smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(N2CC[NH+](Cc3c[nH+]ccc3N)CC2)c(C)c1 ZINC001209733430 801268130 /nfs/dbraw/zinc/26/81/30/801268130.db2.gz WZIYIMJHQIHXHL-UHFFFAOYSA-N 2 2 312.417 2.133 20 10 DECDLP [NH3+][C@@]12CC[C@H]1C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992599 1084583659 /nfs/dbraw/zinc/58/36/59/1084583659.db2.gz PTUAILVZNVKXLE-SMDDNHRTSA-N 2 2 316.323 2.256 20 10 DECDLP [NH3+][C@@]12CC[C@H]1C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992599 1084583667 /nfs/dbraw/zinc/58/36/67/1084583667.db2.gz PTUAILVZNVKXLE-SMDDNHRTSA-N 2 2 316.323 2.256 20 10 DECDLP C[N@@H+]1CCC[C@H](NC2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475699 1143653410 /nfs/dbraw/zinc/65/34/10/1143653410.db2.gz TYKFVLSZUAADBX-KRWDZBQOSA-N 2 2 303.450 2.040 20 10 DECDLP CN1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475699 1143653454 /nfs/dbraw/zinc/65/34/54/1143653454.db2.gz TYKFVLSZUAADBX-KRWDZBQOSA-N 2 2 303.450 2.040 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c[nH]nc3c2)cc1 ZINC000841044588 650412498 /nfs/dbraw/zinc/41/24/98/650412498.db2.gz WNCMHPPCRWOXOR-QGZVFWFLSA-N 2 2 309.417 2.419 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000841044756 650412550 /nfs/dbraw/zinc/41/25/50/650412550.db2.gz YRIAXNOHSRNLNF-QGZVFWFLSA-N 2 2 314.389 2.450 20 10 DECDLP CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC[NH2+]CC1 ZINC000843044128 650875533 /nfs/dbraw/zinc/87/55/33/650875533.db2.gz DUPIHSIJKHSQHR-UHFFFAOYSA-N 2 2 323.393 2.273 20 10 DECDLP CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC[NH2+]CC1 ZINC000843044128 650875536 /nfs/dbraw/zinc/87/55/36/650875536.db2.gz DUPIHSIJKHSQHR-UHFFFAOYSA-N 2 2 323.393 2.273 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c(C(F)(F)F)c1 ZINC000792842600 644159216 /nfs/dbraw/zinc/15/92/16/644159216.db2.gz UBOXITRYDADMAU-BETUJISGSA-N 2 2 313.367 2.423 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c(C(F)(F)F)c1 ZINC000792842600 644159218 /nfs/dbraw/zinc/15/92/18/644159218.db2.gz UBOXITRYDADMAU-BETUJISGSA-N 2 2 313.367 2.423 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1O ZINC000843363132 650957638 /nfs/dbraw/zinc/95/76/38/650957638.db2.gz NYJBVKQTYKDXNY-YIONKMFJSA-N 2 2 306.381 2.449 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1O ZINC000843363132 650957639 /nfs/dbraw/zinc/95/76/39/650957639.db2.gz NYJBVKQTYKDXNY-YIONKMFJSA-N 2 2 306.381 2.449 20 10 DECDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000817900376 647377117 /nfs/dbraw/zinc/37/71/17/647377117.db2.gz SCHWRBDMCVWLCW-RBUKOAKNSA-N 2 2 315.461 2.143 20 10 DECDLP CC(C)[C@H](Cn1cccn1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940258 647388209 /nfs/dbraw/zinc/38/82/09/647388209.db2.gz FBSIKVMKYSNZNP-ROUUACIJSA-N 2 2 315.465 2.263 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817982418 647399312 /nfs/dbraw/zinc/39/93/12/647399312.db2.gz DPMOYJVUTZESQP-ZBFHGGJFSA-N 2 2 321.440 2.455 20 10 DECDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925479447 648220279 /nfs/dbraw/zinc/22/02/79/648220279.db2.gz ZRKWJQQJARMANA-RHSMWYFYSA-N 2 2 305.491 2.470 20 10 DECDLP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1O ZINC000850554957 651952996 /nfs/dbraw/zinc/95/29/96/651952996.db2.gz FTCUWMICSSTDJI-ZFWWWQNUSA-N 2 2 320.433 2.305 20 10 DECDLP [NH3+]C[C@H]1C[N@H+](Cc2cccc(F)c2O)CC[C@H]1C(F)(F)F ZINC000863645472 686538878 /nfs/dbraw/zinc/53/88/78/686538878.db2.gz IBWCUICTILEQQO-WDEREUQCSA-N 2 2 306.303 2.490 20 10 DECDLP [NH3+]C[C@H]1C[N@@H+](Cc2cccc(F)c2O)CC[C@H]1C(F)(F)F ZINC000863645472 686538880 /nfs/dbraw/zinc/53/88/80/686538880.db2.gz IBWCUICTILEQQO-WDEREUQCSA-N 2 2 306.303 2.490 20 10 DECDLP C[C@@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877154222 690032060 /nfs/dbraw/zinc/03/20/60/690032060.db2.gz NISXJVVJJFYGFC-MRXNPFEDSA-N 2 2 317.477 2.222 20 10 DECDLP C[C@@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877154222 690032062 /nfs/dbraw/zinc/03/20/62/690032062.db2.gz NISXJVVJJFYGFC-MRXNPFEDSA-N 2 2 317.477 2.222 20 10 DECDLP COC(=O)CCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000877755570 690217529 /nfs/dbraw/zinc/21/75/29/690217529.db2.gz FSZLUHZTUKKPOK-CQSZACIVSA-N 2 2 320.433 2.460 20 10 DECDLP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1c(O)cccc1F ZINC000886522918 692100724 /nfs/dbraw/zinc/10/07/24/692100724.db2.gz TUJBVAJYTWAMIJ-AWEZNQCLSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1c(O)cccc1F ZINC000886522918 692100726 /nfs/dbraw/zinc/10/07/26/692100726.db2.gz TUJBVAJYTWAMIJ-AWEZNQCLSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925501497 693284589 /nfs/dbraw/zinc/28/45/89/693284589.db2.gz ISZYFTXJZMUHOK-DYVFJYSZSA-N 2 2 321.440 2.017 20 10 DECDLP C[C@@H]([NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1)c1cc(F)ccc1O ZINC000925793987 693342413 /nfs/dbraw/zinc/34/24/13/693342413.db2.gz SXIWVZIECGNURJ-TZMCWYRMSA-N 2 2 308.397 2.341 20 10 DECDLP COc1cc(C[N@@H+]2CCOCC23CCC3)cc(C[NH+](C)C)c1O ZINC001139258554 796350158 /nfs/dbraw/zinc/35/01/58/796350158.db2.gz RSZGUKCFDMHYNE-UHFFFAOYSA-N 2 2 320.433 2.217 20 10 DECDLP COc1cc(C[N@H+]2CCOCC23CCC3)cc(C[NH+](C)C)c1O ZINC001139258554 796350164 /nfs/dbraw/zinc/35/01/64/796350164.db2.gz RSZGUKCFDMHYNE-UHFFFAOYSA-N 2 2 320.433 2.217 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)cc1OC ZINC001222253195 802661875 /nfs/dbraw/zinc/66/18/75/802661875.db2.gz NYERSRWTCNABLD-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC[C@@]23CCC[NH2+]C3)cc1OC ZINC001222253195 802661879 /nfs/dbraw/zinc/66/18/79/802661879.db2.gz NYERSRWTCNABLD-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cncc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC001579321683 1067304735 /nfs/dbraw/zinc/30/47/35/1067304735.db2.gz MYOYJXRQHXMHRS-KRWDZBQOSA-N 2 2 314.433 2.254 20 10 DECDLP C[N@@H+]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001560611007 1075142946 /nfs/dbraw/zinc/14/29/46/1075142946.db2.gz LSRRCXSJHJEFHY-SFHVURJKSA-N 2 2 317.477 2.222 20 10 DECDLP C[N@H+]1CCCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001560611007 1075142949 /nfs/dbraw/zinc/14/29/49/1075142949.db2.gz LSRRCXSJHJEFHY-SFHVURJKSA-N 2 2 317.477 2.222 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H](C)CO1 ZINC001236941901 1138461790 /nfs/dbraw/zinc/46/17/90/1138461790.db2.gz GUUOKYZYJPEALK-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H](C)CO1 ZINC001236941901 1138461796 /nfs/dbraw/zinc/46/17/96/1138461796.db2.gz GUUOKYZYJPEALK-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4C[C@@H]4[C@H](F)C3)c(F)c2)CC1 ZINC001236936969 1138462116 /nfs/dbraw/zinc/46/21/16/1138462116.db2.gz WDLCYAXWFWMZGS-QILLFSRXSA-N 2 2 321.415 2.367 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4C[C@@H]4[C@H](F)C3)c(F)c2)CC1 ZINC001236936969 1138462122 /nfs/dbraw/zinc/46/21/22/1138462122.db2.gz WDLCYAXWFWMZGS-QILLFSRXSA-N 2 2 321.415 2.367 20 10 DECDLP COCCC[N@H+](Cc1ccc2c(c1)CCCN2C)[C@@H]1CC[NH2+]C1 ZINC001236946358 1138463227 /nfs/dbraw/zinc/46/32/27/1138463227.db2.gz MEPCFOPDZMGMAU-GOSISDBHSA-N 2 2 317.477 2.269 20 10 DECDLP COCCC[N@@H+](Cc1ccc2c(c1)CCCN2C)[C@@H]1CC[NH2+]C1 ZINC001236946358 1138463239 /nfs/dbraw/zinc/46/32/39/1138463239.db2.gz MEPCFOPDZMGMAU-GOSISDBHSA-N 2 2 317.477 2.269 20 10 DECDLP C[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC[NH2+]1 ZINC001246357519 1140887392 /nfs/dbraw/zinc/88/73/92/1140887392.db2.gz AHMMEYGOYZCHHD-WMLDXEAASA-N 3 2 303.450 2.087 20 10 DECDLP COCC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c(F)c2O)CC1 ZINC000191222187 402651913 /nfs/dbraw/zinc/65/19/13/402651913.db2.gz CZZFVFMOMXZEIX-LLVKDONJSA-N 2 2 314.376 2.432 20 10 DECDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[N@H+](C)CCN2C)cc1 ZINC000268908223 403121547 /nfs/dbraw/zinc/12/15/47/403121547.db2.gz MJCZUCVQHVATSJ-MAUKXSAKSA-N 2 2 304.482 2.039 20 10 DECDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[N@@H+](C)CCN2C)cc1 ZINC000268908223 403121548 /nfs/dbraw/zinc/12/15/48/403121548.db2.gz MJCZUCVQHVATSJ-MAUKXSAKSA-N 2 2 304.482 2.039 20 10 DECDLP Cc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)ccc1N(C)C ZINC000292890434 403381370 /nfs/dbraw/zinc/38/13/70/403381370.db2.gz VBTBVDYBBBPXCL-SFHVURJKSA-N 2 2 317.477 2.215 20 10 DECDLP Cc1cc(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)ccc1N(C)C ZINC000292890434 403381373 /nfs/dbraw/zinc/38/13/73/403381373.db2.gz VBTBVDYBBBPXCL-SFHVURJKSA-N 2 2 317.477 2.215 20 10 DECDLP CC[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(F)cc1O ZINC000286193250 403468904 /nfs/dbraw/zinc/46/89/04/403468904.db2.gz RJSYDJLDOKