 2 0 349.522 3.702 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1O ZINC000817987765 1136855305 /nfs/dbraw/zinc/85/53/05/1136855305.db2.gz WTCSEUWAUPKMLY-NCZKRNLISA-N 2 0 342.405 3.840 20 10 EHCDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000185356759 1140146394 /nfs/dbraw/zinc/14/63/94/1140146394.db2.gz VLVPQJQEJNDIOD-GFCCVEGCSA-N 2 0 341.293 3.537 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000185634453 1140159931 /nfs/dbraw/zinc/15/99/31/1140159931.db2.gz AQLJGWWUWFZYRA-OAHLLOKOSA-N 2 0 332.488 3.849 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(Br)ccc1O ZINC000049553241 1014354220 /nfs/dbraw/zinc/35/42/20/1014354220.db2.gz ZRDCLAWAGDAZPY-FZMZJTMJSA-N 2 0 329.282 3.536 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[NH2+][C@H](Cn1ccnc1)c1ccccc1 ZINC000895706879 1024742570 /nfs/dbraw/zinc/74/25/70/1024742570.db2.gz OJHKOGAOQJXLFV-OAQYLSRUSA-N 2 0 334.467 3.789 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c1C ZINC000273599594 1027512918 /nfs/dbraw/zinc/51/29/18/1027512918.db2.gz RPPSZXYJSMJAHX-SOLBZPMBSA-N 2 0 334.504 3.549 20 10 EHCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000271893509 1029218229 /nfs/dbraw/zinc/21/82/29/1029218229.db2.gz SNCBASOFDZCBEJ-MRXNPFEDSA-N 2 0 331.479 3.729 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccccc3)cc2F)CC1 ZINC000173400537 1033303314 /nfs/dbraw/zinc/30/33/14/1033303314.db2.gz AHZYITNMRPONAT-QGZVFWFLSA-N 2 0 341.474 3.818 20 10 EHCDRP CC(C)(C)c1cc(O)c(O)c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000151826755 1037709083 /nfs/dbraw/zinc/70/90/83/1037709083.db2.gz ZLXYOIBRSZSPOC-UHFFFAOYSA-N 2 0 346.515 3.703 20 10 EHCDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(N(C)C)cc1 ZINC000768131966 1133100318 /nfs/dbraw/zinc/10/03/18/1133100318.db2.gz DGLGRVWEORSUKS-UHFFFAOYSA-N 2 0 325.500 3.836 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000769147940 1133232885 /nfs/dbraw/zinc/23/28/85/1133232885.db2.gz IXVKCTWCJFCJCP-UYAOXDASSA-N 2 0 329.532 3.839 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC(=C4CCC4)CC3)cc2)CC1 ZINC001183532580 1133824531 /nfs/dbraw/zinc/82/45/31/1133824531.db2.gz DZHKHRVXJYQXSV-UHFFFAOYSA-N 2 0 339.527 3.951 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3cccs3)cc2)CC1 ZINC000775645487 1135389765 /nfs/dbraw/zinc/38/97/65/1135389765.db2.gz ALJHKGCVEACBSW-IBGZPJMESA-N 2 0 341.524 3.837 20 10 EHCDRP CC[N@H+](CCC[NH+](C)C)Cc1ccc(OCc2ccccc2)cc1O ZINC000809750442 1135885258 /nfs/dbraw/zinc/88/52/58/1135885258.db2.gz WLHJMUIDBNEXFW-UHFFFAOYSA-N 2 0 342.483 3.745 20 10 EHCDRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001199329512 1135898031 /nfs/dbraw/zinc/89/80/31/1135898031.db2.gz USVZWFBYXHNNKS-KDURUIRLSA-N 2 0 329.532 3.744 20 10 EHCDRP Oc1ccccc1C[N@H+](Cc1cccc2c1CC[NH2+]C2)C1CCCC1 ZINC000852744799 1136483070 /nfs/dbraw/zinc/48/30/70/1136483070.db2.gz JIACGHWYDUGPOZ-UHFFFAOYSA-N 2 0 336.479 3.983 20 10 EHCDRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817964387 1136852284 /nfs/dbraw/zinc/85/22/84/1136852284.db2.gz ARIZNWHZKMFMID-AWEZNQCLSA-N 2 0 330.394 3.841 20 10 EHCDRP CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817965034 1136853030 /nfs/dbraw/zinc/85/30/30/1136853030.db2.gz NUHXRVQMYLKPLH-CQSZACIVSA-N 2 0 341.293 3.585 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1O ZINC000817976558 1136854219 /nfs/dbraw/zinc/85/42/19/1136854219.db2.gz NLTHIVNZVGRFKU-DZGCQCFKSA-N 2 0 328.378 3.594 20 10 EHCDRP COc1cc(C[N@@H+]2CCCC23CC[NH+](C)CC3)c(O)c(C(C)(C)C)c1 ZINC000825620368 1137582645 /nfs/dbraw/zinc/58/26/45/1137582645.db2.gz AVJFSWFUONVYDN-UHFFFAOYSA-N 2 0 346.515 3.759 20 10 EHCDRP Cc1ccc(C[NH2+]C[C@@H]2CCCN(C)[C@@H]2c2cccs2)c(O)c1 ZINC000877056109 1137668856 /nfs/dbraw/zinc/66/88/56/1137668856.db2.gz YPPVDBRTOFLTKJ-LPHOPBHVSA-N 2 0 330.497 3.935 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000883289560 1137852852 /nfs/dbraw/zinc/85/28/52/1137852852.db2.gz SJWQVDDTGSITHW-HNNXBMFYSA-N 2 0 345.437 3.567 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000186518328 1140208136 /nfs/dbraw/zinc/20/81/36/1140208136.db2.gz ZUJMGBVSBUKLKF-HRCADAONSA-N 2 0 332.488 3.704 20 10 EHCDRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cccc(OC)c2O)cc1 ZINC000074336682 1017997394 /nfs/dbraw/zinc/99/73/94/1017997394.db2.gz DSTWMEUHAAKYJU-UHFFFAOYSA-N 2 0 328.456 3.532 20 10 EHCDRP Cc1ccnc2cc(NCc3ccc(N4CC[NH+](C)CC4)cc3)ccc12 ZINC001167434094 1020004446 /nfs/dbraw/zinc/00/44/46/1020004446.db2.gz BFFQHPLQINORJH-UHFFFAOYSA-N 2 0 346.478 3.907 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857829 1020076947 /nfs/dbraw/zinc/07/69/47/1020076947.db2.gz JHERGUYJBIHTRT-UHOSZYNNSA-N 2 0 334.504 3.570 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000185038883 1126746589 /nfs/dbraw/zinc/74/65/89/1126746589.db2.gz PCYXDNKPVOLVNE-BBWFWOEESA-N 2 0 334.504 3.810 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000185337352 1126868767 /nfs/dbraw/zinc/86/87/67/1126868767.db2.gz QIZNJOYUBUFALP-UYAOXDASSA-N 2 0 338.495 3.916 20 10 EHCDRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(OC)ccc1O ZINC000236911635 1121468496 /nfs/dbraw/zinc/46/84/96/1121468496.db2.gz AOISZVCLZSHEIL-UHFFFAOYSA-N 2 0 328.456 3.532 20 10 EHCDRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733324640 1131025203 /nfs/dbraw/zinc/02/52/03/1131025203.db2.gz PPSBBJVXXVGAOC-IRXDYDNUSA-N 2 0 335.511 3.739 20 10 EHCDRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)CC1 ZINC001175351446 1132645873 /nfs/dbraw/zinc/64/58/73/1132645873.db2.gz MGGORKWXQPDXGW-OAQYLSRUSA-N 2 0 329.532 3.839 20 10 EHCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315648 1133260179 /nfs/dbraw/zinc/26/01/79/1133260179.db2.gz KIUJIRUMMVDGPV-GOSISDBHSA-N 2 0 346.515 3.879 20 10 EHCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000770506217 1133436000 /nfs/dbraw/zinc/43/60/00/1133436000.db2.gz ZEZCULSJOMAONC-TZIWHRDSSA-N 2 0 336.479 3.879 20 10 EHCDRP Cc1cc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)n1-c1ccccc1 ZINC000774110694 1133611781 /nfs/dbraw/zinc/61/17/81/1133611781.db2.gz GOTGMZRPABNVAR-XDNSSPFJSA-N 2 0 337.511 3.851 20 10 EHCDRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000810252088 1135948182 /nfs/dbraw/zinc/94/81/82/1135948182.db2.gz HWYCGJPCGDQAGC-SFHVURJKSA-N 2 0 335.561 3.621 20 10 EHCDRP CCOCc1cc(CNCC[C@H](C)[NH+]2CCCCC2)ccc1OC ZINC001201954087 1136078026 /nfs/dbraw/zinc/07/80/26/1136078026.db2.gz HDFRPXMLHQSRGX-KRWDZBQOSA-N 2 0 334.504 3.586 20 10 EHCDRP CCC[NH+]1CCC([NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850012728 1136199074 /nfs/dbraw/zinc/19/90/74/1136199074.db2.gz ODEUMTPCRDLFJI-UHFFFAOYSA-N 2 0 334.504 3.662 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000850517344 1136275826 /nfs/dbraw/zinc/27/58/26/1136275826.db2.gz YZLVEAKPOYRUGW-KRWDZBQOSA-N 2 0 339.483 3.658 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000814298441 1136437894 /nfs/dbraw/zinc/43/78/94/1136437894.db2.gz SZKALGGBFBOXHA-QHCPKHFHSA-N 2 0 349.522 3.722 20 10 EHCDRP CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817966462 1136853038 /nfs/dbraw/zinc/85/30/38/1136853038.db2.gz OJPBQIHOUUUDBW-GDBMZVCRSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Br)cc1O ZINC000817976238 1136854491 /nfs/dbraw/zinc/85/44/91/1136854491.db2.gz WMURYONPCGRBDM-AVGNSLFASA-N 2 0 341.293 3.570 20 10 EHCDRP CC1(C)C[C@H]([NH2+]Cc2cccc(O)c2O)CC[N@@H+]1Cc1ccccc1 ZINC001171977214 1137525607 /nfs/dbraw/zinc/52/56/07/1137525607.db2.gz YYOLBHZZHUXNMT-GOSISDBHSA-N 2 0 340.467 3.631 20 10 EHCDRP C[C@H]1C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2c1c(F)ccc2O ZINC000873235320 1137594728 /nfs/dbraw/zinc/59/47/28/1137594728.db2.gz KXENSIFTTLEGRD-YVEFUNNKSA-N 2 0 326.415 3.515 20 10 EHCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1O ZINC000873246111 1137595136 /nfs/dbraw/zinc/59/51/36/1137595136.db2.gz WYTIIOGWHJPLER-DGCLKSJQSA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc2ccccc2c1O ZINC000873246558 1137595142 /nfs/dbraw/zinc/59/51/42/1137595142.db2.gz WTDNLNLLFGQOGD-OAHLLOKOSA-N 2 0 348.450 3.523 20 10 EHCDRP COc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(O)c(C(C)(C)C)c1 ZINC000825885427 1137654497 /nfs/dbraw/zinc/65/44/97/1137654497.db2.gz GBFJZKISSNGOOM-SJPCQFCGSA-N 2 0 346.515 3.755 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1cc(Br)ccc1O ZINC000226864667 1033515549 /nfs/dbraw/zinc/51/55/49/1033515549.db2.gz UJRDYRXUEYQUHQ-LNSITVRQSA-N 2 0 341.293 3.678 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000248183252 1040715554 /nfs/dbraw/zinc/71/55/54/1040715554.db2.gz WWJSXRCRFGDMCE-OPYAIIAOSA-N 2 0 347.547 3.540 20 10 EHCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)CC[N@@H+]1Cc1ccccc1 ZINC000080338642 1041159296 /nfs/dbraw/zinc/15/92/96/1041159296.db2.gz YHSDSXOQNBFBAS-LAUBAEHRSA-N 2 0 336.479 3.764 20 10 EHCDRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCN(c2ccc(OC)cc2C)CC1 ZINC001167841857 1043122391 /nfs/dbraw/zinc/12/23/91/1043122391.db2.gz SNLXAHUMTNFNHO-IBGZPJMESA-N 2 0 347.547 3.636 20 10 EHCDRP Oc1cc2c(cc1C[NH+]1CCC(C[NH+]3CCCCCC3)CC1)CCC2 ZINC000917442565 1122608946 /nfs/dbraw/zinc/60/89/46/1122608946.db2.gz FOPXTGMEIRZKKU-UHFFFAOYSA-N 2 0 342.527 3.969 20 10 EHCDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Br)cc1O ZINC000700973335 1130086792 /nfs/dbraw/zinc/08/67/92/1130086792.db2.gz GOKUKDJPGBICCL-ZDUSSCGKSA-N 2 0 343.309 3.755 20 10 EHCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000738090341 1131460916 /nfs/dbraw/zinc/46/09/16/1131460916.db2.gz PGVZLMNDWFXYGB-UHFFFAOYSA-N 2 0 348.531 3.948 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C3CCC(C)CC3)cc2F)CC1 ZINC000742370129 1131711234 /nfs/dbraw/zinc/71/12/34/1131711234.db2.gz ROWZVZRCPLHBJU-UHFFFAOYSA-N 2 0 333.495 3.636 20 10 EHCDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(C)cc(C)c2O)CC1 ZINC000766376344 1132526750 /nfs/dbraw/zinc/52/67/50/1132526750.db2.gz ZRXIFTABGHIHAQ-UHFFFAOYSA-N 2 0 348.531 3.579 20 10 EHCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(-c4ccccc4)ccc3O)CC[C@H]21 ZINC000770353652 1133420355 /nfs/dbraw/zinc/42/03/55/1133420355.db2.gz SXPKVFCUSBGZQM-PZJWPPBQSA-N 2 0 336.479 3.975 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)cc1C(C)C ZINC000746644663 1133960327 /nfs/dbraw/zinc/96/03/27/1133960327.db2.gz BPFMFEYGMXKPMJ-YFVAEKQCSA-N 2 0 346.515 3.508 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1 ZINC000809756800 1135888184 /nfs/dbraw/zinc/88/81/84/1135888184.db2.gz TYCJMGVQQJFBHU-FQEVSTJZSA-N 2 0 329.532 3.697 20 10 EHCDRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000810252851 1135948832 /nfs/dbraw/zinc/94/88/32/1135948832.db2.gz VOXKQKQWOXSWGK-OAHLLOKOSA-N 2 0 342.936 3.914 20 10 EHCDRP COc1cc(C[NH2+]C2CCC(C[NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850221502 1136222846 /nfs/dbraw/zinc/22/28/46/1136222846.db2.gz KDYONYFTXLXOFJ-UHFFFAOYSA-N 2 0 348.531 3.908 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000817957983 1136851915 /nfs/dbraw/zinc/85/19/15/1136851915.db2.gz RTRHUFPJEVXNMH-AKIFATBCSA-N 2 0 349.522 3.702 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@@H+]1C ZINC000823955394 1137119112 /nfs/dbraw/zinc/11/91/12/1137119112.db2.gz KPYBWLVWBULAAF-AEFFLSMTSA-N 2 0 343.540 3.957 20 10 EHCDRP C[C@H]1C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2c1c(F)ccc2O ZINC000873235318 1137594718 /nfs/dbraw/zinc/59/47/18/1137594718.db2.gz KXENSIFTTLEGRD-SJCJKPOMSA-N 2 0 326.415 3.515 20 10 EHCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185671077 1140162400 /nfs/dbraw/zinc/16/24/00/1140162400.db2.gz WJNBCQTXNNTETG-RDJZCZTQSA-N 2 0 330.472 3.553 20 10 EHCDRP CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(Br)ccc1O ZINC000049553242 1014354590 /nfs/dbraw/zinc/35/45/90/1014354590.db2.gz ZRDCLAWAGDAZPY-SMDDNHRTSA-N 2 0 329.282 3.536 20 10 EHCDRP Cc1ccc2c(cc[nH+]c2NCc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001167422949 1019732607 /nfs/dbraw/zinc/73/26/07/1019732607.db2.gz IBFSBRQXAHCYIQ-UHFFFAOYSA-N 2 0 346.478 3.907 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(N(C)C)cc1 ZINC000162499193 1028884469 /nfs/dbraw/zinc/88/44/69/1028884469.db2.gz GPRKJYDVNOHHRJ-QGZVFWFLSA-N 2 0 341.499 3.544 20 10 EHCDRP CC[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1cc(Br)ccc1O ZINC000226864678 1033516370 /nfs/dbraw/zinc/51/63/70/1033516370.db2.gz UJRDYRXUEYQUHQ-WHOFXGATSA-N 2 0 341.293 3.678 20 10 EHCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CCCCC3)c(C)c2)C1 ZINC000827991789 1034391233 /nfs/dbraw/zinc/39/12/33/1034391233.db2.gz WOQXSTGWXCBLPB-HXUWFJFHSA-N 2 0 329.532 3.759 20 10 EHCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000765406054 1127608279 /nfs/dbraw/zinc/60/82/79/1127608279.db2.gz LZIOFXFGGUXCDC-CEXWTWQISA-N 2 0 347.547 3.683 20 10 EHCDRP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c(C)n1-c1cccc(C)c1 ZINC000742375604 1131717386 /nfs/dbraw/zinc/71/73/86/1131717386.db2.gz SKQGXRDCGBLZKN-OXQOHEQNSA-N 2 0 325.500 3.975 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](c3cccs3)C3CC3)cc2)CC1 ZINC000771823375 1133601868 /nfs/dbraw/zinc/60/18/68/1133601868.db2.gz MRWLMCVPYPUUJH-FQEVSTJZSA-N 2 0 341.524 3.741 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000771866959 1133603474 /nfs/dbraw/zinc/60/34/74/1133603474.db2.gz GFXYIXBZMAMSNO-VXKWHMMOSA-N 2 0 349.522 3.864 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC=C(C)CC3)cc2F)CC1 ZINC000788593206 1134148808 /nfs/dbraw/zinc/14/88/08/1134148808.db2.gz GOFRBNIVEAYYBP-SFHVURJKSA-N 2 0 331.479 3.556 20 10 EHCDRP Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000793206985 1134882702 /nfs/dbraw/zinc/88/27/02/1134882702.db2.gz MLYZKVZPRDXUOI-KRWDZBQOSA-N 2 0 344.886 3.966 20 10 EHCDRP CC(C)[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775633804 1135364069 /nfs/dbraw/zinc/36/40/69/1135364069.db2.gz KTKCPEJVCYWTLV-UHFFFAOYSA-N 2 0 337.511 3.849 20 10 EHCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850098981 1136210945 /nfs/dbraw/zinc/21/09/45/1136210945.db2.gz PXEPIULDIYGVIT-HNNXBMFYSA-N 2 0 334.504 3.520 20 10 EHCDRP Cc1cc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000853623164 1136550408 /nfs/dbraw/zinc/55/04/08/1136550408.db2.gz FRQWSLUBPDFICZ-GOSISDBHSA-N 2 0 348.531 3.541 20 10 EHCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816486267 1136723380 /nfs/dbraw/zinc/72/33/80/1136723380.db2.gz WCIDATDLBDFSGI-UHFFFAOYSA-N 2 0 328.859 3.739 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000817934093 1136846916 /nfs/dbraw/zinc/84/69/16/1136846916.db2.gz BXKNXPDTAQPEGY-HZPDHXFCSA-N 2 0 340.515 3.505 20 10 EHCDRP CC[C@@H]([NH2+]CCC[NH2+]C(C)C)c1cc(Br)ccc1O ZINC000817953614 1136851190 /nfs/dbraw/zinc/85/11/90/1136851190.db2.gz PMHMTVVNIWBFGM-CQSZACIVSA-N 2 0 329.282 3.584 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(O)c1 ZINC000185337029 1140146007 /nfs/dbraw/zinc/14/60/07/1140146007.db2.gz HESLUNGWYFRDTI-QGZVFWFLSA-N 2 0 342.483 3.882 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000185336886 1140146016 /nfs/dbraw/zinc/14/60/16/1140146016.db2.gz QKXCLFADIQJNAO-KRWDZBQOSA-N 2 0 342.483 3.882 20 10 EHCDRP COc1ccc(N2CCC([NH2+]CC[C@H](C)[NH+]3CCCCC3)CC2)cc1 ZINC000376798856 1017127055 /nfs/dbraw/zinc/12/70/55/1017127055.db2.gz KUNDPPIMIWSMIF-SFHVURJKSA-N 2 0 345.531 3.518 20 10 EHCDRP COc1ccc(N2CCC([NH2+]CCC[NH+](C(C)C)C(C)C)CC2)cc1 ZINC000155828023 1038996335 /nfs/dbraw/zinc/99/63/35/1038996335.db2.gz CYJHXDWHFUEARL-UHFFFAOYSA-N 2 0 347.547 3.763 20 10 EHCDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC000180792669 1124072701 /nfs/dbraw/zinc/07/27/01/1124072701.db2.gz GJWRIKVRQBXEDE-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107840 1131462706 /nfs/dbraw/zinc/46/27/06/1131462706.db2.gz ORQLGIBNZSJDNK-ROUUACIJSA-N 2 0 342.527 3.967 20 10 EHCDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000766374480 1132526044 /nfs/dbraw/zinc/52/60/44/1132526044.db2.gz PCPMNHAWZLYMHM-UHFFFAOYSA-N 2 0 348.531 3.579 20 10 EHCDRP CCN(C)c1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000773840936 1133342659 /nfs/dbraw/zinc/34/26/59/1133342659.db2.gz VDLJKPITZRAPIZ-HKUYNNGSSA-N 2 0 329.532 3.885 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2c(O)cccc2OC)CC1)CC(C)C ZINC000809755972 1135887274 /nfs/dbraw/zinc/88/72/74/1135887274.db2.gz MUYKTPOPFWZEBA-UHFFFAOYSA-N 2 0 348.531 3.981 20 10 EHCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000809756893 1135888173 /nfs/dbraw/zinc/88/81/73/1135888173.db2.gz UXYUNMAJIHOAPP-NRFANRHFSA-N 2 0 341.543 3.841 20 10 EHCDRP COc1cc(C[NH2+]CCC2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850120028 1136212263 /nfs/dbraw/zinc/21/22/63/1136212263.db2.gz UGGWBBUURKUERC-UHFFFAOYSA-N 2 0 334.504 3.520 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)ccc1N(C)C ZINC000815074188 1136547080 /nfs/dbraw/zinc/54/70/80/1136547080.db2.gz LDUONBXRLRHGPX-NQIIRXRSSA-N 2 0 327.516 3.510 20 10 EHCDRP CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817966456 1136853378 /nfs/dbraw/zinc/85/33/78/1136853378.db2.gz OGKFQMAFQVVSPA-HOCLYGCPSA-N 2 0 341.293 3.585 20 10 EHCDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823667113 1137108850 /nfs/dbraw/zinc/10/88/50/1137108850.db2.gz ZJQKUKPTACRNRZ-SFHVURJKSA-N 2 0 343.540 3.816 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1O ZINC000846149765 1137336172 /nfs/dbraw/zinc/33/61/72/1137336172.db2.gz LQHVZGSHGHSZLA-MRXNPFEDSA-N 2 0 334.504 3.810 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846167579 1137337279 /nfs/dbraw/zinc/33/72/79/1137337279.db2.gz KXYXHUFTZHJKAM-WMZOPIPTSA-N 2 0 340.467 3.574 20 10 EHCDRP C[C@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc2ccccc2c1O ZINC000873246557 1137595209 /nfs/dbraw/zinc/59/52/09/1137595209.db2.gz WTDNLNLLFGQOGD-HNNXBMFYSA-N 2 0 348.450 3.523 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000873272884 1137596012 /nfs/dbraw/zinc/59/60/12/1137596012.db2.gz WYTGIXHTEKLPIA-NHYWBVRUSA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385189 1139087903 /nfs/dbraw/zinc/08/79/03/1139087903.db2.gz YEIFFRBBNYANTO-IAGOWNOFSA-N 2 0 345.506 3.951 20 10 EHCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)CC1 ZINC000157487945 1037622136 /nfs/dbraw/zinc/62/21/36/1037622136.db2.gz RCTMZBXBSDRXRH-UHFFFAOYSA-N 2 0 329.532 3.887 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000185337318 1126868926 /nfs/dbraw/zinc/86/89/26/1126868926.db2.gz QIZNJOYUBUFALP-QUCCMNQESA-N 2 0 338.495 3.916 20 10 EHCDRP C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C[NH+]1CCCCC1 ZINC000324485210 1121925646 /nfs/dbraw/zinc/92/56/46/1121925646.db2.gz NECCXBWAZBLALG-LJQANCHMSA-N 2 0 329.532 3.889 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC001203255090 1132064797 /nfs/dbraw/zinc/06/47/97/1132064797.db2.gz RYNPEHSGFASQBB-UHFFFAOYSA-N 2 0 329.532 3.744 20 10 EHCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169124019 1132665742 /nfs/dbraw/zinc/66/57/42/1132665742.db2.gz PJOJUOCAVOWUQZ-MFCZKXCZSA-N 2 0 328.500 3.847 20 10 EHCDRP COc1cc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c(O)cc1C ZINC000768439289 1133139451 /nfs/dbraw/zinc/13/94/51/1133139451.db2.gz KFLAQHOOXNWQCO-UHFFFAOYSA-N 2 0 346.515 3.797 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000771818317 1133600739 /nfs/dbraw/zinc/60/07/39/1133600739.db2.gz JQWHEYPGBWXCKL-NRFANRHFSA-N 2 0 341.474 3.818 20 10 EHCDRP COc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001199583212 1135915079 /nfs/dbraw/zinc/91/50/79/1135915079.db2.gz VWFZDLJGICOXNJ-INIZCTEOSA-N 2 0 348.531 3.910 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c(O)c1C ZINC000850481750 1136267422 /nfs/dbraw/zinc/26/74/22/1136267422.db2.gz BBOKVKZAKBZJRK-KRWDZBQOSA-N 2 0 346.515 3.551 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815561150 1136610815 /nfs/dbraw/zinc/61/08/15/1136610815.db2.gz ZRNFZCLUXPUONW-RWMBFGLXSA-N 2 0 328.378 3.688 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000817934092 1136847045 /nfs/dbraw/zinc/84/70/45/1136847045.db2.gz BXKNXPDTAQPEGY-HOTGVXAUSA-N 2 0 340.515 3.505 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1O ZINC000817966949 1136853323 /nfs/dbraw/zinc/85/33/23/1136853323.db2.gz ZZKMTNVKNOEOEV-WBMJQRKESA-N 2 0 341.293 3.503 20 10 EHCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976968 1136854393 /nfs/dbraw/zinc/85/43/93/1136854393.db2.gz XXYHXLABTIZTHU-FPOVZHCZSA-N 2 0 336.479 3.798 20 10 EHCDRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817986528 1136855314 /nfs/dbraw/zinc/85/53/14/1136855314.db2.gz RFDYOJJMGPVBOM-HNNXBMFYSA-N 2 0 328.378 3.762 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817987141 1136855541 /nfs/dbraw/zinc/85/55/41/1136855541.db2.gz WRVAEYMTTSLUNH-WZGPROSRSA-N 2 0 345.506 3.855 20 10 EHCDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823667112 1137108997 /nfs/dbraw/zinc/10/89/97/1137108997.db2.gz ZJQKUKPTACRNRZ-GOSISDBHSA-N 2 0 343.540 3.816 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc2c(cc1O)CCCC2 ZINC000844924185 1137263222 /nfs/dbraw/zinc/26/32/22/1137263222.db2.gz NJRYPDCTGQRYFU-ZDUSSCGKSA-N 2 0 328.431 3.720 20 10 EHCDRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CC2 ZINC000846055785 1137331123 /nfs/dbraw/zinc/33/11/23/1137331123.db2.gz NTPRZBSURPLNEO-JOCHJYFZSA-N 2 0 335.495 3.524 20 10 EHCDRP C[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1[O-] ZINC000170788800 1017093328 /nfs/dbraw/zinc/09/33/28/1017093328.db2.gz PQLDXJOIHHHRBG-HNNXBMFYSA-N 2 0 328.431 3.847 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](CC)c2ccccc2O)[C@@H](C)C1 ZINC000155857495 1020074800 /nfs/dbraw/zinc/07/48/00/1020074800.db2.gz JHERGUYJBIHTRT-YTQUADARSA-N 2 0 334.504 3.570 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311025312 1033221021 /nfs/dbraw/zinc/22/10/21/1033221021.db2.gz CAEJPLFBBKXWBC-WIYYLYMNSA-N 2 0 337.511 3.753 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000840892944 1027590259 /nfs/dbraw/zinc/59/02/59/1027590259.db2.gz FILOUNJVBWTJKE-KRWDZBQOSA-N 2 0 331.548 3.845 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138037 1032049846 /nfs/dbraw/zinc/04/98/46/1032049846.db2.gz CQTXVRVRKOJPAW-WBVHZDCISA-N 2 0 328.431 3.704 20 10 EHCDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764665059 1127520438 /nfs/dbraw/zinc/52/04/38/1127520438.db2.gz ATZSBNKETIBYCL-QGZVFWFLSA-N 2 0 333.495 3.953 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CCCC2 ZINC000768465484 1133144641 /nfs/dbraw/zinc/14/46/41/1133144641.db2.gz HSYLHHVFXHOHSO-QGZVFWFLSA-N 2 0 328.500 3.579 20 10 EHCDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1 ZINC001179015480 1133221372 /nfs/dbraw/zinc/22/13/72/1133221372.db2.gz BQMCOGBBJVWHRE-ZCBMTBAISA-N 2 0 349.522 3.701 20 10 EHCDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1 ZINC001179015479 1133221566 /nfs/dbraw/zinc/22/15/66/1133221566.db2.gz BQMCOGBBJVWHRE-OENHHBGDSA-N 2 0 349.522 3.701 20 10 EHCDRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc(N(C)C)cc3)C2)CC1 ZINC000769147965 1133234777 /nfs/dbraw/zinc/23/47/77/1133234777.db2.gz KBGAKACISIZIEN-FQEVSTJZSA-N 2 0 329.532 3.697 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000769149256 1133234915 /nfs/dbraw/zinc/23/49/15/1133234915.db2.gz ZMHCOJRQERLQSD-ROUUACIJSA-N 2 0 346.515 3.877 20 10 EHCDRP Cc1nccn1CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788821712 1134177284 /nfs/dbraw/zinc/17/72/84/1134177284.db2.gz YPZSAODNMCGWOG-NSHDSACASA-N 2 0 327.350 3.657 20 10 EHCDRP C[N@H+](CCCc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775652375 1135417283 /nfs/dbraw/zinc/41/72/83/1135417283.db2.gz YNBNLKSPCKLWRD-UHFFFAOYSA-N 2 0 337.511 3.503 20 10 EHCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809767458 1135879671 /nfs/dbraw/zinc/87/96/71/1135879671.db2.gz LNYZZSDUHYVQHM-CTNGQTDRSA-N 2 0 336.479 3.975 20 10 EHCDRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215470 1135938388 /nfs/dbraw/zinc/93/83/88/1135938388.db2.gz FWGBRLVVVIRBQT-OAHLLOKOSA-N 2 0 330.394 3.794 20 10 EHCDRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810229812 1135941708 /nfs/dbraw/zinc/94/17/08/1135941708.db2.gz KYPFNPWLKDSRCC-OAHLLOKOSA-N 2 0 328.378 3.714 20 10 EHCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815561070 1136610933 /nfs/dbraw/zinc/61/09/33/1136610933.db2.gz XODFKVDHHCRYRE-CTNGQTDRSA-N 2 0 338.495 3.998 20 10 EHCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000817899279 1136844664 /nfs/dbraw/zinc/84/46/64/1136844664.db2.gz NKOWKRIJFGIIEQ-PCCBWWKXSA-N 2 0 327.516 3.687 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC[NH2+]C(C)C)c1O ZINC000817951888 1136850836 /nfs/dbraw/zinc/85/08/36/1136850836.db2.gz BJVAEPZNBBJZBF-GFCCVEGCSA-N 2 0 329.282 3.502 20 10 EHCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976967 1136854107 /nfs/dbraw/zinc/85/41/07/1136854107.db2.gz XXYHXLABTIZTHU-CTNGQTDRSA-N 2 0 336.479 3.798 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC000817978792 1136854389 /nfs/dbraw/zinc/85/43/89/1136854389.db2.gz DRSCMVOUTNLWET-RIFZZMRRSA-N 2 0 342.458 3.884 20 10 EHCDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817980006 1136854747 /nfs/dbraw/zinc/85/47/47/1136854747.db2.gz GYWCDBPRAGLZSR-SJLPKXTDSA-N 2 0 333.495 3.999 20 10 EHCDRP CCC(F)(F)C(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000858270445 1136954447 /nfs/dbraw/zinc/95/44/47/1136954447.db2.gz BENFYODVEGFCFJ-UHFFFAOYSA-N 2 0 339.474 3.600 20 10 EHCDRP Cc1c2ccccc2n(C)c1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459509250 1032234073 /nfs/dbraw/zinc/23/40/73/1032234073.db2.gz ULUBANNCEDRSPO-UHFFFAOYSA-N 2 0 334.467 3.640 20 10 EHCDRP Cc1ccc(O)c(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC000895391996 1024459718 /nfs/dbraw/zinc/45/97/18/1024459718.db2.gz IXCFXAVYWFIJFB-TYPHKJRUSA-N 2 0 336.479 3.843 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138024 1032051446 /nfs/dbraw/zinc/05/14/46/1032051446.db2.gz CQTXVRVRKOJPAW-RDJZCZTQSA-N 2 0 328.431 3.704 20 10 EHCDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccc(OC)cc32)C1 ZINC000173432533 1033331783 /nfs/dbraw/zinc/33/17/83/1033331783.db2.gz IMJPRSUENDMDBE-INIZCTEOSA-N 2 0 342.483 3.718 20 10 EHCDRP Cc1oc2ccccc2c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000767194398 1132963972 /nfs/dbraw/zinc/96/39/72/1132963972.db2.gz LZEMBSNQLCCMMH-UHFFFAOYSA-N 2 0 349.478 3.783 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCCCCCC3)cc2)CC1 ZINC001177363012 1133060541 /nfs/dbraw/zinc/06/05/41/1133060541.db2.gz HGHMJBMYNIVLHO-UHFFFAOYSA-N 2 0 329.532 3.889 20 10 EHCDRP c1cc2c(cc1C[NH2+]C1CC[NH+](CC3CCCC3)CC1)CCCO2 ZINC001178412433 1133167550 /nfs/dbraw/zinc/16/75/50/1133167550.db2.gz RUZCLISIRUJSJI-UHFFFAOYSA-N 2 0 328.500 3.756 20 10 EHCDRP CCOc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c(O)c1 ZINC000769148608 1133233834 /nfs/dbraw/zinc/23/38/34/1133233834.db2.gz OVACNUMFXCVMIQ-GOSISDBHSA-N 2 0 346.515 3.735 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2O ZINC000850581080 1136292220 /nfs/dbraw/zinc/29/22/20/1136292220.db2.gz CXRUYMRDEOKKDH-CXAGYDPISA-N 2 0 332.463 3.791 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](c3ccccc3)C3CC3)cc2)CC1 ZINC000814298439 1136437738 /nfs/dbraw/zinc/43/77/38/1136437738.db2.gz SZKALGGBFBOXHA-HSZRJFAPSA-N 2 0 349.522 3.722 20 10 EHCDRP COc1ccc(N2CCC([NH2+][C@H](C)C[C@@H]3CCCCC[NH2+]3)CC2)cc1 ZINC000817903905 1136844684 /nfs/dbraw/zinc/84/46/84/1136844684.db2.gz WUGFOEDIKHENRZ-MJGOQNOKSA-N 2 0 345.531 3.564 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Br)ccc1O ZINC000817976815 1136854119 /nfs/dbraw/zinc/85/41/19/1136854119.db2.gz UYMUZNPYXPPWTH-RISCZKNCSA-N 2 0 329.282 3.713 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])c1O ZINC000817975735 1136854542 /nfs/dbraw/zinc/85/45/42/1136854542.db2.gz AIAYUTPJCNRCGX-NWDGAFQWSA-N 2 0 329.282 3.631 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc(F)ccc1O ZINC000185337089 1140145615 /nfs/dbraw/zinc/14/56/15/1140145615.db2.gz TWBOGDKVGILEQX-OAHLLOKOSA-N 2 0 346.446 3.713 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000195133555 1032047337 /nfs/dbraw/zinc/04/73/37/1032047337.db2.gz ZFRAFUZPLGEOIB-SJLPKXTDSA-N 2 0 340.467 3.574 20 10 EHCDRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000398187093 1041172918 /nfs/dbraw/zinc/17/29/18/1041172918.db2.gz YLENYRUZRRKAKD-AHRSYUTCSA-N 2 0 336.479 3.880 20 10 EHCDRP Cc1cc(O)c(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1C ZINC000743401540 1131913280 /nfs/dbraw/zinc/91/32/80/1131913280.db2.gz BUSNNVNTLLLPQU-HXUWFJFHSA-N 2 0 338.495 3.963 20 10 EHCDRP COc1cc(C[NH2+]CCC[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001177133556 1133033758 /nfs/dbraw/zinc/03/37/58/1133033758.db2.gz ZAOULOLPAUTQOF-UHFFFAOYSA-N 2 0 334.504 3.664 20 10 EHCDRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]Cc2ccc4c(c2)CCO4)C3)cc1 ZINC000774163576 1133626158 /nfs/dbraw/zinc/62/61/58/1133626158.db2.gz RZLHKKJBVPVLOL-KOUNCHBCSA-N 2 0 348.490 3.907 20 10 EHCDRP CN(C)c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000792969633 1134833600 /nfs/dbraw/zinc/83/36/00/1134833600.db2.gz MZYPRLOTMJFHME-UHFFFAOYSA-N 2 0 343.437 3.593 20 10 EHCDRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775701886 1135539158 /nfs/dbraw/zinc/53/91/58/1135539158.db2.gz OHUVFLGSJSFSFS-SLYNCCJLSA-N 2 0 327.516 3.591 20 10 EHCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1O ZINC000775740352 1135598642 /nfs/dbraw/zinc/59/86/42/1135598642.db2.gz VGXGBWKSPJOHQP-KSSFIOAISA-N 2 0 334.891 3.803 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1F ZINC000809767401 1135879635 /nfs/dbraw/zinc/87/96/35/1135879635.db2.gz JYVJMLLHKBIOFR-HKUYNNGSSA-N 2 0 333.495 3.588 20 10 EHCDRP Oc1c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc2ccccc21 ZINC000816560701 1136736732 /nfs/dbraw/zinc/73/67/32/1136736732.db2.gz XPRLRWZMJKWFFX-UHFFFAOYSA-N 2 0 347.462 3.947 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000817957982 1136852190 /nfs/dbraw/zinc/85/21/90/1136852190.db2.gz RTRHUFPJEVXNMH-ACIOBRDBSA-N 2 0 349.522 3.702 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817966457 1136853338 /nfs/dbraw/zinc/85/33/38/1136853338.db2.gz OGKFQMAFQVVSPA-ZBFHGGJFSA-N 2 0 341.293 3.585 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817987140 1136855428 /nfs/dbraw/zinc/85/54/28/1136855428.db2.gz WRVAEYMTTSLUNH-JCHJZTRSSA-N 2 0 345.506 3.855 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000846139974 1137338493 /nfs/dbraw/zinc/33/84/93/1137338493.db2.gz CXMXAIMKRBZJQD-BBWFWOEESA-N 2 0 334.504 3.810 20 10 EHCDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846146058 1137339092 /nfs/dbraw/zinc/33/90/92/1137339092.db2.gz PQPZMLNKNFRFDL-HNNXBMFYSA-N 2 0 328.456 3.703 20 10 EHCDRP C[C@@H]([NH2+]Cc1c([O-])cccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000896639547 1025792530 /nfs/dbraw/zinc/79/25/30/1025792530.db2.gz VXELNWKVHBKSGK-WBVHZDCISA-N 2 0 328.431 3.532 20 10 EHCDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc(OC)ccc2O)CC1 ZINC000180790026 1038260346 /nfs/dbraw/zinc/26/03/46/1038260346.db2.gz ZJWKWBZZQNZZTA-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107837 1131462837 /nfs/dbraw/zinc/46/28/37/1131462837.db2.gz ORQLGIBNZSJDNK-MSOLQXFVSA-N 2 0 342.527 3.967 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000769149257 1133234544 /nfs/dbraw/zinc/23/45/44/1133234544.db2.gz ZMHCOJRQERLQSD-ZWKOTPCHSA-N 2 0 346.515 3.877 20 10 EHCDRP CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002793 1134837328 /nfs/dbraw/zinc/83/73/28/1134837328.db2.gz BWOBXWKYKPAFCE-LSDHHAIUSA-N 2 0 343.437 3.734 20 10 EHCDRP CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c(C(F)(F)F)c1 ZINC000793002779 1134837434 /nfs/dbraw/zinc/83/74/34/1134837434.db2.gz BWOBXWKYKPAFCE-CABCVRRESA-N 2 0 343.437 3.734 20 10 EHCDRP Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001649139107 1135740271 /nfs/dbraw/zinc/74/02/71/1135740271.db2.gz RCWIEDAEVTUQKN-IBGZPJMESA-N 2 0 337.511 3.906 20 10 EHCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239247 1136520668 /nfs/dbraw/zinc/52/06/68/1136520668.db2.gz CVASQHFETAXGTJ-MJGOQNOKSA-N 2 0 329.532 3.915 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1F ZINC000817903700 1136844888 /nfs/dbraw/zinc/84/48/88/1136844888.db2.gz SQBHUFXLWQOHLL-AWEZNQCLSA-N 2 0 344.478 3.685 20 10 EHCDRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)c1cc(Br)ccc1O ZINC000817953613 1136850864 /nfs/dbraw/zinc/85/08/64/1136850864.db2.gz PMHMTVVNIWBFGM-AWEZNQCLSA-N 2 0 329.282 3.584 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000817956937 1136851559 /nfs/dbraw/zinc/85/15/59/1136851559.db2.gz GGKMPKZGYNUHBV-DKUWSORSSA-N 2 0 335.495 3.597 20 10 EHCDRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817966455 1136853290 /nfs/dbraw/zinc/85/32/90/1136853290.db2.gz OGKFQMAFQVVSPA-GOEBONIOSA-N 2 0 341.293 3.585 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1O ZINC000817975386 1136854425 /nfs/dbraw/zinc/85/44/25/1136854425.db2.gz MNSJWTPKRCWXOY-AVGNSLFASA-N 2 0 341.293 3.570 20 10 EHCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@@H+]1C ZINC000823955397 1137119221 /nfs/dbraw/zinc/11/92/21/1137119221.db2.gz KPYBWLVWBULAAF-WMZOPIPTSA-N 2 0 343.540 3.957 20 10 EHCDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@@H+]1C ZINC000823955395 1137119235 /nfs/dbraw/zinc/11/92/35/1137119235.db2.gz KPYBWLVWBULAAF-FUHWJXTLSA-N 2 0 343.540 3.957 20 10 EHCDRP CCC1([NH+]2CCCC2)CCN(Cc2cc(C)cc(OC)c2O)CC1 ZINC000872646579 1137582375 /nfs/dbraw/zinc/58/23/75/1137582375.db2.gz BYNVEOXDGJANQD-UHFFFAOYSA-N 2 0 332.488 3.550 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1O ZINC000873246112 1137595230 /nfs/dbraw/zinc/59/52/30/1137595230.db2.gz WYTIIOGWHJPLER-WCQYABFASA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H]([NH2+]C/C=C\C[NH2+][C@H](C)c1ccccc1O)c1ccccc1O ZINC000879649431 1137753636 /nfs/dbraw/zinc/75/36/36/1137753636.db2.gz SPINCFCSGOXIAP-ZJBFNYKTSA-N 2 0 326.440 3.655 20 10 EHCDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000185356195 1140146537 /nfs/dbraw/zinc/14/65/37/1140146537.db2.gz SDKOESBPAPHRCF-GFCCVEGCSA-N 2 0 341.293 3.537 20 10 EHCDRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(C)cc1O ZINC000280265789 1020234497 /nfs/dbraw/zinc/23/44/97/1020234497.db2.gz XNXRHJHSBMZYFS-ZCNNSNEGSA-N 2 0 346.515 3.509 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138061 1032051614 /nfs/dbraw/zinc/05/16/14/1032051614.db2.gz CQTXVRVRKOJPAW-NVXWUHKLSA-N 2 0 328.431 3.704 20 10 EHCDRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185075142 1126750945 /nfs/dbraw/zinc/75/09/45/1126750945.db2.gz CVDGNWLEPSKPRW-OAHLLOKOSA-N 2 0 328.500 3.796 20 10 EHCDRP CSC1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC[NH+](C)CC1 ZINC000810251972 1132731909 /nfs/dbraw/zinc/73/19/09/1132731909.db2.gz DMBITCXXPZBCEZ-CYBMUJFWSA-N 2 0 342.936 3.832 20 10 EHCDRP Cc1ccccc1C1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771841715 1133598948 /nfs/dbraw/zinc/59/89/48/1133598948.db2.gz KAOPBKQTEFXOED-UHFFFAOYSA-N 2 0 349.522 3.783 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1F ZINC000789559400 1134300552 /nfs/dbraw/zinc/30/05/52/1134300552.db2.gz PXWCSBUAWUGNMP-UHFFFAOYSA-N 2 0 333.495 3.732 20 10 EHCDRP C[C@@H](c1ccco1)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775662194 1135437517 /nfs/dbraw/zinc/43/75/17/1135437517.db2.gz RXTFFVBDDKLKFI-KRWDZBQOSA-N 2 0 339.483 3.757 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@H]4C3)cc2)CC1 ZINC001199052875 1135876197 /nfs/dbraw/zinc/87/61/97/1135876197.db2.gz OVSALSMDTZIKQJ-PCCBWWKXSA-N 2 0 341.543 3.887 20 10 EHCDRP CC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(C)cc1O ZINC000850483956 1136267298 /nfs/dbraw/zinc/26/72/98/1136267298.db2.gz ZDWICUXRXIWDCY-HXUWFJFHSA-N 2 0 346.515 3.632 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1N(C)C ZINC000815074187 1136547236 /nfs/dbraw/zinc/54/72/36/1136547236.db2.gz LDUONBXRLRHGPX-GHTZIAJQSA-N 2 0 327.516 3.510 20 10 EHCDRP [O-]c1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000816594483 1136735562 /nfs/dbraw/zinc/73/55/62/1136735562.db2.gz FKEJHCBUDJBDJW-OAHLLOKOSA-N 2 0 348.849 3.796 20 10 EHCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817887626 1136841543 /nfs/dbraw/zinc/84/15/43/1136841543.db2.gz AVMIKPKROQRPRF-IEBWSBKVSA-N 2 0 347.572 3.640 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1O ZINC000817946799 1136849951 /nfs/dbraw/zinc/84/99/51/1136849951.db2.gz DYKYQTZJSJOXRN-RWMBFGLXSA-N 2 0 341.293 3.502 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1O ZINC000846144587 1137339076 /nfs/dbraw/zinc/33/90/76/1137339076.db2.gz IAXZTHGPZILSFL-IAGOWNOFSA-N 2 0 342.483 3.962 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)c(F)c1 ZINC000883289561 1137852799 /nfs/dbraw/zinc/85/27/99/1137852799.db2.gz SJWQVDDTGSITHW-OAHLLOKOSA-N 2 0 345.437 3.567 20 10 EHCDRP COc1ccc(O)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000181032944 1139880094 /nfs/dbraw/zinc/88/00/94/1139880094.db2.gz SAQJRYXKUAKOOS-UHFFFAOYSA-N 2 0 328.456 3.531 20 10 EHCDRP Cc1cc2cc(NCc3ccc(N4CC[NH+](C)CC4)cc3)ccc2c[nH+]1 ZINC001167436824 1020140332 /nfs/dbraw/zinc/14/03/32/1020140332.db2.gz BALSUTARWCLCPB-UHFFFAOYSA-N 2 0 346.478 3.907 20 10 EHCDRP Cc1ccc2c(NCc3ccc(N4CC[NH+](C)CC4)cc3)cc[nH+]c2c1 ZINC001167437177 1020158825 /nfs/dbraw/zinc/15/88/25/1020158825.db2.gz NYZMYWWVBHLGEK-UHFFFAOYSA-N 2 0 346.478 3.907 20 10 EHCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165928022 1036808322 /nfs/dbraw/zinc/80/83/22/1036808322.db2.gz YDJSCJHJMZSEQH-NQIIRXRSSA-N 2 0 347.547 3.684 20 10 EHCDRP CCOc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000236950113 1039282084 /nfs/dbraw/zinc/28/20/84/1039282084.db2.gz LVJRXQZQWHCICD-UHFFFAOYSA-N 2 0 342.483 3.921 20 10 EHCDRP Cc1cc(CC[NH2+][C@@H](C)C2CC[NH+](C)CC2)c(C)n1-c1ccccc1 ZINC000764716169 1127525291 /nfs/dbraw/zinc/52/52/91/1127525291.db2.gz JLBQHQJJLVALQU-SFHVURJKSA-N 2 0 339.527 3.957 20 10 EHCDRP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001648986296 1120324029 /nfs/dbraw/zinc/32/40/29/1120324029.db2.gz RDJMJOSWQRBZJA-MRXNPFEDSA-N 2 0 331.529 3.814 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H](C)C3)cc2F)CC1 ZINC000742369674 1131716296 /nfs/dbraw/zinc/71/62/96/1131716296.db2.gz CRWWISJJBCNWSR-WMZOPIPTSA-N 2 0 333.495 3.636 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C3=CCCC3)cc2)CC1 ZINC001178871835 1133205859 /nfs/dbraw/zinc/20/58/59/1133205859.db2.gz AZMQPQLGHXTCNC-UHFFFAOYSA-N 2 0 327.516 3.665 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(F)cc3Cl)cc2)CC1 ZINC001179453224 1133253585 /nfs/dbraw/zinc/25/35/85/1133253585.db2.gz FXLWTRUOCUDYRE-UHFFFAOYSA-N 2 0 347.865 3.521 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001181484969 1133496639 /nfs/dbraw/zinc/49/66/39/1133496639.db2.gz GTTLMRJPXKIXGJ-UHFFFAOYSA-N 2 0 325.500 3.755 20 10 EHCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1cccc(Cl)c1 ZINC000775643210 1135382051 /nfs/dbraw/zinc/38/20/51/1135382051.db2.gz OUEMXPYBJOLTBB-UHFFFAOYSA-N 2 0 343.902 3.724 20 10 EHCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775645586 1135389530 /nfs/dbraw/zinc/38/95/30/1135389530.db2.gz BNAOFKHHWPYCEF-GOSISDBHSA-N 2 0 335.495 3.558 20 10 EHCDRP C[C@H](c1ccco1)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775662197 1135437573 /nfs/dbraw/zinc/43/75/73/1135437573.db2.gz RXTFFVBDDKLKFI-QGZVFWFLSA-N 2 0 339.483 3.757 20 10 EHCDRP C[N@H+](Cc1cc2ccccc2o1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775724822 1135579029 /nfs/dbraw/zinc/57/90/29/1135579029.db2.gz NRRMUXDPKDCBOP-UHFFFAOYSA-N 2 0 349.478 3.817 20 10 EHCDRP CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775735559 1135592463 /nfs/dbraw/zinc/59/24/63/1135592463.db2.gz SDXDVFAUCBFESM-VQTJNVASSA-N 2 0 347.572 3.544 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3CCC(C)(C)CC3)cc2)CC1 ZINC001201865214 1136067051 /nfs/dbraw/zinc/06/70/51/1136067051.db2.gz SGLPFUKMNTUBBL-UHFFFAOYSA-N 2 0 329.532 3.744 20 10 EHCDRP COc1cc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000850097257 1136210377 /nfs/dbraw/zinc/21/03/77/1136210377.db2.gz VXQMDBZZSOHZPG-HNNXBMFYSA-N 2 0 334.504 3.518 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1O ZINC000817964866 1136851965 /nfs/dbraw/zinc/85/19/65/1136851965.db2.gz LQUPXHDXRNAAES-LBPRGKRZSA-N 2 0 341.293 3.503 20 10 EHCDRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(C(F)(F)F)cc1O ZINC000817976560 1136854212 /nfs/dbraw/zinc/85/42/12/1136854212.db2.gz NLTHIVNZVGRFKU-UKRRQHHQSA-N 2 0 328.378 3.594 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCC2)cc1 ZINC000817985845 1136855613 /nfs/dbraw/zinc/85/56/13/1136855613.db2.gz NITKKWNTNJODJO-OJAHFUOMSA-N 2 0 327.516 3.716 20 10 EHCDRP C[NH+](C)CCCCCCC[NH2+]Cc1c(O)cccc1Br ZINC000858109004 1136940693 /nfs/dbraw/zinc/94/06/93/1136940693.db2.gz OBNKVDFTBGHQNL-UHFFFAOYSA-N 2 0 343.309 3.756 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1O ZINC000846135411 1137338305 /nfs/dbraw/zinc/33/83/05/1137338305.db2.gz CYYSCMRNVHUYCJ-INIZCTEOSA-N 2 0 340.467 3.847 20 10 EHCDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000715584248 1137477369 /nfs/dbraw/zinc/47/73/69/1137477369.db2.gz PDNRJSRLMKCNHV-UHFFFAOYSA-N 2 0 341.293 3.507 20 10 EHCDRP Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883289201 1137852880 /nfs/dbraw/zinc/85/28/80/1137852880.db2.gz HMSCGIVHAARCDJ-INIZCTEOSA-N 2 0 329.513 3.659 20 10 EHCDRP CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1cc(Br)ccc1O ZINC000049553244 1014353544 /nfs/dbraw/zinc/35/35/44/1014353544.db2.gz ZRDCLAWAGDAZPY-BXUZGUMPSA-N 2 0 329.282 3.536 20 10 EHCDRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000155201548 1016293820 /nfs/dbraw/zinc/29/38/20/1016293820.db2.gz ZKKCXFTUPBJHLF-LJQANCHMSA-N 2 0 328.456 3.574 20 10 EHCDRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(C)cc1O ZINC000280265777 1020233805 /nfs/dbraw/zinc/23/38/05/1020233805.db2.gz XNXRHJHSBMZYFS-SLFFLAALSA-N 2 0 346.515 3.509 20 10 EHCDRP COc1cc(C)cc(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC000896387867 1025394980 /nfs/dbraw/zinc/39/49/80/1025394980.db2.gz JZGUCULJPLNBGX-UHFFFAOYSA-N 2 0 332.488 3.596 20 10 EHCDRP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1cc(Br)ccc1O ZINC000229546812 1034233111 /nfs/dbraw/zinc/23/31/11/1034233111.db2.gz QTSIDPCIHOCESK-OAHLLOKOSA-N 2 0 343.309 3.926 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CCCC2 ZINC000768448819 1133140701 /nfs/dbraw/zinc/14/07/01/1133140701.db2.gz XTYQASCOVSEHJZ-FQEVSTJZSA-N 2 0 328.500 3.721 20 10 EHCDRP COc1ccc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c(O)c1 ZINC000793390883 1134922057 /nfs/dbraw/zinc/92/20/57/1134922057.db2.gz TYJJNMXOBMCDDR-MAUKXSAKSA-N 2 0 332.488 3.534 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC001199052868 1135876447 /nfs/dbraw/zinc/87/64/47/1135876447.db2.gz OVSALSMDTZIKQJ-NJDAHSKKSA-N 2 0 341.543 3.887 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810216383 1135938857 /nfs/dbraw/zinc/93/88/57/1135938857.db2.gz IRBKMTQYKSUTFS-SWLSCSKDSA-N 2 0 330.394 3.794 20 10 EHCDRP C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001201686085 1136056701 /nfs/dbraw/zinc/05/67/01/1136056701.db2.gz ZJPKMBICMMZCNS-JPYJTQIMSA-N 2 0 349.522 3.852 20 10 EHCDRP Oc1ccc(Br)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815152065 1136557382 /nfs/dbraw/zinc/55/73/82/1136557382.db2.gz YKMKSIBEONQACO-UHFFFAOYSA-N 2 0 341.293 3.510 20 10 EHCDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817984783 1136855297 /nfs/dbraw/zinc/85/52/97/1136855297.db2.gz ZYFQZJNBPBZQSQ-MRXNPFEDSA-N 2 0 331.479 3.776 20 10 EHCDRP COc1cccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1O ZINC000846166120 1137337313 /nfs/dbraw/zinc/33/73/13/1137337313.db2.gz SUFCJTYHHYZMKM-PMPSAXMXSA-N 2 0 332.488 3.704 20 10 EHCDRP COc1cccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1O ZINC000846166119 1137337484 /nfs/dbraw/zinc/33/74/84/1137337484.db2.gz SUFCJTYHHYZMKM-OWCLPIDISA-N 2 0 332.488 3.704 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1O ZINC000846135412 1137338080 /nfs/dbraw/zinc/33/80/80/1137338080.db2.gz CYYSCMRNVHUYCJ-MRXNPFEDSA-N 2 0 340.467 3.847 20 10 EHCDRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000715492594 1137477204 /nfs/dbraw/zinc/47/72/04/1137477204.db2.gz VVDCKHBXWHQGCF-UHFFFAOYSA-N 2 0 341.293 3.507 20 10 EHCDRP CSc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)s1 ZINC000883283555 1137852424 /nfs/dbraw/zinc/85/24/24/1137852424.db2.gz JSANIQALJLTVPG-UHFFFAOYSA-N 2 0 347.553 3.512 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152384902 1139088293 /nfs/dbraw/zinc/08/82/93/1139088293.db2.gz YEIFFRBBNYANTO-IRXDYDNUSA-N 2 0 345.506 3.951 20 10 EHCDRP C[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1[O-] ZINC000170788803 1017093664 /nfs/dbraw/zinc/09/36/64/1017093664.db2.gz PQLDXJOIHHHRBG-OAHLLOKOSA-N 2 0 328.431 3.847 20 10 EHCDRP c1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1 ZINC000397623031 1017925338 /nfs/dbraw/zinc/92/53/38/1017925338.db2.gz WURNQPQLMKCKAT-UHFFFAOYSA-N 2 0 336.479 3.623 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874310 1027864170 /nfs/dbraw/zinc/86/41/70/1027864170.db2.gz RFPFCDWPSHWPCC-NBQZKYEYSA-N 2 0 328.431 3.875 20 10 EHCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000271847155 1029198635 /nfs/dbraw/zinc/19/86/35/1029198635.db2.gz IBWBAJZEARTNCF-GOSISDBHSA-N 2 0 327.516 3.980 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000248183254 1040715932 /nfs/dbraw/zinc/71/59/32/1040715932.db2.gz WWJSXRCRFGDMCE-WFXMLNOXSA-N 2 0 347.547 3.540 20 10 EHCDRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000044515713 1040963874 /nfs/dbraw/zinc/96/38/74/1040963874.db2.gz NKWDVDGYSWYUEW-OAHLLOKOSA-N 2 0 341.293 3.537 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(C(F)F)cc3)cc2)CC1 ZINC000764979515 1127559424 /nfs/dbraw/zinc/55/94/24/1127559424.db2.gz FMGDCLOOEVVSMD-UHFFFAOYSA-N 2 0 345.437 3.666 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000765406057 1127608228 /nfs/dbraw/zinc/60/82/28/1127608228.db2.gz LZIOFXFGGUXCDC-QRVBRYPASA-N 2 0 347.547 3.683 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)C[C@@H]3c3ccccc3)cc2)CC1 ZINC001183535785 1133825725 /nfs/dbraw/zinc/82/57/25/1133825725.db2.gz XXKJTUWWZBPZKS-DHIUTWEWSA-N 2 0 349.522 3.722 20 10 EHCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000747469340 1135638583 /nfs/dbraw/zinc/63/85/83/1135638583.db2.gz DSEZNJHPAGGPPT-IBGZPJMESA-N 2 0 348.531 3.757 20 10 EHCDRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CCC2 ZINC000808435998 1135666806 /nfs/dbraw/zinc/66/68/06/1135666806.db2.gz GYNZVDMVXRVYNC-QHCPKHFHSA-N 2 0 349.522 3.914 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1F ZINC000809767402 1135879312 /nfs/dbraw/zinc/87/93/12/1135879312.db2.gz JYVJMLLHKBIOFR-IEBWSBKVSA-N 2 0 333.495 3.588 20 10 EHCDRP CSC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC[NH+](C)CC1 ZINC000810252174 1135948692 /nfs/dbraw/zinc/94/86/92/1135948692.db2.gz KQGVBQJKRAVMFQ-OAHLLOKOSA-N 2 0 348.556 3.749 20 10 EHCDRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578240 1136613622 /nfs/dbraw/zinc/61/36/22/1136613622.db2.gz KGBMLPNSHCLWFO-CTNGQTDRSA-N 2 0 338.495 3.998 20 10 EHCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000817899284 1136844736 /nfs/dbraw/zinc/84/47/36/1136844736.db2.gz NKOWKRIJFGIIEQ-QHAWAJNXSA-N 2 0 327.516 3.687 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)cc1 ZINC000817957346 1136851701 /nfs/dbraw/zinc/85/17/01/1136851701.db2.gz LCKRVBOPWMMDMS-ZLNRFVROSA-N 2 0 349.522 3.844 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Br)ccc1O ZINC000817975387 1136854470 /nfs/dbraw/zinc/85/44/70/1136854470.db2.gz MNSJWTPKRCWXOY-JHJVBQTASA-N 2 0 341.293 3.570 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1O ZINC000846149764 1137336211 /nfs/dbraw/zinc/33/62/11/1137336211.db2.gz LQHVZGSHGHSZLA-INIZCTEOSA-N 2 0 334.504 3.810 20 10 EHCDRP CC1(C)C[C@H]([NH2+]Cc2ccc(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001171984677 1137527529 /nfs/dbraw/zinc/52/75/29/1137527529.db2.gz XLJLMLXXTNZKPN-GOSISDBHSA-N 2 0 340.467 3.631 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1O ZINC000873272188 1137596049 /nfs/dbraw/zinc/59/60/49/1137596049.db2.gz QGWLLLFLDYFCQY-NWDGAFQWSA-N 2 0 341.293 3.502 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1O ZINC000155201227 1016294343 /nfs/dbraw/zinc/29/43/43/1016294343.db2.gz BJAFMMCNUUCIOV-IBGZPJMESA-N 2 0 328.456 3.574 20 10 EHCDRP CCOc1cccc(C[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)c1O ZINC000074336678 1017996325 /nfs/dbraw/zinc/99/63/25/1017996325.db2.gz ZYJQGJHYTHTDTL-UHFFFAOYSA-N 2 0 342.483 3.923 20 10 EHCDRP COc1cc(C)cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1O ZINC000894383199 1021496903 /nfs/dbraw/zinc/49/69/03/1021496903.db2.gz CFQLISKLLXTINE-UHFFFAOYSA-N 2 0 340.467 3.595 20 10 EHCDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000163224425 1026911989 /nfs/dbraw/zinc/91/19/89/1026911989.db2.gz JKHZSAPHTQALSN-IRXDYDNUSA-N 2 0 333.495 3.808 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C3CCCCCC3)cc2F)CC1 ZINC000730108868 1130673469 /nfs/dbraw/zinc/67/34/69/1130673469.db2.gz UGYAIRNVFFNUPZ-UHFFFAOYSA-N 2 0 333.495 3.780 20 10 EHCDRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc(N(C)C)cc3)C2)CC1 ZINC000769147966 1133235205 /nfs/dbraw/zinc/23/52/05/1133235205.db2.gz KBGAKACISIZIEN-HXUWFJFHSA-N 2 0 329.532 3.697 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000769466918 1133296865 /nfs/dbraw/zinc/29/68/65/1133296865.db2.gz PDWMAOLFPRSHSR-HXUWFJFHSA-N 2 0 329.532 3.983 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2c(O)cccc2OC)CC1)CC1CC1 ZINC000770591540 1133448790 /nfs/dbraw/zinc/44/87/90/1133448790.db2.gz LKKQFTLWWXIANW-UHFFFAOYSA-N 2 0 346.515 3.735 20 10 EHCDRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810229811 1135941477 /nfs/dbraw/zinc/94/14/77/1135941477.db2.gz KYPFNPWLKDSRCC-HNNXBMFYSA-N 2 0 328.378 3.714 20 10 EHCDRP CSC1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC[NH+](C)CC1 ZINC000810251973 1135948892 /nfs/dbraw/zinc/94/88/92/1135948892.db2.gz DMBITCXXPZBCEZ-ZDUSSCGKSA-N 2 0 342.936 3.832 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc1N(C)C ZINC000815074189 1136547477 /nfs/dbraw/zinc/54/74/77/1136547477.db2.gz LDUONBXRLRHGPX-RXVVDRJESA-N 2 0 327.516 3.510 20 10 EHCDRP Oc1c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)ccc2ccccc21 ZINC000816521256 1136727083 /nfs/dbraw/zinc/72/70/83/1136727083.db2.gz KRMPHLQOUIKEAU-UWJYYQICSA-N 2 0 336.479 3.994 20 10 EHCDRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1O ZINC000817585236 1136825527 /nfs/dbraw/zinc/82/55/27/1136825527.db2.gz DETSRCCQIDVBOA-LMWSTFAQSA-N 2 0 341.293 3.678 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817946915 1136849857 /nfs/dbraw/zinc/84/98/57/1136849857.db2.gz HSZKVOKKXLHLPU-XUJVJEKNSA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1)[C@@H]1CCC[NH2+]C1 ZINC000817948336 1136850600 /nfs/dbraw/zinc/85/06/00/1136850600.db2.gz XZAYDBWPZQTPQV-LZLYRXPVSA-N 2 0 333.495 3.855 20 10 EHCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000817986840 1136855606 /nfs/dbraw/zinc/85/56/06/1136855606.db2.gz UOMHTFDQNWPBMC-NRFANRHFSA-N 2 0 336.479 3.966 20 10 EHCDRP COc1cc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000858245468 1136951884 /nfs/dbraw/zinc/95/18/84/1136951884.db2.gz JGIHNRUDMVHJDA-OAHLLOKOSA-N 2 0 334.504 3.520 20 10 EHCDRP CC1(C)C[C@@H]([NH2+]Cc2cccc(O)c2O)CC[N@@H+]1Cc1ccccc1 ZINC001171977215 1137525196 /nfs/dbraw/zinc/52/51/96/1137525196.db2.gz YYOLBHZZHUXNMT-SFHVURJKSA-N 2 0 340.467 3.631 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2c1c(F)ccc2O ZINC000873235317 1137594726 /nfs/dbraw/zinc/59/47/26/1137594726.db2.gz KXENSIFTTLEGRD-PXAZEXFGSA-N 2 0 326.415 3.515 20 10 EHCDRP Cc1ccc2cc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)[nH]c2c1 ZINC000883283093 1137852434 /nfs/dbraw/zinc/85/24/34/1137852434.db2.gz RASLNXBRDAMNPF-UHFFFAOYSA-N 2 0 348.494 3.518 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000120870013 1137953155 /nfs/dbraw/zinc/95/31/55/1137953155.db2.gz CEZYULYITXMSLM-HNNXBMFYSA-N 2 0 329.463 3.804 20 10 EHCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)CC[C@H]21 ZINC000247301992 1020019039 /nfs/dbraw/zinc/01/90/39/1020019039.db2.gz ZSTLXXFMJRWWMP-TZIWHRDSSA-N 2 0 327.516 3.593 20 10 EHCDRP Cc1cc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716047 1127525272 /nfs/dbraw/zinc/52/52/72/1127525272.db2.gz GOMITFPOVOSDHR-UZLBHIALSA-N 2 0 325.500 3.709 20 10 EHCDRP CN(C)c1ccc(C[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1F ZINC000733322274 1131024673 /nfs/dbraw/zinc/02/46/73/1131024673.db2.gz FUHXXXHEOBNUAK-UHFFFAOYSA-N 2 0 329.463 3.503 20 10 EHCDRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)CC1 ZINC001175351444 1132645211 /nfs/dbraw/zinc/64/52/11/1132645211.db2.gz MGGORKWXQPDXGW-NRFANRHFSA-N 2 0 329.532 3.839 20 10 EHCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000769149007 1133235042 /nfs/dbraw/zinc/23/50/42/1133235042.db2.gz WUTABHWLPLUVDB-GOSISDBHSA-N 2 0 346.515 3.735 20 10 EHCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1O ZINC000775740348 1135598895 /nfs/dbraw/zinc/59/88/95/1135598895.db2.gz VGXGBWKSPJOHQP-KBXCAEBGSA-N 2 0 334.891 3.803 20 10 EHCDRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001199329513 1135897943 /nfs/dbraw/zinc/89/79/43/1135897943.db2.gz USVZWFBYXHNNKS-OALUTQOASA-N 2 0 329.532 3.744 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853239248 1136521022 /nfs/dbraw/zinc/52/10/22/1136521022.db2.gz CVASQHFETAXGTJ-PKOBYXMFSA-N 2 0 329.532 3.915 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccoc1 ZINC000773146141 1137469862 /nfs/dbraw/zinc/46/98/62/1137469862.db2.gz ORRKTBDBICVBII-QGZVFWFLSA-N 2 0 339.483 3.662 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(OCC)c2O)CC1 ZINC000134160291 1137943925 /nfs/dbraw/zinc/94/39/25/1137943925.db2.gz OEIYDYQCAZAMNP-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(N(C)C)cc1 ZINC000089215106 1138195724 /nfs/dbraw/zinc/19/57/24/1138195724.db2.gz ZGUUMOALLZPWKS-QGZVFWFLSA-N 2 0 338.499 3.715 20 10 EHCDRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000185314499 1140144460 /nfs/dbraw/zinc/14/44/60/1140144460.db2.gz KHAFGLUVTBNAHV-INIZCTEOSA-N 2 0 342.483 3.697 20 10 EHCDRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)cc1O ZINC000834910731 1021128609 /nfs/dbraw/zinc/12/86/09/1021128609.db2.gz YSMIRBZTBUAOLO-LBPRGKRZSA-N 2 0 341.293 3.680 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(O)c1C ZINC000273306004 1027368039 /nfs/dbraw/zinc/36/80/39/1027368039.db2.gz CSEKIMAHWOFLHW-QGZVFWFLSA-N 2 0 342.483 3.800 20 10 EHCDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1O ZINC000174451728 1033940823 /nfs/dbraw/zinc/94/08/23/1033940823.db2.gz OCGFCDHHCHCMAF-UHFFFAOYSA-N 2 0 336.435 3.907 20 10 EHCDRP CN(C)c1ccc(/C=C\C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000922845359 1129691502 /nfs/dbraw/zinc/69/15/02/1129691502.db2.gz OUMRJYBNZQBIJS-XQRVVYSFSA-N 2 0 327.516 3.762 20 10 EHCDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)cc1O ZINC000700973332 1130086248 /nfs/dbraw/zinc/08/62/48/1130086248.db2.gz GOKUKDJPGBICCL-CYBMUJFWSA-N 2 0 343.309 3.755 20 10 EHCDRP C[C@]1(C[NH2+]Cc2cc(F)ccc2O)CC[N@H+](Cc2ccccc2)C1 ZINC000379772890 1132518594 /nfs/dbraw/zinc/51/85/94/1132518594.db2.gz RXBVFVULUJZELO-HXUWFJFHSA-N 2 0 328.431 3.533 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000768302533 1133122878 /nfs/dbraw/zinc/12/28/78/1133122878.db2.gz HOETXSXLZDOGDF-UHFFFAOYSA-N 2 0 341.543 3.985 20 10 EHCDRP CCOc1ccc(O)c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000768304492 1133123560 /nfs/dbraw/zinc/12/35/60/1133123560.db2.gz YNWQJQRUUXFRPP-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CCCC2 ZINC000768448826 1133140710 /nfs/dbraw/zinc/14/07/10/1133140710.db2.gz XTYQASCOVSEHJZ-HXUWFJFHSA-N 2 0 328.500 3.721 20 10 EHCDRP Cc1c2ccccc2n(C)c1C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001179717050 1133275738 /nfs/dbraw/zinc/27/57/38/1133275738.db2.gz MMAAOHOPBAOZJW-UHFFFAOYSA-N 2 0 325.500 3.983 20 10 EHCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514985 1133306732 /nfs/dbraw/zinc/30/67/32/1133306732.db2.gz MZBSPYWGRGCWMK-NRFANRHFSA-N 2 0 341.543 3.841 20 10 EHCDRP CCCN(Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(C[NH3+])cc1 ZINC000775141191 1134374535 /nfs/dbraw/zinc/37/45/35/1134374535.db2.gz YGYSFKBDJKCAAR-UHFFFAOYSA-N 2 0 341.499 3.502 20 10 EHCDRP CC(C)c1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000775340348 1134651789 /nfs/dbraw/zinc/65/17/89/1134651789.db2.gz KXEMSQXATHWTLN-UHFFFAOYSA-N 2 0 337.511 3.852 20 10 EHCDRP C[N@H+](Cc1ccc(Cl)s1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775645711 1135388688 /nfs/dbraw/zinc/38/86/88/1135388688.db2.gz FXUOGJBQOIBZBD-UHFFFAOYSA-N 2 0 349.931 3.785 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3ccccc3)cc2)CC1 ZINC000775645416 1135392432 /nfs/dbraw/zinc/39/24/32/1135392432.db2.gz KUUXUKJSQLIJAZ-QFIPXVFZSA-N 2 0 335.495 3.776 20 10 EHCDRP COc1ccc(O)c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC000775734453 1135588559 /nfs/dbraw/zinc/58/85/59/1135588559.db2.gz QFJWGHUTRZAGOI-KRWDZBQOSA-N 2 0 346.515 3.877 20 10 EHCDRP C[NH+]1CCC(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)CC1 ZINC000776265981 1136124865 /nfs/dbraw/zinc/12/48/65/1136124865.db2.gz SITWVWZHQROHOH-OAQYLSRUSA-N 2 0 338.495 3.998 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000850517345 1136275841 /nfs/dbraw/zinc/27/58/41/1136275841.db2.gz YZLVEAKPOYRUGW-QGZVFWFLSA-N 2 0 339.483 3.658 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241077 1136521527 /nfs/dbraw/zinc/52/15/27/1136521527.db2.gz UGJWCAGMNXFNAI-RXVVDRJESA-N 2 0 329.532 3.915 20 10 EHCDRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000817957947 1136852158 /nfs/dbraw/zinc/85/21/58/1136852158.db2.gz REYRCUAYXICZKF-UHFFFAOYSA-N 2 0 337.511 3.844 20 10 EHCDRP CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Br)ccc1O ZINC000817976813 1136854464 /nfs/dbraw/zinc/85/44/64/1136854464.db2.gz UYMUZNPYXPPWTH-BXUZGUMPSA-N 2 0 329.282 3.713 20 10 EHCDRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817981340 1136854914 /nfs/dbraw/zinc/85/49/14/1136854914.db2.gz REMXTAFGKBCAPA-DZGCQCFKSA-N 2 0 341.293 3.728 20 10 EHCDRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817981343 1136854954 /nfs/dbraw/zinc/85/49/54/1136854954.db2.gz REMXTAFGKBCAPA-ZFWWWQNUSA-N 2 0 341.293 3.728 20 10 EHCDRP CC(C)[N@H+](Cc1ccnn1-c1cc[nH+]cc1)Cc1ccc(N(C)C)cc1 ZINC000824566868 1137143151 /nfs/dbraw/zinc/14/31/51/1137143151.db2.gz ORIZBYDXZAYUDE-UHFFFAOYSA-N 2 0 349.482 3.744 20 10 EHCDRP Cc1cc(O)c(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Cl ZINC000825125474 1137166747 /nfs/dbraw/zinc/16/67/47/1137166747.db2.gz LEJVSZBSPXDBBI-UHFFFAOYSA-N 2 0 348.874 3.584 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1O ZINC000846144486 1137339023 /nfs/dbraw/zinc/33/90/23/1137339023.db2.gz GXMVXQHRLRZNBI-OAHLLOKOSA-N 2 0 332.488 3.849 20 10 EHCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)c3cccnc3c1[O-])C2 ZINC001172104633 1137536400 /nfs/dbraw/zinc/53/64/00/1137536400.db2.gz DPFJAQOSPPXBKM-QDMKHBRRSA-N 2 0 345.874 3.699 20 10 EHCDRP COc1cccc(C[N@@H+]2CCC[C@@H](C[C@@H]([NH3+])C3CCCC3)C2)c1O ZINC000873232250 1137594574 /nfs/dbraw/zinc/59/45/74/1137594574.db2.gz NSYOMCCGLUCDRL-MAUKXSAKSA-N 2 0 332.488 3.520 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1O ZINC000873241848 1137595105 /nfs/dbraw/zinc/59/51/05/1137595105.db2.gz GPGAXSZBZYNENR-AAEUAGOBSA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1O ZINC000873246113 1137595152 /nfs/dbraw/zinc/59/51/52/1137595152.db2.gz WYTIIOGWHJPLER-YPMHNXCESA-N 2 0 341.293 3.584 20 10 EHCDRP COc1cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000825699292 1137607377 /nfs/dbraw/zinc/60/73/77/1137607377.db2.gz SZTXSKWMWQQJSM-MRXNPFEDSA-N 2 0 334.504 3.614 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1O ZINC000183489317 1140042705 /nfs/dbraw/zinc/04/27/05/1140042705.db2.gz WXHUGOQTGUYKEL-INIZCTEOSA-N 2 0 328.456 3.574 20 10 EHCDRP Cc1ccc(O)c(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC000895391995 1024459556 /nfs/dbraw/zinc/45/95/56/1024459556.db2.gz IXCFXAVYWFIJFB-JBACZVJFSA-N 2 0 336.479 3.843 20 10 EHCDRP CC[NH+](CC)CCCC1CC[NH+](Cc2c(O)cccc2OC)CC1 ZINC000783594608 1027564262 /nfs/dbraw/zinc/56/42/62/1027564262.db2.gz GVSLWLQSJUGGOC-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000359874311 1027862004 /nfs/dbraw/zinc/86/20/04/1027862004.db2.gz RFPFCDWPSHWPCC-UVFQYZLESA-N 2 0 328.431 3.875 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000359879024 1027865971 /nfs/dbraw/zinc/86/59/71/1027865971.db2.gz YYVNJXBPSOXZMU-WJPUGNRLSA-N 2 0 340.467 3.744 20 10 EHCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000165928146 1036808274 /nfs/dbraw/zinc/80/82/74/1036808274.db2.gz YDJSCJHJMZSEQH-WIYYLYMNSA-N 2 0 347.547 3.684 20 10 EHCDRP CC[NH+]1CCC([NH2+]CCc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC000761574017 1037167489 /nfs/dbraw/zinc/16/74/89/1037167489.db2.gz WJVSPUVABIDWLB-UHFFFAOYSA-N 2 0 325.500 3.711 20 10 EHCDRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000155628003 1040830128 /nfs/dbraw/zinc/83/01/28/1040830128.db2.gz DAMRAHLZLPEIEH-TZIWHRDSSA-N 2 0 338.495 3.998 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000044534531 1040977699 /nfs/dbraw/zinc/97/76/99/1040977699.db2.gz IINPGTBMAFFWDO-WFASDCNBSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@H](CC1CCCCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001178585641 1133179893 /nfs/dbraw/zinc/17/98/93/1133179893.db2.gz ZCYANANLGQLSNM-GOSISDBHSA-N 2 0 329.532 3.887 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1F ZINC001178613859 1133185762 /nfs/dbraw/zinc/18/57/62/1133185762.db2.gz BRLPVWXKSXVYCW-UHFFFAOYSA-N 2 0 335.511 3.884 20 10 EHCDRP CCOc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(O)c1 ZINC000769514306 1133306173 /nfs/dbraw/zinc/30/61/73/1133306173.db2.gz JXEPJANOCUJUCS-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000771866962 1133603276 /nfs/dbraw/zinc/60/32/76/1133603276.db2.gz GFXYIXBZMAMSNO-YADHBBJMSA-N 2 0 349.522 3.864 20 10 EHCDRP C[C@@H](c1cccs1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648924 1135405179 /nfs/dbraw/zinc/40/51/79/1135405179.db2.gz HYNCEIRIJNHAGB-INIZCTEOSA-N 2 0 329.513 3.693 20 10 EHCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809767461 1135879553 /nfs/dbraw/zinc/87/95/53/1135879553.db2.gz LNYZZSDUHYVQHM-TZIWHRDSSA-N 2 0 336.479 3.975 20 10 EHCDRP COc1cc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000850097258 1136210531 /nfs/dbraw/zinc/21/05/31/1136210531.db2.gz VXQMDBZZSOHZPG-OAHLLOKOSA-N 2 0 334.504 3.518 20 10 EHCDRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1O ZINC000850516711 1136275833 /nfs/dbraw/zinc/27/58/33/1136275833.db2.gz LKPHCCORBVDWHJ-HXUWFJFHSA-N 2 0 339.483 3.740 20 10 EHCDRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2O ZINC000850581087 1136292087 /nfs/dbraw/zinc/29/20/87/1136292087.db2.gz CXRUYMRDEOKKDH-SUMWQHHRSA-N 2 0 332.463 3.791 20 10 EHCDRP Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)CC2 ZINC000817979696 1136854887 /nfs/dbraw/zinc/85/48/87/1136854887.db2.gz NDZWZKNSUCYXGN-UHOSZYNNSA-N 2 0 340.442 3.502 20 10 EHCDRP CN(Cc1cccs1)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000823840916 1137115752 /nfs/dbraw/zinc/11/57/52/1137115752.db2.gz DEZVGBVCXTVUGA-SFHVURJKSA-N 2 0 343.540 3.816 20 10 EHCDRP CCOCc1cc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)ccc1OC ZINC000873233010 1137594631 /nfs/dbraw/zinc/59/46/31/1137594631.db2.gz WCARXSNZUKUYEB-HXUWFJFHSA-N 2 0 346.515 3.634 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccs1 ZINC000883289335 1137852848 /nfs/dbraw/zinc/85/28/48/1137852848.db2.gz LEKPYGSKORAYES-GOSISDBHSA-N 2 0 329.513 3.741 20 10 EHCDRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(C)cc(OC)c2O)c1 ZINC000894191039 1019109703 /nfs/dbraw/zinc/10/97/03/1019109703.db2.gz BHOVAHCKRGXQCQ-UHFFFAOYSA-N 2 0 342.483 3.841 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(C)cc1O ZINC000279994255 1019975336 /nfs/dbraw/zinc/97/53/36/1019975336.db2.gz FNJLZBFTJUOLKK-HXUWFJFHSA-N 2 0 342.483 3.882 20 10 EHCDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2c(O)ccc3ccc(OC)cc32)C1 ZINC000173432550 1033331616 /nfs/dbraw/zinc/33/16/16/1033331616.db2.gz IMJPRSUENDMDBE-MRXNPFEDSA-N 2 0 342.483 3.718 20 10 EHCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769514988 1133307398 /nfs/dbraw/zinc/30/73/98/1133307398.db2.gz MZBSPYWGRGCWMK-OAQYLSRUSA-N 2 0 341.543 3.841 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2cccc(OC)c2O)CC1)CC1CC1 ZINC000770598250 1133449468 /nfs/dbraw/zinc/44/94/68/1133449468.db2.gz YUPZCTVKBZBBTP-UHFFFAOYSA-N 2 0 346.515 3.735 20 10 EHCDRP C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775701887 1135539242 /nfs/dbraw/zinc/53/92/42/1135539242.db2.gz OHUVFLGSJSFSFS-YFVAEKQCSA-N 2 0 327.516 3.591 20 10 EHCDRP CCOc1ccc(O)c(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809739288 1135883681 /nfs/dbraw/zinc/88/36/81/1135883681.db2.gz FPZCPCCDXRRNCR-UHFFFAOYSA-N 2 0 342.483 3.875 20 10 EHCDRP CSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC[NH+](C)CC1 ZINC000810252176 1135948919 /nfs/dbraw/zinc/94/89/19/1135948919.db2.gz KQTILLTYJZNONS-LBPRGKRZSA-N 2 0 328.909 3.524 20 10 EHCDRP COc1cccc(C[N@@H+]2CCC[C@H](C[C@@H]([NH3+])C3CCCC3)C2)c1O ZINC000873232248 1137594594 /nfs/dbraw/zinc/59/45/94/1137594594.db2.gz NSYOMCCGLUCDRL-CRAIPNDOSA-N 2 0 332.488 3.520 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(Br)cc1O ZINC000873246110 1137595149 /nfs/dbraw/zinc/59/51/49/1137595149.db2.gz WYTIIOGWHJPLER-AAEUAGOBSA-N 2 0 341.293 3.584 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000184901276 1140125114 /nfs/dbraw/zinc/12/51/14/1140125114.db2.gz PRJCAWLECGUVMA-INIZCTEOSA-N 2 0 340.467 3.847 20 10 EHCDRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cc(Br)ccc1O ZINC000037644086 522866736 /nfs/dbraw/zinc/86/67/36/522866736.db2.gz RHZLUOHKCQRDTP-IUODEOHRSA-N 2 0 341.293 3.537 20 10 EHCDRP Oc1cccc(Cl)c1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000113317915 1026548260 /nfs/dbraw/zinc/54/82/60/1026548260.db2.gz LMPJMNCEMVHIDO-UHFFFAOYSA-N 2 0 330.859 3.931 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000185038918 1126746579 /nfs/dbraw/zinc/74/65/79/1126746579.db2.gz PCYXDNKPVOLVNE-ZACQAIPSSA-N 2 0 334.504 3.810 20 10 EHCDRP Cc1cc(O)c(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1C ZINC000743401539 1131913452 /nfs/dbraw/zinc/91/34/52/1131913452.db2.gz BUSNNVNTLLLPQU-FQEVSTJZSA-N 2 0 338.495 3.963 20 10 EHCDRP CC1=CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000788688744 1134157937 /nfs/dbraw/zinc/15/79/37/1134157937.db2.gz GUMDWXYJWPEOMI-OAQYLSRUSA-N 2 0 339.527 3.807 20 10 EHCDRP CN(C)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000792812657 1134794859 /nfs/dbraw/zinc/79/48/59/1134794859.db2.gz LOYZAONBYINEJL-UHFFFAOYSA-N 2 0 343.437 3.545 20 10 EHCDRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001649139108 1135740622 /nfs/dbraw/zinc/74/06/22/1135740622.db2.gz RCWIEDAEVTUQKN-LJQANCHMSA-N 2 0 337.511 3.906 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1F ZINC000809767403 1135879800 /nfs/dbraw/zinc/87/98/00/1135879800.db2.gz JYVJMLLHKBIOFR-MJGOQNOKSA-N 2 0 333.495 3.588 20 10 EHCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000850584715 1136293867 /nfs/dbraw/zinc/29/38/67/1136293867.db2.gz TZJRRKCCZLBQCE-QGZVFWFLSA-N 2 0 329.532 3.915 20 10 EHCDRP COc1ccc(N2CCC([NH2+]CCCCC[NH+]3CCCC3)CC2)cc1 ZINC000815150844 1136562700 /nfs/dbraw/zinc/56/27/00/1136562700.db2.gz FUVGMOVFHFMPFG-UHFFFAOYSA-N 2 0 345.531 3.520 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000817901608 1136844394 /nfs/dbraw/zinc/84/43/94/1136844394.db2.gz CRHXHHCRTCJDET-FDFHNCONSA-N 2 0 341.543 3.933 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817946913 1136849802 /nfs/dbraw/zinc/84/98/02/1136849802.db2.gz HSZKVOKKXLHLPU-HUBLWGQQSA-N 2 0 341.293 3.584 20 10 EHCDRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817979728 1136854925 /nfs/dbraw/zinc/85/49/25/1136854925.db2.gz DRHDKAOXKGSIGG-DZGCQCFKSA-N 2 0 330.394 3.984 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000858490946 1136972843 /nfs/dbraw/zinc/97/28/43/1136972843.db2.gz SYZKACALRYLDEN-OLZOCXBDSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)Cc3cccs3)cc2)CC[N@@H+]1C ZINC000823955396 1137119148 /nfs/dbraw/zinc/11/91/48/1137119148.db2.gz KPYBWLVWBULAAF-SJLPKXTDSA-N 2 0 343.540 3.957 20 10 EHCDRP Cc1cc(O)c(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1Cl ZINC000825286805 1137171538 /nfs/dbraw/zinc/17/15/38/1137171538.db2.gz GPYOBOQHJVRXPD-UHFFFAOYSA-N 2 0 336.838 3.845 20 10 EHCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)c(F)c1 ZINC000844905457 1137261608 /nfs/dbraw/zinc/26/16/08/1137261608.db2.gz ZUVFVNGPOHZBHB-UHFFFAOYSA-N 2 0 327.447 3.565 20 10 EHCDRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183425508 1140037493 /nfs/dbraw/zinc/03/74/93/1140037493.db2.gz XKKUMGWMBZDRHY-QGZVFWFLSA-N 2 0 342.483 3.964 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C)cc1O ZINC000279999588 1019980647 /nfs/dbraw/zinc/98/06/47/1019980647.db2.gz FUZJRYOYJFBJFY-IBGZPJMESA-N 2 0 342.483 3.882 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(C)cc2O)[C@@H](C)C1 ZINC000280054366 1020039493 /nfs/dbraw/zinc/03/94/93/1020039493.db2.gz JUZXNMPHUFRTPF-SXLOBPIMSA-N 2 0 348.531 3.878 20 10 EHCDRP C[C@H]1CC([NH2+]Cc2cccc(O)c2O)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168029577 1024547676 /nfs/dbraw/zinc/54/76/76/1024547676.db2.gz TVAYILMKOLNEIF-HOTGVXAUSA-N 2 0 340.467 3.629 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000044534533 1040976682 /nfs/dbraw/zinc/97/66/82/1040976682.db2.gz IINPGTBMAFFWDO-SWLSCSKDSA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000185337559 1126869404 /nfs/dbraw/zinc/86/94/04/1126869404.db2.gz VZTOXHUNYUBHKL-ICSRJNTNSA-N 2 0 338.495 3.916 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000185659071 1126969634 /nfs/dbraw/zinc/96/96/34/1126969634.db2.gz LFILVUXYJIMSJN-MRXNPFEDSA-N 2 0 334.504 3.810 20 10 EHCDRP COCC[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000764907465 1127548530 /nfs/dbraw/zinc/54/85/30/1127548530.db2.gz HGUYFFZUZODMNO-IBGZPJMESA-N 2 0 347.547 3.686 20 10 EHCDRP Cc1nccn1CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788821705 1134177632 /nfs/dbraw/zinc/17/76/32/1134177632.db2.gz YPZSAODNMCGWOG-LLVKDONJSA-N 2 0 327.350 3.657 20 10 EHCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930699 1134828443 /nfs/dbraw/zinc/82/84/43/1134828443.db2.gz QNSAOQHBYGWINP-CQSZACIVSA-N 2 0 343.437 3.593 20 10 EHCDRP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c(O)c1 ZINC000793390884 1134921994 /nfs/dbraw/zinc/92/19/94/1134921994.db2.gz TYJJNMXOBMCDDR-QAPCUYQASA-N 2 0 332.488 3.534 20 10 EHCDRP Cc1ccc(C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C2CC2)o1 ZINC000775649853 1135417272 /nfs/dbraw/zinc/41/72/72/1135417272.db2.gz UDAATDAEWGSPKE-UHFFFAOYSA-N 2 0 339.483 3.504 20 10 EHCDRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215469 1135938425 /nfs/dbraw/zinc/93/84/25/1135938425.db2.gz FWGBRLVVVIRBQT-HNNXBMFYSA-N 2 0 330.394 3.794 20 10 EHCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000810252437 1135948971 /nfs/dbraw/zinc/94/89/71/1135948971.db2.gz PFVOMHYDAACRRT-MRXNPFEDSA-N 2 0 335.561 3.621 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2O ZINC000850581082 1136292273 /nfs/dbraw/zinc/29/22/73/1136292273.db2.gz CXRUYMRDEOKKDH-DYVFJYSZSA-N 2 0 332.463 3.791 20 10 EHCDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817887628 1136841562 /nfs/dbraw/zinc/84/15/62/1136841562.db2.gz AVMIKPKROQRPRF-PKOBYXMFSA-N 2 0 347.572 3.640 20 10 EHCDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964397 1136851936 /nfs/dbraw/zinc/85/19/36/1136851936.db2.gz BEWQNWDTYHUBHN-OXQOHEQNSA-N 2 0 333.495 3.856 20 10 EHCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000794698635 1137235613 /nfs/dbraw/zinc/23/56/13/1137235613.db2.gz ICXQURAQWWEZSQ-CQSZACIVSA-N 2 0 343.437 3.591 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)ccc1O ZINC000184901477 1140125085 /nfs/dbraw/zinc/12/50/85/1140125085.db2.gz UGWAHLHKDKSVMT-HNNXBMFYSA-N 2 0 328.431 3.978 20 10 EHCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1O ZINC000894158085 1018746868 /nfs/dbraw/zinc/74/68/68/1018746868.db2.gz NEBANZHBHHKUNM-UHFFFAOYSA-N 2 0 340.467 3.595 20 10 EHCDRP C[C@H]([NH2+]Cc1c([O-])cccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000896639546 1025791507 /nfs/dbraw/zinc/79/15/07/1025791507.db2.gz VXELNWKVHBKSGK-RDJZCZTQSA-N 2 0 328.431 3.532 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000195133524 1032046580 /nfs/dbraw/zinc/04/65/80/1032046580.db2.gz ZFRAFUZPLGEOIB-WMZOPIPTSA-N 2 0 340.467 3.574 20 10 EHCDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000173491215 1033369600 /nfs/dbraw/zinc/36/96/00/1033369600.db2.gz JGTMJQOGRARIJU-OAHLLOKOSA-N 2 0 342.483 3.791 20 10 EHCDRP Oc1ccc(F)cc1C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000311033664 1034027031 /nfs/dbraw/zinc/02/70/31/1034027031.db2.gz NTCSVRHIEOWGMY-GOSISDBHSA-N 2 0 342.458 3.923 20 10 EHCDRP CN1CCCc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc21 ZINC000765484235 1127617723 /nfs/dbraw/zinc/61/77/23/1127617723.db2.gz ACMSGMRPGYRXSH-UHFFFAOYSA-N 2 0 341.543 3.956 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379636046 1132177774 /nfs/dbraw/zinc/17/77/74/1132177774.db2.gz WXMJZNCBOXBMBP-SJORKVTESA-N 2 0 342.483 3.962 20 10 EHCDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657802 1132241845 /nfs/dbraw/zinc/24/18/45/1132241845.db2.gz UMRBKAGKMSZGNO-RXVVDRJESA-N 2 0 337.511 3.895 20 10 EHCDRP CCC[N@H+](Cc1ccc(OCC[NH+](C)C)cc1)Cc1ccccc1O ZINC000769201403 1133243897 /nfs/dbraw/zinc/24/38/97/1133243897.db2.gz TUWVLWMPHDSVDZ-UHFFFAOYSA-N 2 0 342.483 3.745 20 10 EHCDRP Oc1ccccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000770506214 1133435823 /nfs/dbraw/zinc/43/58/23/1133435823.db2.gz ZEZCULSJOMAONC-CTNGQTDRSA-N 2 0 336.479 3.879 20 10 EHCDRP Cc1cccc(C(C)(C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000771841821 1133598656 /nfs/dbraw/zinc/59/86/56/1133598656.db2.gz LSECTVQJRXXTQM-UHFFFAOYSA-N 2 0 337.511 3.772 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1 ZINC000771818322 1133600830 /nfs/dbraw/zinc/60/08/30/1133600830.db2.gz JQWHEYPGBWXCKL-OAQYLSRUSA-N 2 0 341.474 3.818 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3(c4ccccc4)CCC3)cc2)CC1 ZINC000771818936 1133601659 /nfs/dbraw/zinc/60/16/59/1133601659.db2.gz NUVWOSORSLBEGB-UHFFFAOYSA-N 2 0 335.495 3.607 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@H+](Cc3cccs3)C3CC3)cc2)CC1 ZINC000775648723 1135406361 /nfs/dbraw/zinc/40/63/61/1135406361.db2.gz IVCGRAIFBXCYID-UHFFFAOYSA-N 2 0 341.524 3.665 20 10 EHCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000809767459 1135879970 /nfs/dbraw/zinc/87/99/70/1135879970.db2.gz LNYZZSDUHYVQHM-FPOVZHCZSA-N 2 0 336.479 3.975 20 10 EHCDRP COc1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850036389 1136200916 /nfs/dbraw/zinc/20/09/16/1136200916.db2.gz KKYUSQHNUSRYNU-UHFFFAOYSA-N 2 0 346.515 3.662 20 10 EHCDRP COc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850329182 1136235446 /nfs/dbraw/zinc/23/54/46/1136235446.db2.gz KZAIGUZWYPRGPT-UHFFFAOYSA-N 2 0 334.504 3.661 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2c1c(F)ccc2O ZINC000853240682 1136521525 /nfs/dbraw/zinc/52/15/25/1136521525.db2.gz RAKBXHMHOUQYKI-KMFMINBZSA-N 2 0 332.463 3.791 20 10 EHCDRP [O-]c1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000816594482 1136735456 /nfs/dbraw/zinc/73/54/56/1136735456.db2.gz FKEJHCBUDJBDJW-HNNXBMFYSA-N 2 0 348.849 3.796 20 10 EHCDRP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642836 1136743644 /nfs/dbraw/zinc/74/36/44/1136743644.db2.gz MWCWOTIYBPDJAC-JOCHJYFZSA-N 2 0 336.479 3.977 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000817901607 1136844802 /nfs/dbraw/zinc/84/48/02/1136844802.db2.gz CRHXHHCRTCJDET-BHIFYINESA-N 2 0 341.543 3.933 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000817934091 1136846705 /nfs/dbraw/zinc/84/67/05/1136846705.db2.gz BXKNXPDTAQPEGY-CVEARBPZSA-N 2 0 340.515 3.505 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817947141 1136850456 /nfs/dbraw/zinc/85/04/56/1136850456.db2.gz LFQCSCJGHXGQFZ-JMSVASOKSA-N 2 0 330.394 3.840 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817947142 1136850495 /nfs/dbraw/zinc/85/04/95/1136850495.db2.gz LFQCSCJGHXGQFZ-XUJVJEKNSA-N 2 0 330.394 3.840 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1O ZINC000817969506 1136853725 /nfs/dbraw/zinc/85/37/25/1136853725.db2.gz VKYPJDLNBVOJMM-LLVKDONJSA-N 2 0 347.256 3.609 20 10 EHCDRP Oc1cccc2c1[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)CC2 ZINC000817979690 1136855042 /nfs/dbraw/zinc/85/50/42/1136855042.db2.gz NDZWZKNSUCYXGN-QXAKKESOSA-N 2 0 340.442 3.502 20 10 EHCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1O ZINC000873241849 1137595129 /nfs/dbraw/zinc/59/51/29/1137595129.db2.gz GPGAXSZBZYNENR-DGCLKSJQSA-N 2 0 341.293 3.584 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(OCC)ccc2O)CC1 ZINC000134170267 1137945439 /nfs/dbraw/zinc/94/54/39/1137945439.db2.gz FRKWWOOILKKDQQ-UHFFFAOYSA-N 2 0 334.504 3.735 20 10 EHCDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462494 1139092529 /nfs/dbraw/zinc/09/25/29/1139092529.db2.gz KERLKKFVTIQCGY-MSOLQXFVSA-N 2 0 327.516 3.812 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000186518376 1140207703 /nfs/dbraw/zinc/20/77/03/1140207703.db2.gz ZUJMGBVSBUKLKF-BZUAXINKSA-N 2 0 332.488 3.704 20 10 EHCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1O ZINC000894384972 1021557816 /nfs/dbraw/zinc/55/78/16/1021557816.db2.gz OHRDMDQDYJTEMX-UHFFFAOYSA-N 2 0 342.483 3.839 20 10 EHCDRP COc1cc(C)cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1O ZINC000894328202 1021604422 /nfs/dbraw/zinc/60/44/22/1021604422.db2.gz KJGRQHFSKITGEU-UHFFFAOYSA-N 2 0 332.488 3.596 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1F ZINC000297539807 1021630768 /nfs/dbraw/zinc/63/07/68/1021630768.db2.gz OQIDAJJHPXMQFK-UHFFFAOYSA-N 2 0 326.419 3.609 20 10 EHCDRP C[C@@H]([NH2+]Cc1c([O-])cccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000896639545 1025792120 /nfs/dbraw/zinc/79/21/20/1025792120.db2.gz VXELNWKVHBKSGK-NVXWUHKLSA-N 2 0 328.431 3.532 20 10 EHCDRP Cc1cc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cc[nH+]1 ZINC000302477157 1027160658 /nfs/dbraw/zinc/16/06/58/1027160658.db2.gz QYCUKCSEXHYVHH-UHFFFAOYSA-N 2 0 336.483 3.534 20 10 EHCDRP COc1cc(C)cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1O ZINC000164599379 1035711872 /nfs/dbraw/zinc/71/18/72/1035711872.db2.gz HMELGVZUOUGCBM-UHFFFAOYSA-N 2 0 346.515 3.797 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000236916674 1040187020 /nfs/dbraw/zinc/18/70/20/1040187020.db2.gz UZJWGKAZPDUYFD-RTBURBONSA-N 2 0 347.547 3.512 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)CC[N@@H+]1Cc1ccccc1 ZINC000080338639 1041159771 /nfs/dbraw/zinc/15/97/71/1041159771.db2.gz YHSDSXOQNBFBAS-DYESRHJHSA-N 2 0 336.479 3.764 20 10 EHCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169124020 1132665347 /nfs/dbraw/zinc/66/53/47/1132665347.db2.gz PJOJUOCAVOWUQZ-QOIOWGMHSA-N 2 0 328.500 3.847 20 10 EHCDRP C[C@H](c1cccs1)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648931 1135405110 /nfs/dbraw/zinc/40/51/10/1135405110.db2.gz HYNCEIRIJNHAGB-MRXNPFEDSA-N 2 0 329.513 3.693 20 10 EHCDRP C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775701885 1135539347 /nfs/dbraw/zinc/53/93/47/1135539347.db2.gz OHUVFLGSJSFSFS-QFUCXCTJSA-N 2 0 327.516 3.591 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)cc2)CC1 ZINC001199052924 1135876460 /nfs/dbraw/zinc/87/64/60/1135876460.db2.gz OVSALSMDTZIKQJ-PWRODBHTSA-N 2 0 341.543 3.887 20 10 EHCDRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810207856 1135943008 /nfs/dbraw/zinc/94/30/08/1135943008.db2.gz PTLVSGRREHNAQP-OAHLLOKOSA-N 2 0 330.394 3.938 20 10 EHCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850070012 1136206104 /nfs/dbraw/zinc/20/61/04/1136206104.db2.gz QZIHNQBCDUNGIQ-HNNXBMFYSA-N 2 0 334.504 3.520 20 10 EHCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850070013 1136206144 /nfs/dbraw/zinc/20/61/44/1136206144.db2.gz QZIHNQBCDUNGIQ-OAHLLOKOSA-N 2 0 334.504 3.520 20 10 EHCDRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)[C@H](C)C2 ZINC000850386581 1136247284 /nfs/dbraw/zinc/24/72/84/1136247284.db2.gz MGYNFKGZRXYIGT-JPYJTQIMSA-N 2 0 349.522 3.770 20 10 EHCDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815561073 1136610911 /nfs/dbraw/zinc/61/09/11/1136610911.db2.gz XODFKVDHHCRYRE-TZIWHRDSSA-N 2 0 338.495 3.998 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1 ZINC000817978986 1136854835 /nfs/dbraw/zinc/85/48/35/1136854835.db2.gz GELHNFNRGCWNAC-HHXXYDBFSA-N 2 0 342.458 3.884 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(C(F)(F)F)cc1O ZINC000817987762 1136855355 /nfs/dbraw/zinc/85/53/55/1136855355.db2.gz WTCSEUWAUPKMLY-DMEJVMROSA-N 2 0 342.405 3.840 20 10 EHCDRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)cc1)CC2 ZINC000846055786 1137331024 /nfs/dbraw/zinc/33/10/24/1137331024.db2.gz NTPRZBSURPLNEO-QFIPXVFZSA-N 2 0 335.495 3.524 20 10 EHCDRP COc1cccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1O ZINC000846166118 1137337369 /nfs/dbraw/zinc/33/73/69/1137337369.db2.gz SUFCJTYHHYZMKM-JYJNAYRXSA-N 2 0 332.488 3.704 20 10 EHCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1O ZINC000873241851 1137595103 /nfs/dbraw/zinc/59/51/03/1137595103.db2.gz GPGAXSZBZYNENR-YPMHNXCESA-N 2 0 341.293 3.584 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1O ZINC000873269492 1137595737 /nfs/dbraw/zinc/59/57/37/1137595737.db2.gz QGWLLLFLDYFCQY-NEPJUHHUSA-N 2 0 341.293 3.502 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(O)c1 ZINC000185337049 1140145641 /nfs/dbraw/zinc/14/56/41/1140145641.db2.gz HESLUNGWYFRDTI-KRWDZBQOSA-N 2 0 342.483 3.882 20 10 EHCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185671111 1140162019 /nfs/dbraw/zinc/16/20/19/1140162019.db2.gz WJNBCQTXNNTETG-WBVHZDCISA-N 2 0 330.472 3.553 20 10 EHCDRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(C)cc(OC)c2O)cc1 ZINC000894153844 1018721037 /nfs/dbraw/zinc/72/10/37/1018721037.db2.gz NTFUQAFVHHGGKR-UHFFFAOYSA-N 2 0 342.483 3.841 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(C)cc(OC)c2O)CC1 ZINC000164356763 1035521729 /nfs/dbraw/zinc/52/17/29/1035521729.db2.gz PSQUMKZVBFYBHG-UHFFFAOYSA-N 2 0 334.504 3.653 20 10 EHCDRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000155627898 1040830493 /nfs/dbraw/zinc/83/04/93/1040830493.db2.gz DAMRAHLZLPEIEH-CTNGQTDRSA-N 2 0 338.495 3.998 20 10 EHCDRP Cc1cc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000764716043 1127525588 /nfs/dbraw/zinc/52/55/88/1127525588.db2.gz GOMITFPOVOSDHR-OXJNMPFZSA-N 2 0 325.500 3.709 20 10 EHCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768448654 1133140699 /nfs/dbraw/zinc/14/06/99/1133140699.db2.gz VAYAPSWMPMUJBV-UHFFFAOYSA-N 2 0 330.516 3.825 20 10 EHCDRP COc1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(O)cc1C ZINC000768463398 1133144515 /nfs/dbraw/zinc/14/45/15/1133144515.db2.gz SMDFYWZCUYEOEO-UHFFFAOYSA-N 2 0 346.515 3.797 20 10 EHCDRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(-c4ccccc4)ccc3O)CC[C@@H]21 ZINC000770353650 1133419823 /nfs/dbraw/zinc/41/98/23/1133419823.db2.gz SXPKVFCUSBGZQM-FPOVZHCZSA-N 2 0 336.479 3.975 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)cc1C(C)C ZINC000746644661 1133960689 /nfs/dbraw/zinc/96/06/89/1133960689.db2.gz BPFMFEYGMXKPMJ-HFSMHLIXSA-N 2 0 346.515 3.508 20 10 EHCDRP CN(C)c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000793066182 1134846099 /nfs/dbraw/zinc/84/60/99/1134846099.db2.gz MLWMYNXPYGQIEF-UHFFFAOYSA-N 2 0 343.437 3.593 20 10 EHCDRP Cc1cc(Cl)cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000793206986 1134882382 /nfs/dbraw/zinc/88/23/82/1134882382.db2.gz MLYZKVZPRDXUOI-QGZVFWFLSA-N 2 0 344.886 3.966 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4CCCC[C@H]4C3)cc2)CC1 ZINC001199052926 1135876216 /nfs/dbraw/zinc/87/62/16/1135876216.db2.gz OVSALSMDTZIKQJ-QHAWAJNXSA-N 2 0 341.543 3.887 20 10 EHCDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810216381 1135938813 /nfs/dbraw/zinc/93/88/13/1135938813.db2.gz IRBKMTQYKSUTFS-IUODEOHRSA-N 2 0 330.394 3.794 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Br)ccc1O ZINC000817946916 1136850001 /nfs/dbraw/zinc/85/00/01/1136850001.db2.gz HSZKVOKKXLHLPU-ZOWXZIJZSA-N 2 0 341.293 3.584 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)cc1 ZINC000817957349 1136851588 /nfs/dbraw/zinc/85/15/88/1136851588.db2.gz LCKRVBOPWMMDMS-ZRBLBEILSA-N 2 0 349.522 3.844 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1O ZINC000817966946 1136853206 /nfs/dbraw/zinc/85/32/06/1136853206.db2.gz ZZKMTNVKNOEOEV-BLLLJJGKSA-N 2 0 341.293 3.503 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1O ZINC000817981518 1136854920 /nfs/dbraw/zinc/85/49/20/1136854920.db2.gz SPGWFOJSHPZTJE-JSGCOSHPSA-N 2 0 341.293 3.646 20 10 EHCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC001172101678 1137532417 /nfs/dbraw/zinc/53/24/17/1137532417.db2.gz HPIREXKGGDLEAO-ZKTXZKFHSA-N 2 0 327.516 3.782 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000120870185 1137953175 /nfs/dbraw/zinc/95/31/75/1137953175.db2.gz CEZYULYITXMSLM-OAHLLOKOSA-N 2 0 329.463 3.804 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(Cl)ccc1O ZINC000185054876 1140133725 /nfs/dbraw/zinc/13/37/25/1140133725.db2.gz FNGOHJNFXRYITF-CQSZACIVSA-N 2 0 348.874 3.837 20 10 EHCDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](CCC(F)(F)F)CC1 ZINC000194978850 1140627025 /nfs/dbraw/zinc/62/70/25/1140627025.db2.gz JMJWHVXWHMWANN-UHFFFAOYSA-N 2 0 343.437 3.779 20 10 EHCDRP COc1ccc(N2CCC([NH2+]CC[C@@H](C)[NH+]3CCCCC3)CC2)cc1 ZINC000376798855 1017126165 /nfs/dbraw/zinc/12/61/65/1017126165.db2.gz KUNDPPIMIWSMIF-GOSISDBHSA-N 2 0 345.531 3.518 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(C)cc2O)[C@H](C)C1 ZINC000280054364 1020040488 /nfs/dbraw/zinc/04/04/88/1020040488.db2.gz JUZXNMPHUFRTPF-RLLQIKCJSA-N 2 0 348.531 3.878 20 10 EHCDRP C[NH+]1CCN(c2ccc(CNc3cccc(C4=[NH+]CCC4)c3)cc2)CC1 ZINC001167436819 1020133081 /nfs/dbraw/zinc/13/30/81/1020133081.db2.gz AUTMEAJQWOFKAB-UHFFFAOYSA-N 2 0 348.494 3.633 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(O)c1C ZINC000273306002 1027366752 /nfs/dbraw/zinc/36/67/52/1027366752.db2.gz CSEKIMAHWOFLHW-KRWDZBQOSA-N 2 0 342.483 3.800 20 10 EHCDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1O ZINC000273410844 1027416772 /nfs/dbraw/zinc/41/67/72/1027416772.db2.gz HUMSFNWBAFFJRR-GFCCVEGCSA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000185337368 1126868883 /nfs/dbraw/zinc/86/88/83/1126868883.db2.gz QIZNJOYUBUFALP-AZUAARDMSA-N 2 0 338.495 3.916 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1O ZINC000185337623 1126869372 /nfs/dbraw/zinc/86/93/72/1126869372.db2.gz RPESBYFSQGXUMI-WMZOPIPTSA-N 2 0 342.458 3.747 20 10 EHCDRP CCOc1ccc(O)c(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c1 ZINC000922509291 1129557935 /nfs/dbraw/zinc/55/79/35/1129557935.db2.gz LHMXXZNFAWNAAZ-UHFFFAOYSA-N 2 0 332.488 3.678 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H](C)C3)cc2F)CC1 ZINC000742369673 1131716100 /nfs/dbraw/zinc/71/61/00/1131716100.db2.gz CRWWISJJBCNWSR-SJLPKXTDSA-N 2 0 333.495 3.636 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3cccs3)C3CC3)cc2)CC1 ZINC000771823376 1133601673 /nfs/dbraw/zinc/60/16/73/1133601673.db2.gz MRWLMCVPYPUUJH-HXUWFJFHSA-N 2 0 341.524 3.741 20 10 EHCDRP CC(C)(C[NH2+]Cc1ccc(N2CCCCC2)cc1)C[NH+]1CCCC1 ZINC000791011690 1134496340 /nfs/dbraw/zinc/49/63/40/1134496340.db2.gz XPWTXUOUSBYSCK-UHFFFAOYSA-N 2 0 329.532 3.889 20 10 EHCDRP COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1O ZINC000809738881 1135883241 /nfs/dbraw/zinc/88/32/41/1135883241.db2.gz NRAOQXHAJVYMKY-UHFFFAOYSA-N 2 0 348.874 3.748 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2cc(OC)ccc2O)CC1)CC(C)C ZINC000809755125 1135886825 /nfs/dbraw/zinc/88/68/25/1135886825.db2.gz DZBVBDRGCWKWCO-UHFFFAOYSA-N 2 0 348.531 3.981 20 10 EHCDRP CN(c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1)C1CCCCC1 ZINC000817897607 1136844122 /nfs/dbraw/zinc/84/41/22/1136844122.db2.gz SWSMHYHTKQFGSR-DFNIBXOVSA-N 2 0 327.516 3.828 20 10 EHCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976970 1136854431 /nfs/dbraw/zinc/85/44/31/1136854431.db2.gz XXYHXLABTIZTHU-TZIWHRDSSA-N 2 0 336.479 3.798 20 10 EHCDRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817979733 1136855021 /nfs/dbraw/zinc/85/50/21/1136855021.db2.gz DRHDKAOXKGSIGG-ZFWWWQNUSA-N 2 0 330.394 3.984 20 10 EHCDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000844928657 1137263404 /nfs/dbraw/zinc/26/34/04/1137263404.db2.gz XTAOJTFAMBMIRW-INIZCTEOSA-N 2 0 333.495 3.856 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cc(Br)ccc1O ZINC000873241850 1137595032 /nfs/dbraw/zinc/59/50/32/1137595032.db2.gz GPGAXSZBZYNENR-WCQYABFASA-N 2 0 341.293 3.584 20 10 EHCDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000126196921 1137663100 /nfs/dbraw/zinc/66/31/00/1137663100.db2.gz SRMUMTFEBYEUQC-MRXNPFEDSA-N 2 0 333.495 3.808 20 10 EHCDRP C[C@@H]([NH2+]C/C=C/C[NH2+][C@H](C)c1ccccc1O)c1ccccc1O ZINC000879649430 1137753642 /nfs/dbraw/zinc/75/36/42/1137753642.db2.gz SPINCFCSGOXIAP-XLBHYRNJSA-N 2 0 326.440 3.655 20 10 EHCDRP Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883289202 1137852805 /nfs/dbraw/zinc/85/28/05/1137852805.db2.gz HMSCGIVHAARCDJ-MRXNPFEDSA-N 2 0 329.513 3.659 20 10 EHCDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000185356179 1140146544 /nfs/dbraw/zinc/14/65/44/1140146544.db2.gz SDKOESBPAPHRCF-LBPRGKRZSA-N 2 0 341.293 3.537 20 10 EHCDRP COc1cc(C)cc(C[NH+]2CCC(CCCn3ccnc3)CC2)c1O ZINC000782944143 1016801766 /nfs/dbraw/zinc/80/17/66/1016801766.db2.gz DTGKXVRALWEBAN-UHFFFAOYSA-N 2 0 343.471 3.598 20 10 EHCDRP CN(C)c1ccc(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c2ccccc21 ZINC001279217809 1016981484 /nfs/dbraw/zinc/98/14/84/1016981484.db2.gz CLQYVSFCMTWOOW-UHFFFAOYSA-N 2 0 337.511 3.824 20 10 EHCDRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C)cc1O ZINC000280265785 1020234054 /nfs/dbraw/zinc/23/40/54/1020234054.db2.gz XNXRHJHSBMZYFS-XUVXKRRUSA-N 2 0 346.515 3.509 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000359879025 1027868563 /nfs/dbraw/zinc/86/85/63/1027868563.db2.gz YYVNJXBPSOXZMU-XPIZARPCSA-N 2 0 340.467 3.744 20 10 EHCDRP CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)c1cc(Br)ccc1O ZINC000229546822 1034233455 /nfs/dbraw/zinc/23/34/55/1034233455.db2.gz QTSIDPCIHOCESK-HNNXBMFYSA-N 2 0 343.309 3.926 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC000192846877 1036557260 /nfs/dbraw/zinc/55/72/60/1036557260.db2.gz PEWPBFGLNNNVOD-VCSGRIEYSA-N 2 0 327.516 3.638 20 10 EHCDRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000155627707 1040831318 /nfs/dbraw/zinc/83/13/18/1040831318.db2.gz DAMRAHLZLPEIEH-FPOVZHCZSA-N 2 0 338.495 3.998 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC[NH2+]C(C)C)c1O ZINC000817951894 1127617738 /nfs/dbraw/zinc/61/77/38/1127617738.db2.gz BJVAEPZNBBJZBF-LBPRGKRZSA-N 2 0 329.282 3.502 20 10 EHCDRP Cc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000739875997 1131512802 /nfs/dbraw/zinc/51/28/02/1131512802.db2.gz LMFQRVWFXRFMKL-QGZVFWFLSA-N 2 0 330.516 3.916 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379636041 1132177982 /nfs/dbraw/zinc/17/79/82/1132177982.db2.gz WXMJZNCBOXBMBP-DLBZAZTESA-N 2 0 342.483 3.962 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000769466917 1133296440 /nfs/dbraw/zinc/29/64/40/1133296440.db2.gz PDWMAOLFPRSHSR-FQEVSTJZSA-N 2 0 329.532 3.983 20 10 EHCDRP CCN(C)c1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000773840937 1133342098 /nfs/dbraw/zinc/34/20/98/1133342098.db2.gz VDLJKPITZRAPIZ-IEBWSBKVSA-N 2 0 329.532 3.885 20 10 EHCDRP CC[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccccc1O ZINC000775501919 1134965502 /nfs/dbraw/zinc/96/55/02/1134965502.db2.gz MWDNOXPLJIRQDT-FQEVSTJZSA-N 2 0 342.483 3.616 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000775645415 1135392094 /nfs/dbraw/zinc/39/20/94/1135392094.db2.gz KUUXUKJSQLIJAZ-JOCHJYFZSA-N 2 0 335.495 3.776 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]3c3cccc(F)c3)cc2)CC1 ZINC000775724765 1135580770 /nfs/dbraw/zinc/58/07/70/1135580770.db2.gz KLHZZVUVCPXPQJ-OAQYLSRUSA-N 2 0 339.458 3.525 20 10 EHCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000850098983 1136211018 /nfs/dbraw/zinc/21/10/18/1136211018.db2.gz PXEPIULDIYGVIT-OAHLLOKOSA-N 2 0 334.504 3.520 20 10 EHCDRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578241 1136613612 /nfs/dbraw/zinc/61/36/12/1136613612.db2.gz KGBMLPNSHCLWFO-FPOVZHCZSA-N 2 0 338.495 3.998 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCC2)cc1 ZINC000817985834 1136855344 /nfs/dbraw/zinc/85/53/44/1136855344.db2.gz NITKKWNTNJODJO-FRYIKTPZSA-N 2 0 327.516 3.716 20 10 EHCDRP CCOCc1cc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)ccc1OC ZINC000865765927 1137310129 /nfs/dbraw/zinc/31/01/29/1137310129.db2.gz SJVCOPDMJAMHCR-UHFFFAOYSA-N 2 0 334.504 3.584 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1O ZINC000873239141 1137594903 /nfs/dbraw/zinc/59/49/03/1137594903.db2.gz OPRDXWNOTZVTLN-YRGRVCCFSA-N 2 0 341.293 3.631 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1O ZINC000183489333 1140042385 /nfs/dbraw/zinc/04/23/85/1140042385.db2.gz WXHUGOQTGUYKEL-MRXNPFEDSA-N 2 0 328.456 3.574 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000184933507 1140126380 /nfs/dbraw/zinc/12/63/80/1140126380.db2.gz WHJQINPGYIDTTB-MRXNPFEDSA-N 2 0 340.467 3.847 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000185869824 1140174401 /nfs/dbraw/zinc/17/44/01/1140174401.db2.gz KGVUQZQKKMFOKD-INIZCTEOSA-N 2 0 325.456 3.663 20 10 EHCDRP CCCC[NH+]1CCC([NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000164474335 1021431944 /nfs/dbraw/zinc/43/19/44/1021431944.db2.gz PPVIRYUMXPFSOX-UHFFFAOYSA-N 2 0 345.531 3.518 20 10 EHCDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000044534535 1025936989 /nfs/dbraw/zinc/93/69/89/1025936989.db2.gz IINPGTBMAFFWDO-DOMZBBRYSA-N 2 0 341.293 3.537 20 10 EHCDRP Cc1cc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(O)c(C(C)(C)C)c1 ZINC000052569789 1030717413 /nfs/dbraw/zinc/71/74/13/1030717413.db2.gz NOLJZMSFWGHMFN-UHFFFAOYSA-N 2 0 339.483 3.715 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc(Br)ccc1O ZINC000227435067 1034001419 /nfs/dbraw/zinc/00/14/19/1034001419.db2.gz MWUBYAXQOFSKAZ-CYBMUJFWSA-N 2 0 341.293 3.509 20 10 EHCDRP CCCC[NH+]1CCC([NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000227441823 1034010112 /nfs/dbraw/zinc/01/01/12/1034010112.db2.gz WNFWMXZRUQUHQG-UHFFFAOYSA-N 2 0 341.293 3.509 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738107839 1131462748 /nfs/dbraw/zinc/46/27/48/1131462748.db2.gz ORQLGIBNZSJDNK-QZTJIDSGSA-N 2 0 342.527 3.967 20 10 EHCDRP CCOc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c(O)c1 ZINC000768301838 1133122397 /nfs/dbraw/zinc/12/23/97/1133122397.db2.gz COHUSWKJAYGECJ-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000774498860 1133689680 /nfs/dbraw/zinc/68/96/80/1133689680.db2.gz VGHVUYIVNPPOMF-OAHLLOKOSA-N 2 0 328.500 3.796 20 10 EHCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809767516 1135879400 /nfs/dbraw/zinc/87/94/00/1135879400.db2.gz NFYCSGRPFUIVSG-CTNGQTDRSA-N 2 0 327.516 3.593 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1F ZINC000809767404 1135879949 /nfs/dbraw/zinc/87/99/49/1135879949.db2.gz JYVJMLLHKBIOFR-PKOBYXMFSA-N 2 0 333.495 3.588 20 10 EHCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809767518 1135880073 /nfs/dbraw/zinc/88/00/73/1135880073.db2.gz NFYCSGRPFUIVSG-PZJWPPBQSA-N 2 0 327.516 3.593 20 10 EHCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1F ZINC000809738818 1135883334 /nfs/dbraw/zinc/88/33/34/1135883334.db2.gz LHQXTVVFXLSWLU-UHFFFAOYSA-N 2 0 329.463 3.585 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093130 1136508599 /nfs/dbraw/zinc/50/85/99/1136508599.db2.gz DCIFCCYJDNHUPY-OAQYLSRUSA-N 2 0 341.543 3.889 20 10 EHCDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964586 1136852207 /nfs/dbraw/zinc/85/22/07/1136852207.db2.gz FMOXKOCJPDWVLU-INIZCTEOSA-N 2 0 333.495 3.856 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])c1O ZINC000817975734 1136854456 /nfs/dbraw/zinc/85/44/56/1136854456.db2.gz AIAYUTPJCNRCGX-NEPJUHHUSA-N 2 0 329.282 3.631 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000858132281 1136942438 /nfs/dbraw/zinc/94/24/38/1136942438.db2.gz YSZXCRQYMBQAIF-IBGZPJMESA-N 2 0 329.532 3.885 20 10 EHCDRP Oc1cccc(Br)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000858168102 1136946119 /nfs/dbraw/zinc/94/61/19/1136946119.db2.gz NGTWWXPPSDLDLD-UHFFFAOYSA-N 2 0 341.293 3.510 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1O ZINC000846143941 1137338604 /nfs/dbraw/zinc/33/86/04/1137338604.db2.gz BFRHHIVNXNJRNI-GTPINHCMSA-N 2 0 332.488 3.849 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1O ZINC000846144591 1137338932 /nfs/dbraw/zinc/33/89/32/1137338932.db2.gz IAXZTHGPZILSFL-IRXDYDNUSA-N 2 0 342.483 3.962 20 10 EHCDRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1O ZINC000155626638 1018716711 /nfs/dbraw/zinc/71/67/11/1018716711.db2.gz PLKPBGHURRCGMT-HXUWFJFHSA-N 2 0 342.483 3.964 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000195138049 1032052494 /nfs/dbraw/zinc/05/24/94/1032052494.db2.gz CQTXVRVRKOJPAW-DOTOQJQBSA-N 2 0 328.431 3.704 20 10 EHCDRP COc1cc(Cl)cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1O ZINC000761192380 1034379100 /nfs/dbraw/zinc/37/91/00/1034379100.db2.gz MMBNMQQXRTZBAH-UHFFFAOYSA-N 2 0 340.895 3.606 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H](C)C3)cc2F)CC1 ZINC000742369671 1131716288 /nfs/dbraw/zinc/71/62/88/1131716288.db2.gz CRWWISJJBCNWSR-AEFFLSMTSA-N 2 0 333.495 3.636 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)CCCC2 ZINC000768463436 1133144605 /nfs/dbraw/zinc/14/46/05/1133144605.db2.gz TUPBJRJHYRPUAZ-WIYYLYMNSA-N 2 0 340.511 3.720 20 10 EHCDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001178249309 1133145129 /nfs/dbraw/zinc/14/51/29/1133145129.db2.gz MHLLCRGTKPBRAN-FQEVSTJZSA-N 2 0 329.532 3.744 20 10 EHCDRP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000793202368 1134866547 /nfs/dbraw/zinc/86/65/47/1134866547.db2.gz HWRIVVOBKXIIJS-IBGZPJMESA-N 2 0 341.474 3.503 20 10 EHCDRP CC[N@H+](CCc1cccs1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775656345 1135425484 /nfs/dbraw/zinc/42/54/84/1135425484.db2.gz FEUYIOFDLIDGEI-UHFFFAOYSA-N 2 0 343.540 3.565 20 10 EHCDRP C[C@H](CC[NH2+]Cc1ccc(N(C)C)c(F)c1)[N@H+](C)Cc1ccccc1 ZINC001200940985 1135971294 /nfs/dbraw/zinc/97/12/94/1135971294.db2.gz BQTYIMONFOKYJP-QGZVFWFLSA-N 2 0 343.490 3.892 20 10 EHCDRP CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cc(Br)ccc1O ZINC000854230060 1136600303 /nfs/dbraw/zinc/60/03/03/1136600303.db2.gz FQUXMQWDFXFBMM-ZIAGYGMSSA-N 2 0 329.282 3.569 20 10 EHCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000816642837 1136743912 /nfs/dbraw/zinc/74/39/12/1136743912.db2.gz MWCWOTIYBPDJAC-QFIPXVFZSA-N 2 0 336.479 3.977 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1O ZINC000817948449 1136850408 /nfs/dbraw/zinc/85/04/08/1136850408.db2.gz KGXCMYIXQDGODK-LBPRGKRZSA-N 2 0 349.272 3.507 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1O ZINC000817969507 1136853583 /nfs/dbraw/zinc/85/35/83/1136853583.db2.gz VKYPJDLNBVOJMM-NSHDSACASA-N 2 0 347.256 3.609 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)c1O ZINC000844924577 1137263138 /nfs/dbraw/zinc/26/31/38/1137263138.db2.gz MERWRBHLGGOFHI-GFCCVEGCSA-N 2 0 341.293 3.503 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1O ZINC000846140009 1137338396 /nfs/dbraw/zinc/33/83/96/1137338396.db2.gz CXMXAIMKRBZJQD-ZACQAIPSSA-N 2 0 334.504 3.810 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccs1 ZINC000883289336 1137852882 /nfs/dbraw/zinc/85/28/82/1137852882.db2.gz LEKPYGSKORAYES-SFHVURJKSA-N 2 0 329.513 3.741 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(O)c1C ZINC000273467929 1027444077 /nfs/dbraw/zinc/44/40/77/1027444077.db2.gz FDNAJCVOSIPLJW-QGZVFWFLSA-N 2 0 342.483 3.800 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c(O)c1C ZINC000273599587 1027513127 /nfs/dbraw/zinc/51/31/27/1027513127.db2.gz RPPSZXYJSMJAHX-BQFCYCMXSA-N 2 0 334.504 3.549 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000359879022 1027868003 /nfs/dbraw/zinc/86/80/03/1027868003.db2.gz YYVNJXBPSOXZMU-HZUJVAHNSA-N 2 0 340.467 3.744 20 10 EHCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169124018 1132665122 /nfs/dbraw/zinc/66/51/22/1132665122.db2.gz PJOJUOCAVOWUQZ-IHSNIMORSA-N 2 0 328.500 3.847 20 10 EHCDRP CN(C)c1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000769403729 1133278870 /nfs/dbraw/zinc/27/88/70/1133278870.db2.gz VIQGGJGILKRPCP-NRFANRHFSA-N 2 0 337.511 3.707 20 10 EHCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000769515383 1133306944 /nfs/dbraw/zinc/30/69/44/1133306944.db2.gz PQFDWGIWGVYTKU-HXUWFJFHSA-N 2 0 329.532 3.697 20 10 EHCDRP COc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC001199583214 1135915101 /nfs/dbraw/zinc/91/51/01/1135915101.db2.gz VWFZDLJGICOXNJ-MRXNPFEDSA-N 2 0 348.531 3.910 20 10 EHCDRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000810252087 1135948419 /nfs/dbraw/zinc/94/84/19/1135948419.db2.gz HWYCGJPCGDQAGC-GOSISDBHSA-N 2 0 335.561 3.621 20 10 EHCDRP Oc1ccccc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000816619369 1136742573 /nfs/dbraw/zinc/74/25/73/1136742573.db2.gz CUYBCKGGPZALRV-UHFFFAOYSA-N 2 0 336.479 3.880 20 10 EHCDRP CN(C)c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)c(C(F)(F)F)c1 ZINC000817416098 1136806551 /nfs/dbraw/zinc/80/65/51/1136806551.db2.gz IOKCTGLLQIXFIT-UHFFFAOYSA-N 2 0 343.437 3.734 20 10 EHCDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964588 1136852106 /nfs/dbraw/zinc/85/21/06/1136852106.db2.gz FMOXKOCJPDWVLU-MRXNPFEDSA-N 2 0 333.495 3.856 20 10 EHCDRP CC1([NH+]2CCCCC2)CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000872793827 1137584463 /nfs/dbraw/zinc/58/44/63/1137584463.db2.gz CPLQKNBRDZPFSF-UHFFFAOYSA-N 2 0 339.483 3.781 20 10 EHCDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc2c(cc1O)CCCC2 ZINC000873234127 1137594627 /nfs/dbraw/zinc/59/46/27/1137594627.db2.gz ALFIRNBQAJJWFV-OAHLLOKOSA-N 2 0 336.479 3.768 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)s1 ZINC000883289198 1137852801 /nfs/dbraw/zinc/85/28/01/1137852801.db2.gz HLMVXWIRXQYFMX-INIZCTEOSA-N 2 0 329.513 3.659 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc(F)ccc1F ZINC000883289453 1137852819 /nfs/dbraw/zinc/85/28/19/1137852819.db2.gz PHAJQDUAPYGWSO-HNNXBMFYSA-N 2 0 345.437 3.567 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc(F)ccc1O ZINC000185337073 1140145870 /nfs/dbraw/zinc/14/58/70/1140145870.db2.gz TWBOGDKVGILEQX-HNNXBMFYSA-N 2 0 346.446 3.713 20 10 EHCDRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000162550516 1028977264 /nfs/dbraw/zinc/97/72/64/1028977264.db2.gz OYDGZNKUOVBUEU-QGZVFWFLSA-N 2 0 341.499 3.544 20 10 EHCDRP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000195133536 1032046156 /nfs/dbraw/zinc/04/61/56/1032046156.db2.gz ZFRAFUZPLGEOIB-AEFFLSMTSA-N 2 0 340.467 3.574 20 10 EHCDRP Oc1ccc(F)cc1C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000311033665 1034026038 /nfs/dbraw/zinc/02/60/38/1034026038.db2.gz NTCSVRHIEOWGMY-SFHVURJKSA-N 2 0 342.458 3.923 20 10 EHCDRP CCOc1cccc(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC000922511246 1129558189 /nfs/dbraw/zinc/55/81/89/1129558189.db2.gz ZLVTTYUEYNVUGI-UHFFFAOYSA-N 2 0 332.488 3.678 20 10 EHCDRP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+]C1CCCCC1 ZINC000768668951 1133168867 /nfs/dbraw/zinc/16/88/67/1133168867.db2.gz BLCPFBUDIGSQOA-UHFFFAOYSA-N 2 0 327.516 3.641 20 10 EHCDRP CCN(C)c1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000773840941 1133343092 /nfs/dbraw/zinc/34/30/92/1133343092.db2.gz VDLJKPITZRAPIZ-MJGOQNOKSA-N 2 0 329.532 3.885 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)c3cccs3)cc2)CC1 ZINC000771840827 1133598540 /nfs/dbraw/zinc/59/85/40/1133598540.db2.gz GTHPLXUZNPZBHF-UHFFFAOYSA-N 2 0 329.513 3.525 20 10 EHCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792930697 1134827446 /nfs/dbraw/zinc/82/74/46/1134827446.db2.gz QNSAOQHBYGWINP-AWEZNQCLSA-N 2 0 343.437 3.593 20 10 EHCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1Cl ZINC000775643364 1135383462 /nfs/dbraw/zinc/38/34/62/1135383462.db2.gz WEGLIWQPOXKMGJ-UHFFFAOYSA-N 2 0 343.902 3.724 20 10 EHCDRP C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775647451 1135390323 /nfs/dbraw/zinc/39/03/23/1135390323.db2.gz WEEVZRIMKLFFBX-MRXNPFEDSA-N 2 0 341.524 3.619 20 10 EHCDRP Cc1ccc2oc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cc2c1 ZINC000850376899 1136244997 /nfs/dbraw/zinc/24/49/97/1136244997.db2.gz NJILHFJVMYIOJG-UHFFFAOYSA-N 2 0 349.478 3.783 20 10 EHCDRP CC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccc(C)cc1O ZINC000850483955 1136267533 /nfs/dbraw/zinc/26/75/33/1136267533.db2.gz ZDWICUXRXIWDCY-FQEVSTJZSA-N 2 0 346.515 3.632 20 10 EHCDRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)C1 ZINC000815578242 1136613647 /nfs/dbraw/zinc/61/36/47/1136613647.db2.gz KGBMLPNSHCLWFO-PZJWPPBQSA-N 2 0 338.495 3.998 20 10 EHCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817887627 1136841441 /nfs/dbraw/zinc/84/14/41/1136841441.db2.gz AVMIKPKROQRPRF-MJGOQNOKSA-N 2 0 347.572 3.640 20 10 EHCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCCC2)cc1 ZINC000817976944 1136854460 /nfs/dbraw/zinc/85/44/60/1136854460.db2.gz XJRVBHUSILBLGV-YLJYHZDGSA-N 2 0 327.516 3.860 20 10 EHCDRP CN(C)c1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)c(C(F)(F)F)c1 ZINC000824913949 1137156508 /nfs/dbraw/zinc/15/65/08/1137156508.db2.gz JXHRCNIAIAUMQG-UHFFFAOYSA-N 2 0 345.453 3.981 20 10 EHCDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc2c(cc1O)CCCC2 ZINC000873234123 1137594682 /nfs/dbraw/zinc/59/46/82/1137594682.db2.gz ALFIRNBQAJJWFV-HNNXBMFYSA-N 2 0 336.479 3.768 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2c1c(F)ccc2O ZINC000873235319 1137594770 /nfs/dbraw/zinc/59/47/70/1137594770.db2.gz KXENSIFTTLEGRD-SJKOYZFVSA-N 2 0 326.415 3.515 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccsc3)cc2F)CC1 ZINC000177972226 1139659588 /nfs/dbraw/zinc/65/95/88/1139659588.db2.gz MTOZOSOCBIEJMG-HNNXBMFYSA-N 2 0 347.503 3.880 20 10 EHCDRP C[NH+](C)CC[C@@H](NCc1ccc2ccccc2c1O)c1cccnc1 ZINC000896722704 1025905665 /nfs/dbraw/zinc/90/56/65/1025905665.db2.gz OQIMIWYHUNUYTE-HXUWFJFHSA-N 2 0 335.451 3.723 20 10 EHCDRP COc1cc(C)cc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1O ZINC000894320540 1026110448 /nfs/dbraw/zinc/11/04/48/1026110448.db2.gz NKYMREOYWVZRBD-UHFFFAOYSA-N 2 0 332.488 3.596 20 10 EHCDRP Cc1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1N1CCCCC1 ZINC001167646860 1028515890 /nfs/dbraw/zinc/51/58/90/1028515890.db2.gz IDOWLWHHRUXSPQ-RBBKRZOGSA-N 2 0 341.543 3.901 20 10 EHCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000271847157 1029198194 /nfs/dbraw/zinc/19/81/94/1029198194.db2.gz IBWBAJZEARTNCF-SFHVURJKSA-N 2 0 327.516 3.980 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311025299 1037172030 /nfs/dbraw/zinc/17/20/30/1037172030.db2.gz CAEJPLFBBKXWBC-NQIIRXRSSA-N 2 0 337.511 3.753 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000738067215 1131459490 /nfs/dbraw/zinc/45/94/90/1131459490.db2.gz IGXUEVZJXMQUCM-UHFFFAOYSA-N 2 0 330.516 3.825 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657800 1132241395 /nfs/dbraw/zinc/24/13/95/1132241395.db2.gz UMRBKAGKMSZGNO-NQIIRXRSSA-N 2 0 337.511 3.895 20 10 EHCDRP Cc1cc(O)c(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)cc1C(C)C ZINC000746644662 1133960421 /nfs/dbraw/zinc/96/04/21/1133960421.db2.gz BPFMFEYGMXKPMJ-SLYNCCJLSA-N 2 0 346.515 3.508 20 10 EHCDRP Oc1ccc(Cl)cc1CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000793242967 1134886745 /nfs/dbraw/zinc/88/67/45/1134886745.db2.gz SENIIJHJZOBVMZ-HDICACEKSA-N 2 0 342.870 3.609 20 10 EHCDRP COc1ccc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c(O)c1 ZINC000793390885 1134921485 /nfs/dbraw/zinc/92/14/85/1134921485.db2.gz TYJJNMXOBMCDDR-YJBOKZPZSA-N 2 0 332.488 3.534 20 10 EHCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)c1ccccc1 ZINC000793610702 1134971861 /nfs/dbraw/zinc/97/18/61/1134971861.db2.gz WKNDSIMSZAJEHI-UHFFFAOYSA-N 2 0 337.511 3.806 20 10 EHCDRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)C1 ZINC000793768044 1134986968 /nfs/dbraw/zinc/98/69/68/1134986968.db2.gz QAENZALRUVJBHE-OAQYLSRUSA-N 2 0 340.467 3.545 20 10 EHCDRP CCN(C)c1ccc(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1 ZINC001197194923 1135658449 /nfs/dbraw/zinc/65/84/49/1135658449.db2.gz YDSPJPDGZAOGRM-UHFFFAOYSA-N 2 0 331.548 3.943 20 10 EHCDRP Cc1ccc(O)c(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC000809703504 1135874235 /nfs/dbraw/zinc/87/42/35/1135874235.db2.gz LDMSROCJULFMKC-QFIPXVFZSA-N 2 0 336.479 3.799 20 10 EHCDRP Cc1cccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1O ZINC000809702929 1135874635 /nfs/dbraw/zinc/87/46/35/1135874635.db2.gz AXIPDOPCRWEMTD-JOCHJYFZSA-N 2 0 336.479 3.799 20 10 EHCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2c1c(F)ccc2O ZINC000853240683 1136521328 /nfs/dbraw/zinc/52/13/28/1136521328.db2.gz RAKBXHMHOUQYKI-UKPHBRMFSA-N 2 0 332.463 3.791 20 10 EHCDRP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC000816642400 1136743423 /nfs/dbraw/zinc/74/34/23/1136743423.db2.gz YMDRXAOOFMICBZ-NRFANRHFSA-N 2 0 327.516 3.595 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1O ZINC000817948448 1136850465 /nfs/dbraw/zinc/85/04/65/1136850465.db2.gz KGXCMYIXQDGODK-GFCCVEGCSA-N 2 0 349.272 3.507 20 10 EHCDRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817981341 1136854916 /nfs/dbraw/zinc/85/49/16/1136854916.db2.gz REMXTAFGKBCAPA-HIFRSBDPSA-N 2 0 341.293 3.728 20 10 EHCDRP C[NH+](C)Cc1cccc(C[NH2+]Cc2c(O)cccc2Br)c1 ZINC000858091530 1136938671 /nfs/dbraw/zinc/93/86/71/1136938671.db2.gz AHNPZCALQFMGEQ-UHFFFAOYSA-N 2 0 349.272 3.506 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000846140005 1137338506 /nfs/dbraw/zinc/33/85/06/1137338506.db2.gz CXMXAIMKRBZJQD-IXDOHACOSA-N 2 0 334.504 3.810 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000152385097 1139089099 /nfs/dbraw/zinc/08/90/99/1139089099.db2.gz YEIFFRBBNYANTO-DLBZAZTESA-N 2 0 345.506 3.951 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(Cl)ccc1O ZINC000185054854 1140134076 /nfs/dbraw/zinc/13/40/76/1140134076.db2.gz FNGOHJNFXRYITF-AWEZNQCLSA-N 2 0 348.874 3.837 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c1C ZINC000273599589 1027512793 /nfs/dbraw/zinc/51/27/93/1027512793.db2.gz RPPSZXYJSMJAHX-JZXOWHBKSA-N 2 0 334.504 3.549 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000359879023 1027867383 /nfs/dbraw/zinc/86/73/83/1027867383.db2.gz YYVNJXBPSOXZMU-LUQKVYGDSA-N 2 0 340.467 3.744 20 10 EHCDRP Cc1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1N1CCCCC1 ZINC001167646858 1028512601 /nfs/dbraw/zinc/51/26/01/1028512601.db2.gz IDOWLWHHRUXSPQ-IRLDBZIGSA-N 2 0 341.543 3.901 20 10 EHCDRP COc1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000164518817 1035652684 /nfs/dbraw/zinc/65/26/84/1035652684.db2.gz LXOYKAVWRAXHEL-DNVCBOLYSA-N 2 0 346.515 3.614 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1CC[NH+](C)CC1 ZINC000157521929 1037672936 /nfs/dbraw/zinc/67/29/36/1037672936.db2.gz UGHAATPMZMDVKF-GOSISDBHSA-N 2 0 329.532 3.743 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000765406056 1127608163 /nfs/dbraw/zinc/60/81/63/1127608163.db2.gz LZIOFXFGGUXCDC-OTWHNJEPSA-N 2 0 347.547 3.683 20 10 EHCDRP CC[C@H]([NH2+]CC(C)(C)N1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000765857711 1128617399 /nfs/dbraw/zinc/61/73/99/1128617399.db2.gz DWNGAGCJXYJFHY-FQEVSTJZSA-N 2 0 347.547 3.683 20 10 EHCDRP CC(C)(C)[NH+]1CCC([NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000227438419 1120883254 /nfs/dbraw/zinc/88/32/54/1120883254.db2.gz PEEUEECPWRXNOO-UHFFFAOYSA-N 2 0 341.293 3.507 20 10 EHCDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000738071759 1131460105 /nfs/dbraw/zinc/46/01/05/1131460105.db2.gz VYBWKCWJZYIFGS-UHFFFAOYSA-N 2 0 348.531 3.949 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379636045 1132178068 /nfs/dbraw/zinc/17/80/68/1132178068.db2.gz WXMJZNCBOXBMBP-IRXDYDNUSA-N 2 0 342.483 3.962 20 10 EHCDRP CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177641470 1133089344 /nfs/dbraw/zinc/08/93/44/1133089344.db2.gz DJXZQVITBVSEGW-CTNGQTDRSA-N 2 0 329.532 3.887 20 10 EHCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCCC2 ZINC000768463429 1133144166 /nfs/dbraw/zinc/14/41/66/1133144166.db2.gz TUPBJRJHYRPUAZ-GHTZIAJQSA-N 2 0 340.511 3.720 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC(C)(C)C3)cc2)CC1 ZINC001178962725 1133217084 /nfs/dbraw/zinc/21/70/84/1133217084.db2.gz PTYPQICXIGAAFT-IBGZPJMESA-N 2 0 329.532 3.744 20 10 EHCDRP C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C[NH+]1CCCC1 ZINC000792919327 1134825095 /nfs/dbraw/zinc/82/50/95/1134825095.db2.gz FYHCVAQEOAYWBN-AWEZNQCLSA-N 2 0 343.437 3.593 20 10 EHCDRP C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648225 1135397053 /nfs/dbraw/zinc/39/70/53/1135397053.db2.gz AXJOTKDJVXQLNV-KRWDZBQOSA-N 2 0 341.474 3.771 20 10 EHCDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc3c(c2)CCN3Cc2ccccc2)C1 ZINC000809576511 1135852752 /nfs/dbraw/zinc/85/27/52/1135852752.db2.gz BPBFYSJLDRWDGS-OAQYLSRUSA-N 2 0 349.522 3.633 20 10 EHCDRP COc1ccc(N2CCC([NH2+][C@@H](C)C[C@H]3CCCCC[NH2+]3)CC2)cc1 ZINC000817903906 1136844450 /nfs/dbraw/zinc/84/44/50/1136844450.db2.gz WUGFOEDIKHENRZ-PKOBYXMFSA-N 2 0 345.531 3.564 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)c1O ZINC000817981519 1136854879 /nfs/dbraw/zinc/85/48/79/1136854879.db2.gz SPGWFOJSHPZTJE-OCCSQVGLSA-N 2 0 341.293 3.646 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(C(F)(F)F)cc1O ZINC000817987763 1136855367 /nfs/dbraw/zinc/85/53/67/1136855367.db2.gz WTCSEUWAUPKMLY-FIRUKDTASA-N 2 0 342.405 3.840 20 10 EHCDRP CC1(C)C[C@@H]([NH2+]Cc2ccc(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001171984678 1137527510 /nfs/dbraw/zinc/52/75/10/1137527510.db2.gz XLJLMLXXTNZKPN-SFHVURJKSA-N 2 0 340.467 3.631 20 10 EHCDRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1c(C)cccc1O ZINC000876936758 1137665759 /nfs/dbraw/zinc/66/57/59/1137665759.db2.gz MSQATOUCHVVHLG-UHFFFAOYSA-N 2 0 342.483 3.711 20 10 EHCDRP Oc1cccc(Cl)c1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000113315485 1137912622 /nfs/dbraw/zinc/91/26/22/1137912622.db2.gz DFNOTIARZLNVIV-UHFFFAOYSA-N 2 0 330.859 3.931 20 10 EHCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462686 1139091625 /nfs/dbraw/zinc/09/16/25/1139091625.db2.gz KERLKKFVTIQCGY-QZTJIDSGSA-N 2 0 327.516 3.812 20 10 EHCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462588 1139092613 /nfs/dbraw/zinc/09/26/13/1139092613.db2.gz KERLKKFVTIQCGY-ZWKOTPCHSA-N 2 0 327.516 3.812 20 10 EHCDRP Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000157919190 1033162609 /nfs/dbraw/zinc/16/26/09/1033162609.db2.gz PDMATAAOMUJRTK-UTKZUKDTSA-N 2 0 336.479 3.994 20 10 EHCDRP Cc1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1N1CCCCC1 ZINC001167646850 1028513462 /nfs/dbraw/zinc/51/34/62/1028513462.db2.gz IDOWLWHHRUXSPQ-IFMALSPDSA-N 2 0 341.543 3.901 20 10 EHCDRP COc1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(O)c(C(C)(C)C)c1 ZINC000164518948 1035651456 /nfs/dbraw/zinc/65/14/56/1035651456.db2.gz LXOYKAVWRAXHEL-BEFAXECRSA-N 2 0 346.515 3.614 20 10 EHCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000185038898 1126746288 /nfs/dbraw/zinc/74/62/88/1126746288.db2.gz PCYXDNKPVOLVNE-ULQDDVLXSA-N 2 0 334.504 3.810 20 10 EHCDRP Cc1cc(CC[NH2+][C@H](C)C2CC[NH+](C)CC2)c(C)n1-c1ccccc1 ZINC000764716168 1127525518 /nfs/dbraw/zinc/52/55/18/1127525518.db2.gz JLBQHQJJLVALQU-GOSISDBHSA-N 2 0 339.527 3.957 20 10 EHCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000765406055 1127608446 /nfs/dbraw/zinc/60/84/46/1127608446.db2.gz LZIOFXFGGUXCDC-FHWLQOOXSA-N 2 0 347.547 3.683 20 10 EHCDRP CCC[NH+](C)Cc1c(O)ccc2ccc(O)c(C[N@@H+](C)CCC)c21 ZINC000069062144 1124102827 /nfs/dbraw/zinc/10/28/27/1124102827.db2.gz MKBQPPAHUOCUKJ-UHFFFAOYSA-N 2 0 330.472 3.935 20 10 EHCDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444490 1133140112 /nfs/dbraw/zinc/14/01/12/1133140112.db2.gz CBHGRDHLYXWHLK-UHFFFAOYSA-N 2 0 330.516 3.823 20 10 EHCDRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(O)c1 ZINC000769317603 1133260481 /nfs/dbraw/zinc/26/04/81/1133260481.db2.gz TVIDEUYKZMXATN-SFHVURJKSA-N 2 0 346.515 3.879 20 10 EHCDRP Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775650008 1135416968 /nfs/dbraw/zinc/41/69/68/1135416968.db2.gz WOHQWYSRXPEYFI-LJQANCHMSA-N 2 0 337.511 3.940 20 10 EHCDRP COc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850240491 1136225708 /nfs/dbraw/zinc/22/57/08/1136225708.db2.gz RGRUQLSOBYETOB-UHFFFAOYSA-N 2 0 334.504 3.520 20 10 EHCDRP COc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c(O)c(C(C)(C)C)c1 ZINC000850323869 1136235118 /nfs/dbraw/zinc/23/51/18/1136235118.db2.gz HIHAWYWHNXBNIN-HNNXBMFYSA-N 2 0 334.504 3.520 20 10 EHCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000817977012 1136854246 /nfs/dbraw/zinc/85/42/46/1136854246.db2.gz ZJZNPHXQXWQCKS-BEFAXECRSA-N 2 0 331.479 3.609 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817987138 1136855565 /nfs/dbraw/zinc/85/55/65/1136855565.db2.gz WRVAEYMTTSLUNH-DSLXNQLJSA-N 2 0 345.506 3.855 20 10 EHCDRP Cc1ccc(C[NH2+]C[C@@H]2CCCN(C)[C@H]2c2cccs2)c(O)c1 ZINC000877056111 1137668865 /nfs/dbraw/zinc/66/88/65/1137668865.db2.gz YPPVDBRTOFLTKJ-QFBILLFUSA-N 2 0 330.497 3.935 20 10 EHCDRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)s1 ZINC000883289477 1137852778 /nfs/dbraw/zinc/85/27/78/1137852778.db2.gz PUUDOBMREZABPK-MRXNPFEDSA-N 2 0 343.540 3.968 20 10 EHCDRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1cc(Br)ccc1O ZINC000049553243 1014354806 /nfs/dbraw/zinc/35/48/06/1014354806.db2.gz ZRDCLAWAGDAZPY-RISCZKNCSA-N 2 0 329.282 3.536 20 10 EHCDRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Br)ccc1O ZINC000020129062 1025775533 /nfs/dbraw/zinc/77/55/33/1025775533.db2.gz CXBOXAMCDFLSQF-OAHLLOKOSA-N 2 0 341.293 3.681 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(O)c1C ZINC000273351934 1027390706 /nfs/dbraw/zinc/39/07/06/1027390706.db2.gz CATRBFDFZANKQP-KRWDZBQOSA-N 2 0 339.483 3.971 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(O)c1C ZINC000273467927 1027442309 /nfs/dbraw/zinc/44/23/09/1027442309.db2.gz FDNAJCVOSIPLJW-KRWDZBQOSA-N 2 0 342.483 3.800 20 10 EHCDRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000131286118 1027757761 /nfs/dbraw/zinc/75/77/61/1027757761.db2.gz GYHTVHLRDUOAIZ-SFHVURJKSA-N 2 0 347.547 3.764 20 10 EHCDRP COc1cc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000164533288 1035656474 /nfs/dbraw/zinc/65/64/74/1035656474.db2.gz PBZAUHYMVKAOEP-BEFAXECRSA-N 2 0 346.515 3.614 20 10 EHCDRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000044515711 1040964313 /nfs/dbraw/zinc/96/43/13/1040964313.db2.gz NKWDVDGYSWYUEW-HNNXBMFYSA-N 2 0 341.293 3.537 20 10 EHCDRP CCOCc1cc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)ccc1OC ZINC000922847972 1129690204 /nfs/dbraw/zinc/69/02/04/1129690204.db2.gz IQMIVAFNNOQPJV-UHFFFAOYSA-N 2 0 346.515 3.728 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738066805 1131459538 /nfs/dbraw/zinc/45/95/38/1131459538.db2.gz GAFLABSRMQGIJR-UHFFFAOYSA-N 2 0 341.499 3.884 20 10 EHCDRP CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177641471 1133089683 /nfs/dbraw/zinc/08/96/83/1133089683.db2.gz DJXZQVITBVSEGW-FPOVZHCZSA-N 2 0 329.532 3.887 20 10 EHCDRP COc1cc(C[NH2+]CCC[N@H+](C)CC(C)C)c(O)c(C(C)(C)C)c1 ZINC001179082598 1133227164 /nfs/dbraw/zinc/22/71/64/1133227164.db2.gz ZSMROLUKXDHWPX-UHFFFAOYSA-N 2 0 336.520 3.766 20 10 EHCDRP CN(C)c1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000769403731 1133278572 /nfs/dbraw/zinc/27/85/72/1133278572.db2.gz VIQGGJGILKRPCP-OAQYLSRUSA-N 2 0 337.511 3.707 20 10 EHCDRP CC[N@H+](Cc1cccs1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775644326 1135384840 /nfs/dbraw/zinc/38/48/40/1135384840.db2.gz HFNFZPBGCPVKNY-UHFFFAOYSA-N 2 0 329.513 3.522 20 10 EHCDRP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1O ZINC000775740350 1135599033 /nfs/dbraw/zinc/59/90/33/1135599033.db2.gz VGXGBWKSPJOHQP-KDOFPFPSSA-N 2 0 334.891 3.803 20 10 EHCDRP CC[NH+]1CCC(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850118795 1136212627 /nfs/dbraw/zinc/21/26/27/1136212627.db2.gz IUMKYWBFUCTMNY-UHFFFAOYSA-N 2 0 334.504 3.520 20 10 EHCDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817887625 1136841512 /nfs/dbraw/zinc/84/15/12/1136841512.db2.gz AVMIKPKROQRPRF-HKUYNNGSSA-N 2 0 347.572 3.640 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1O ZINC000817966947 1136853408 /nfs/dbraw/zinc/85/34/08/1136853408.db2.gz ZZKMTNVKNOEOEV-LRDDRELGSA-N 2 0 341.293 3.503 20 10 EHCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000817986841 1136855447 /nfs/dbraw/zinc/85/54/47/1136855447.db2.gz UOMHTFDQNWPBMC-OAQYLSRUSA-N 2 0 336.479 3.966 20 10 EHCDRP Cc1ccc(O)c(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)c1 ZINC000862478540 1137145834 /nfs/dbraw/zinc/14/58/34/1137145834.db2.gz JEXRLWVTHVFSFY-GOSISDBHSA-N 2 0 338.495 3.886 20 10 EHCDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000844928658 1137263316 /nfs/dbraw/zinc/26/33/16/1137263316.db2.gz XTAOJTFAMBMIRW-MRXNPFEDSA-N 2 0 333.495 3.856 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846167576 1137337385 /nfs/dbraw/zinc/33/73/85/1137337385.db2.gz KXYXHUFTZHJKAM-AEFFLSMTSA-N 2 0 340.467 3.574 20 10 EHCDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000126196786 1137663107 /nfs/dbraw/zinc/66/31/07/1137663107.db2.gz SRMUMTFEBYEUQC-INIZCTEOSA-N 2 0 333.495 3.808 20 10 EHCDRP Oc1cc(Br)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000826016031 1137701144 /nfs/dbraw/zinc/70/11/44/1137701144.db2.gz FMHKNOAZBOIRMW-UHFFFAOYSA-N 2 0 341.293 3.510 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccsc3)cc2F)CC1 ZINC000177972236 1139659682 /nfs/dbraw/zinc/65/96/82/1139659682.db2.gz MTOZOSOCBIEJMG-OAHLLOKOSA-N 2 0 347.503 3.880 20 10 EHCDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000185869805 1140174459 /nfs/dbraw/zinc/17/44/59/1140174459.db2.gz KGVUQZQKKMFOKD-MRXNPFEDSA-N 2 0 325.456 3.663 20 10 EHCDRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C)cc1O ZINC000280291795 1020259297 /nfs/dbraw/zinc/25/92/97/1020259297.db2.gz ZFUDVBHEZOIBOO-HXUWFJFHSA-N 2 0 342.483 3.882 20 10 EHCDRP Cc1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1N1CCCCC1 ZINC001167646862 1028517171 /nfs/dbraw/zinc/51/71/71/1028517171.db2.gz IDOWLWHHRUXSPQ-UNMCSNQZSA-N 2 0 341.543 3.901 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000236916698 1040187983 /nfs/dbraw/zinc/18/79/83/1040187983.db2.gz UZJWGKAZPDUYFD-OALUTQOASA-N 2 0 347.547 3.512 20 10 EHCDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000185337334 1126868418 /nfs/dbraw/zinc/86/84/18/1126868418.db2.gz QIZNJOYUBUFALP-ICSRJNTNSA-N 2 0 338.495 3.916 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000769149212 1133234961 /nfs/dbraw/zinc/23/49/61/1133234961.db2.gz YYUZDEZTAPJPTL-SFHVURJKSA-N 2 0 346.515 3.735 20 10 EHCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769471870 1133297864 /nfs/dbraw/zinc/29/78/64/1133297864.db2.gz XPPGXPWCYYWZSW-WIYYLYMNSA-N 2 0 329.532 3.982 20 10 EHCDRP CCOc1ccc(O)c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000769513401 1133306342 /nfs/dbraw/zinc/30/63/42/1133306342.db2.gz DBGNTNTZEZGNMD-UHFFFAOYSA-N 2 0 346.515 3.879 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000771844328 1133598448 /nfs/dbraw/zinc/59/84/48/1133598448.db2.gz SKCKBEYICGGVOI-HNNXBMFYSA-N 2 0 345.437 3.567 20 10 EHCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001190827882 1134756056 /nfs/dbraw/zinc/75/60/56/1134756056.db2.gz QHGPMIJZFGMHTH-FQEVSTJZSA-N 2 0 329.532 3.841 20 10 EHCDRP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000793202369 1134866709 /nfs/dbraw/zinc/86/67/09/1134866709.db2.gz HWRIVVOBKXIIJS-LJQANCHMSA-N 2 0 341.474 3.503 20 10 EHCDRP CC[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000850583953 1136293412 /nfs/dbraw/zinc/29/34/12/1136293412.db2.gz OSOPMAASEOEOQR-OAQYLSRUSA-N 2 0 329.532 3.915 20 10 EHCDRP Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000817957986 1136852171 /nfs/dbraw/zinc/85/21/71/1136852171.db2.gz RTRHUFPJEVXNMH-YMPZKCBVSA-N 2 0 349.522 3.702 20 10 EHCDRP C[C@@H]1CCCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2Cl)C1 ZINC000817930283 1136852653 /nfs/dbraw/zinc/85/26/53/1136852653.db2.gz NSFNIXXVKBYESA-NAZJXLNTSA-N 2 0 347.934 3.949 20 10 EHCDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794804493 1137255289 /nfs/dbraw/zinc/25/52/89/1137255289.db2.gz MXXAFPAXNCCPMS-LNLFQRSKSA-N 2 0 334.504 3.631 20 10 EHCDRP CCN(CC)c1ccc(C[NH2+]Cc2ccccc2C[NH2+]C)cc1F ZINC000844904367 1137261575 /nfs/dbraw/zinc/26/15/75/1137261575.db2.gz JIDITSMIYBDUIK-UHFFFAOYSA-N 2 0 329.463 3.681 20 10 EHCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(N3CCCCC3)cc1)C2 ZINC001172101677 1137532402 /nfs/dbraw/zinc/53/24/02/1137532402.db2.gz HPIREXKGGDLEAO-NUZGMZIFSA-N 2 0 327.516 3.782 20 10 EHCDRP Cc1ccc(C[NH2+]C[C@H]2CCCN(C)[C@H]2c2cccs2)c(O)c1 ZINC000877056113 1137668828 /nfs/dbraw/zinc/66/88/28/1137668828.db2.gz YPPVDBRTOFLTKJ-VQIMIIECSA-N 2 0 330.497 3.935 20 10 EHCDRP Cc1ccc(C[NH2+]C[C@H]2CCCN(C)[C@@H]2c2cccs2)c(O)c1 ZINC000877056108 1137668880 /nfs/dbraw/zinc/66/88/80/1137668880.db2.gz YPPVDBRTOFLTKJ-APWZRJJASA-N 2 0 330.497 3.935 20 10 EHCDRP CCN1CCC([NH2+][C@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000275299905 1016335527 /nfs/dbraw/zinc/33/55/27/1016335527.db2.gz HUXWTRDRVQINFR-GFCCVEGCSA-N 2 0 341.293 3.598 20 10 EHCDRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000166545699 1016650070 /nfs/dbraw/zinc/65/00/70/1016650070.db2.gz HRBWYJKZMZFNAM-TZIWHRDSSA-N 2 0 327.516 3.639 20 10 EHCDRP C[NH+](C)CC[C@H](NCc1ccc2ccccc2c1O)c1cccnc1 ZINC000896722703 1025905502 /nfs/dbraw/zinc/90/55/02/1025905502.db2.gz OQIMIWYHUNUYTE-FQEVSTJZSA-N 2 0 335.451 3.723 20 10 EHCDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000273478291 1027449140 /nfs/dbraw/zinc/44/91/40/1027449140.db2.gz TYOAVWPPIRXOET-LBPRGKRZSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Br)ccc1O ZINC000273478289 1027449698 /nfs/dbraw/zinc/44/96/98/1027449698.db2.gz TYOAVWPPIRXOET-GFCCVEGCSA-N 2 0 341.293 3.537 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000160529267 1030826786 /nfs/dbraw/zinc/82/67/86/1030826786.db2.gz KTXGWJSIXNMANW-QGZVFWFLSA-N 2 0 341.499 3.544 20 10 EHCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2c(O)ccc3ccc(OC)cc32)C1 ZINC000173450313 1033339217 /nfs/dbraw/zinc/33/92/17/1033339217.db2.gz VMRMJCAEKYCUEQ-MRXNPFEDSA-N 2 0 342.483 3.718 20 10 EHCDRP C[N@H+](Cc1ccc(N2CCCC2)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168393136 1036584502 /nfs/dbraw/zinc/58/45/02/1036584502.db2.gz XARMATVENTUYRS-UHFFFAOYSA-N 2 0 327.516 3.593 20 10 EHCDRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765406929 1127608154 /nfs/dbraw/zinc/60/81/54/1127608154.db2.gz WRDZNPKNNGGVKH-UEXGIBASSA-N 2 0 347.547 3.683 20 10 EHCDRP CC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1cc(Br)ccc1O ZINC000083526330 1127641552 /nfs/dbraw/zinc/64/15/52/1127641552.db2.gz FQZZJZGUONYBMS-AWEZNQCLSA-N 2 0 343.309 3.783 20 10 EHCDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657803 1132242057 /nfs/dbraw/zinc/24/20/57/1132242057.db2.gz UMRBKAGKMSZGNO-WIYYLYMNSA-N 2 0 337.511 3.895 20 10 EHCDRP Cc1cccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1O ZINC000809702930 1135874252 /nfs/dbraw/zinc/87/42/52/1135874252.db2.gz AXIPDOPCRWEMTD-QFIPXVFZSA-N 2 0 336.479 3.799 20 10 EHCDRP CCOc1cccc(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)c1O ZINC000809739183 1135883510 /nfs/dbraw/zinc/88/35/10/1135883510.db2.gz AHCURUAUWJVIKB-UHFFFAOYSA-N 2 0 342.483 3.875 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815561149 1136610806 /nfs/dbraw/zinc/61/08/06/1136610806.db2.gz ZRNFZCLUXPUONW-AVGNSLFASA-N 2 0 328.378 3.688 20 10 EHCDRP COc1ccc(N2CCC([NH2+][C@H](C)C[C@H]3CCCCC[NH2+]3)CC2)cc1 ZINC000817903904 1136844433 /nfs/dbraw/zinc/84/44/33/1136844433.db2.gz WUGFOEDIKHENRZ-IEBWSBKVSA-N 2 0 345.531 3.564 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1O ZINC000817946797 1136850055 /nfs/dbraw/zinc/85/00/55/1136850055.db2.gz DYKYQTZJSJOXRN-AVGNSLFASA-N 2 0 341.293 3.502 20 10 EHCDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817964396 1136852232 /nfs/dbraw/zinc/85/22/32/1136852232.db2.gz BEWQNWDTYHUBHN-OXJNMPFZSA-N 2 0 333.495 3.856 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000817977015 1136854100 /nfs/dbraw/zinc/85/41/00/1136854100.db2.gz ZJZNPHXQXWQCKS-KXBFYZLASA-N 2 0 331.479 3.609 20 10 EHCDRP CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Br)ccc1O ZINC000817976816 1136854266 /nfs/dbraw/zinc/85/42/66/1136854266.db2.gz UYMUZNPYXPPWTH-SMDDNHRTSA-N 2 0 329.282 3.713 20 10 EHCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976969 1136854367 /nfs/dbraw/zinc/85/43/67/1136854367.db2.gz XXYHXLABTIZTHU-PZJWPPBQSA-N 2 0 336.479 3.798 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Br)ccc1O ZINC000817976814 1136854375 /nfs/dbraw/zinc/85/43/75/1136854375.db2.gz UYMUZNPYXPPWTH-FZMZJTMJSA-N 2 0 329.282 3.713 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc2c(cc1O)CCCC2 ZINC000844924183 1137263200 /nfs/dbraw/zinc/26/32/00/1137263200.db2.gz NJRYPDCTGQRYFU-CYBMUJFWSA-N 2 0 328.431 3.720 20 10 EHCDRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185671099 1140162358 /nfs/dbraw/zinc/16/23/58/1140162358.db2.gz WJNBCQTXNNTETG-DOTOQJQBSA-N 2 0 330.472 3.553 20 10 EHCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cccs3)cc2F)CC1 ZINC000155267897 1016383868 /nfs/dbraw/zinc/38/38/68/1016383868.db2.gz MHHDQKAYWFFQDH-OAHLLOKOSA-N 2 0 347.503 3.880 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000248183253 1040714602 /nfs/dbraw/zinc/71/46/02/1040714602.db2.gz WWJSXRCRFGDMCE-UEXGIBASSA-N 2 0 347.547 3.540 20 10 EHCDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000764665055 1127520197 /nfs/dbraw/zinc/52/01/97/1127520197.db2.gz ATZSBNKETIBYCL-KRWDZBQOSA-N 2 0 333.495 3.953 20 10 EHCDRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768230565 1133115210 /nfs/dbraw/zinc/11/52/10/1133115210.db2.gz RUHZMEOTALNYRS-UHFFFAOYSA-N 2 0 329.532 3.982 20 10 EHCDRP CC(C)C1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001178004630 1133122943 /nfs/dbraw/zinc/12/29/43/1133122943.db2.gz IYOTZEPOCMGHFD-UHFFFAOYSA-N 2 0 329.532 3.743 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1O ZINC000769149255 1133234724 /nfs/dbraw/zinc/23/47/24/1133234724.db2.gz ZMHCOJRQERLQSD-QZTJIDSGSA-N 2 0 346.515 3.877 20 10 EHCDRP Oc1ccccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000770506216 1133435981 /nfs/dbraw/zinc/43/59/81/1133435981.db2.gz ZEZCULSJOMAONC-PZJWPPBQSA-N 2 0 336.479 3.879 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@]3(C)CCCc4ccccc43)cc2)CC1 ZINC000771855479 1133607424 /nfs/dbraw/zinc/60/74/24/1133607424.db2.gz ZTIAIGDMOIHYAY-QHCPKHFHSA-N 2 0 349.522 3.780 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(C4CC4)cc3)cc2)CC1 ZINC000790994550 1134490127 /nfs/dbraw/zinc/49/01/27/1134490127.db2.gz BDSUKFOJOANKIB-UHFFFAOYSA-N 2 0 335.495 3.606 20 10 EHCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792938914 1134820980 /nfs/dbraw/zinc/82/09/80/1134820980.db2.gz GXJPZINQWVUCJJ-CQSZACIVSA-N 2 0 343.437 3.593 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[N@H+](Cc3ccccc3)C3CC3)cc2)CC1 ZINC000775647831 1135398139 /nfs/dbraw/zinc/39/81/39/1135398139.db2.gz BXVIWFUAYNMDLM-UHFFFAOYSA-N 2 0 335.495 3.603 20 10 EHCDRP CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775735557 1135592238 /nfs/dbraw/zinc/59/22/38/1135592238.db2.gz SDXDVFAUCBFESM-PMACEKPBSA-N 2 0 347.572 3.544 20 10 EHCDRP C[NH+]1CCC(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CC1 ZINC000776265979 1136124800 /nfs/dbraw/zinc/12/48/00/1136124800.db2.gz SITWVWZHQROHOH-NRFANRHFSA-N 2 0 338.495 3.998 20 10 EHCDRP COc1cc(C[NH2+]C2CC[NH+](C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850012401 1136199386 /nfs/dbraw/zinc/19/93/86/1136199386.db2.gz KFUYYASKSNQXBI-UHFFFAOYSA-N 2 0 334.504 3.661 20 10 EHCDRP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000850120076 1136212418 /nfs/dbraw/zinc/21/24/18/1136212418.db2.gz VNWOFYAKWHYHQU-MRXNPFEDSA-N 2 0 348.531 3.908 20 10 EHCDRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2c1c(F)ccc2O ZINC000850581085 1136292103 /nfs/dbraw/zinc/29/21/03/1136292103.db2.gz CXRUYMRDEOKKDH-GUYCJALGSA-N 2 0 332.463 3.791 20 10 EHCDRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000817585179 1136825563 /nfs/dbraw/zinc/82/55/63/1136825563.db2.gz BZGBGLIQWATMOR-XGNXJENSSA-N 2 0 341.293 3.678 20 10 EHCDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817948337 1136850416 /nfs/dbraw/zinc/85/04/16/1136850416.db2.gz XZAYDBWPZQTPQV-XYJFISCASA-N 2 0 333.495 3.855 20 10 EHCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCCC2)cc1 ZINC000817976942 1136854558 /nfs/dbraw/zinc/85/45/58/1136854558.db2.gz XJRVBHUSILBLGV-PXNSSMCTSA-N 2 0 327.516 3.860 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1O ZINC000817979578 1136854963 /nfs/dbraw/zinc/85/49/63/1136854963.db2.gz LXVHWYZLVSILKN-DHSIGJKJSA-N 2 0 346.421 3.714 20 10 EHCDRP CC[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1O ZINC000873234310 1137594695 /nfs/dbraw/zinc/59/46/95/1137594695.db2.gz BDAWOMYEQNYDJL-GOSISDBHSA-N 2 0 330.859 3.932 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1O ZINC000155626533 1018713497 /nfs/dbraw/zinc/71/34/97/1018713497.db2.gz PLKPBGHURRCGMT-FQEVSTJZSA-N 2 0 342.483 3.964 20 10 EHCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2O)[C@H](C)C1 ZINC000280054355 1020039328 /nfs/dbraw/zinc/03/93/28/1020039328.db2.gz JUZXNMPHUFRTPF-HOJAQTOUSA-N 2 0 348.531 3.878 20 10 EHCDRP CCOc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1O ZINC000769318321 1133260654 /nfs/dbraw/zinc/26/06/54/1133260654.db2.gz UUQCSALYLHIWHS-SFHVURJKSA-N 2 0 346.515 3.879 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cc1F ZINC000771844333 1133598968 /nfs/dbraw/zinc/59/89/68/1133598968.db2.gz SKCKBEYICGGVOI-OAHLLOKOSA-N 2 0 345.437 3.567 20 10 EHCDRP C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F)C[NH+]1CCCC1 ZINC000792919328 1134825039 /nfs/dbraw/zinc/82/50/39/1134825039.db2.gz FYHCVAQEOAYWBN-CQSZACIVSA-N 2 0 343.437 3.593 20 10 EHCDRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3c4c(ccc3O)oc3c4CCCC3)C2)C1 ZINC000793768038 1134986915 /nfs/dbraw/zinc/98/69/15/1134986915.db2.gz QAENZALRUVJBHE-NRFANRHFSA-N 2 0 340.467 3.545 20 10 EHCDRP CC[N@H+](CCC1CC[NH+](Cc2cccc(OC)c2O)CC1)CC(C)C ZINC000809755995 1135887003 /nfs/dbraw/zinc/88/70/03/1135887003.db2.gz NLBCNZLGPYBNDA-UHFFFAOYSA-N 2 0 348.531 3.981 20 10 EHCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000809756895 1135887702 /nfs/dbraw/zinc/88/77/02/1135887702.db2.gz UXYUNMAJIHOAPP-OAQYLSRUSA-N 2 0 341.543 3.841 20 10 EHCDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241078 1136521312 /nfs/dbraw/zinc/52/13/12/1136521312.db2.gz UGJWCAGMNXFNAI-WIYYLYMNSA-N 2 0 329.532 3.915 20 10 EHCDRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1O ZINC000817585176 1136825282 /nfs/dbraw/zinc/82/52/82/1136825282.db2.gz BZGBGLIQWATMOR-LMWSTFAQSA-N 2 0 341.293 3.678 20 10 EHCDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1O ZINC000817969198 1136853909 /nfs/dbraw/zinc/85/39/09/1136853909.db2.gz RNTKQUSDAMIDEM-LLVKDONJSA-N 2 0 347.256 3.609 20 10 EHCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000817977014 1136854294 /nfs/dbraw/zinc/85/42/94/1136854294.db2.gz ZJZNPHXQXWQCKS-HNAYVOBHSA-N 2 0 331.479 3.609 20 10 EHCDRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817979730 1136854981 /nfs/dbraw/zinc/85/49/81/1136854981.db2.gz DRHDKAOXKGSIGG-HIFRSBDPSA-N 2 0 330.394 3.984 20 10 EHCDRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794804494 1137255294 /nfs/dbraw/zinc/25/52/94/1137255294.db2.gz MXXAFPAXNCCPMS-SCTDSRPQSA-N 2 0 334.504 3.631 20 10 EHCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)c1O ZINC000844924578 1137263128 /nfs/dbraw/zinc/26/31/28/1137263128.db2.gz MERWRBHLGGOFHI-LBPRGKRZSA-N 2 0 341.293 3.503 20 10 EHCDRP Cc1cc(N(C)C)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000122658494 1137457692 /nfs/dbraw/zinc/45/76/92/1137457692.db2.gz GGOSENHUHUSKMB-UHFFFAOYSA-N 2 0 329.532 3.948 20 10 EHCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(OC)c(C)cc2O)CC1 ZINC000160231472 1014625546 /nfs/dbraw/zinc/62/55/46/1014625546.db2.gz ZTIZEKOKNLOFGG-UHFFFAOYSA-N 2 0 334.504 3.653 20 10 EHCDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc(Br)ccc1O ZINC000044534537 1025937310 /nfs/dbraw/zinc/93/73/10/1025937310.db2.gz IINPGTBMAFFWDO-IUODEOHRSA-N 2 0 341.293 3.537 20 10 EHCDRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCN(c2ccc(OC)cc2C)CC1 ZINC001167841858 1043123251 /nfs/dbraw/zinc/12/32/51/1043123251.db2.gz SNLXAHUMTNFNHO-LJQANCHMSA-N 2 0 347.547 3.636 20 10 EHCDRP C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C[NH+]1CCCCC1 ZINC000324485209 1121925871 /nfs/dbraw/zinc/92/58/71/1121925871.db2.gz NECCXBWAZBLALG-IBGZPJMESA-N 2 0 329.532 3.889 20 10 EHCDRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(-c4ccccc4)ccc3O)CC[C@H]21 ZINC000770353653 1133420319 /nfs/dbraw/zinc/42/03/19/1133420319.db2.gz SXPKVFCUSBGZQM-TZIWHRDSSA-N 2 0 336.479 3.975 20 10 EHCDRP COc1cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)c(O)c(C(C)(C)C)c1 ZINC000850323065 1136234940 /nfs/dbraw/zinc/23/49/40/1136234940.db2.gz BXTQDMWHQQXDNA-UHFFFAOYSA-N 2 0 339.439 3.636 20 10 EHCDRP c1cc(N2CCCCC2)ccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850421563 1136255881 /nfs/dbraw/zinc/25/58/81/1136255881.db2.gz YNLYTRBRINAFTJ-UHFFFAOYSA-N 2 0 341.543 3.889 20 10 EHCDRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817947140 1136850304 /nfs/dbraw/zinc/85/03/04/1136850304.db2.gz LFQCSCJGHXGQFZ-HUBLWGQQSA-N 2 0 330.394 3.840 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817966465 1136853224 /nfs/dbraw/zinc/85/32/24/1136853224.db2.gz OJPBQIHOUUUDBW-ZBFHGGJFSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccoc1 ZINC000773146137 1137469878 /nfs/dbraw/zinc/46/98/78/1137469878.db2.gz ORRKTBDBICVBII-KRWDZBQOSA-N 2 0 339.483 3.662 20 10 EHCDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000152462383 1139091800 /nfs/dbraw/zinc/09/18/00/1139091800.db2.gz KERLKKFVTIQCGY-ROUUACIJSA-N 2 0 327.516 3.812 20 10 EHCDRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000113335136 1026549804 /nfs/dbraw/zinc/54/98/04/1026549804.db2.gz YRZBVGVCHONAHD-UHFFFAOYSA-N 2 0 348.874 3.666 20 10 EHCDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000155627795 1040830393 /nfs/dbraw/zinc/83/03/93/1040830393.db2.gz DAMRAHLZLPEIEH-PZJWPPBQSA-N 2 0 338.495 3.998 20 10 EHCDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000185337598 1126869440 /nfs/dbraw/zinc/86/94/40/1126869440.db2.gz VZTOXHUNYUBHKL-AZUAARDMSA-N 2 0 338.495 3.916 20 10 EHCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(O)c1 ZINC000185337578 1126869496 /nfs/dbraw/zinc/86/94/96/1126869496.db2.gz VZTOXHUNYUBHKL-UYAOXDASSA-N 2 0 338.495 3.916 20 10 EHCDRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)ccc1F ZINC000921745863 1128723522 /nfs/dbraw/zinc/72/35/22/1128723522.db2.gz QMGGIZAXGIXUHJ-UHFFFAOYSA-N 2 0 328.431 3.502 20 10 EHCDRP Cc1cc(O)c(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1C ZINC000769148735 1133233743 /nfs/dbraw/zinc/23/37/43/1133233743.db2.gz QQGNSBUXJDIIPJ-LJQANCHMSA-N 2 0 330.516 3.953 20 10 EHCDRP CCS[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775698712 1135532453 /nfs/dbraw/zinc/53/24/53/1135532453.db2.gz WGGWBNUFTKYYGS-HXUWFJFHSA-N 2 0 347.572 3.546 20 10 EHCDRP CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775735558 1135592090 /nfs/dbraw/zinc/59/20/90/1135592090.db2.gz SDXDVFAUCBFESM-UXHICEINSA-N 2 0 347.572 3.544 20 10 EHCDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001199329514 1135897953 /nfs/dbraw/zinc/89/79/53/1135897953.db2.gz USVZWFBYXHNNKS-RTBURBONSA-N 2 0 329.532 3.744 20 10 EHCDRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817966463 1136853184 /nfs/dbraw/zinc/85/31/84/1136853184.db2.gz OJPBQIHOUUUDBW-GOEBONIOSA-N 2 0 330.394 3.841 20 10 EHCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCCCC2)c(F)c1 ZINC000817977013 1136854575 /nfs/dbraw/zinc/85/45/75/1136854575.db2.gz ZJZNPHXQXWQCKS-DNVCBOLYSA-N 2 0 331.479 3.609 20 10 EHCDRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Br)ccc1O ZINC000817985082 1136855467 /nfs/dbraw/zinc/85/54/67/1136855467.db2.gz GRRBYLSLKZAIDM-HNNXBMFYSA-N 2 0 339.277 3.505 20 10 EHCDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846146059 1137338970 /nfs/dbraw/zinc/33/89/70/1137338970.db2.gz PQPZMLNKNFRFDL-OAHLLOKOSA-N 2 0 328.456 3.703 20 10 EHCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1O ZINC000846144485 1137339110 /nfs/dbraw/zinc/33/91/10/1137339110.db2.gz GXMVXQHRLRZNBI-HNNXBMFYSA-N 2 0 332.488 3.849 20 10 EHCDRP C[C@H]([NH2+]C/C=C/C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1O ZINC000879650273 1137753769 /nfs/dbraw/zinc/75/37/69/1137753769.db2.gz SPINCFCSGOXIAP-HABDOHHLSA-N 2 0 326.440 3.655 20 10 EHCDRP CC[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1O ZINC000902499886 1030935045 /nfs/dbraw/zinc/93/50/45/1030935045.db2.gz CFHQIQMZFOOQNG-WAOWUJCRSA-N 2 0 338.451 3.689 20 10 EHCDRP COc1cc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000164533154 1035656557 /nfs/dbraw/zinc/65/65/57/1035656557.db2.gz PBZAUHYMVKAOEP-KXBFYZLASA-N 2 0 346.515 3.614 20 10 EHCDRP C[NH+](C)CCCC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768464991 1133144496 /nfs/dbraw/zinc/14/44/96/1133144496.db2.gz HPBKNTSEPZFZDX-UHFFFAOYSA-N 2 0 330.516 3.825 20 10 EHCDRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000769147939 1133232316 /nfs/dbraw/zinc/23/23/16/1133232316.db2.gz IXVKCTWCJFCJCP-QUCCMNQESA-N 2 0 329.532 3.839 20 10 EHCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000769149008 1133235308 /nfs/dbraw/zinc/23/53/08/1133235308.db2.gz WUTABHWLPLUVDB-SFHVURJKSA-N 2 0 346.515 3.735 20 10 EHCDRP COc1cccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1O ZINC000769541491 1133300569 /nfs/dbraw/zinc/30/05/69/1133300569.db2.gz BYSULVDVIRGRSD-QGZVFWFLSA-N 2 0 346.515 3.877 20 10 EHCDRP CCN(C)c1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000773840942 1133342930 /nfs/dbraw/zinc/34/29/30/1133342930.db2.gz VDLJKPITZRAPIZ-PKOBYXMFSA-N 2 0 329.532 3.885 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)cc2)CC1 ZINC000771866954 1133603321 /nfs/dbraw/zinc/60/33/21/1133603321.db2.gz GFXYIXBZMAMSNO-FCHUYYIVSA-N 2 0 349.522 3.864 20 10 EHCDRP C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775680469 1135504438 /nfs/dbraw/zinc/50/44/38/1135504438.db2.gz FUCMHWGPQVDXGV-GOSISDBHSA-N 2 0 335.495 3.558 20 10 EHCDRP CCOCc1cc(CNCC[C@@H](C)[NH+]2CCCCC2)ccc1OC ZINC001201954088 1136077887 /nfs/dbraw/zinc/07/78/87/1136077887.db2.gz HDFRPXMLHQSRGX-QGZVFWFLSA-N 2 0 334.504 3.586 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)c3ccccc3F)cc2)CC1 ZINC000813792928 1136363688 /nfs/dbraw/zinc/36/36/88/1136363688.db2.gz ZZYRWVZGCAJULL-UHFFFAOYSA-N 2 0 341.474 3.602 20 10 EHCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)CC(F)(F)F)cc2)CC1 ZINC000853096250 1136509269 /nfs/dbraw/zinc/50/92/69/1136509269.db2.gz USDNBXWQCZJBMD-UHFFFAOYSA-N 2 0 343.437 3.507 20 10 EHCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000817899282 1136844843 /nfs/dbraw/zinc/84/48/43/1136844843.db2.gz NKOWKRIJFGIIEQ-PWRODBHTSA-N 2 0 327.516 3.687 20 10 EHCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1O ZINC000817966948 1136853194 /nfs/dbraw/zinc/85/31/94/1136853194.db2.gz ZZKMTNVKNOEOEV-MLGOLLRUSA-N 2 0 341.293 3.503 20 10 EHCDRP Oc1ccccc1C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)C1CCCC1 ZINC000824778925 1137151585 /nfs/dbraw/zinc/15/15/85/1137151585.db2.gz VJPHWZHJHAOZLB-UHFFFAOYSA-N 2 0 348.450 3.918 20 10 EHCDRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000844923070 1137263302 /nfs/dbraw/zinc/26/33/02/1137263302.db2.gz GJKOBDGHHQWBPP-LBPRGKRZSA-N 2 0 349.272 3.725 20 10 EHCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1F ZINC000846045813 1137329629 /nfs/dbraw/zinc/32/96/29/1137329629.db2.gz RNCIXJFUHNBRGK-NRFANRHFSA-N 2 0 341.474 3.818 20 10 EHCDRP COc1cccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1O ZINC000846166117 1137337290 /nfs/dbraw/zinc/33/72/90/1137337290.db2.gz SUFCJTYHHYZMKM-HRCADAONSA-N 2 0 332.488 3.704 20 10 EHCDRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846167578 1137337326 /nfs/dbraw/zinc/33/73/26/1137337326.db2.gz KXYXHUFTZHJKAM-SJLPKXTDSA-N 2 0 340.467 3.574 20 10 EHCDRP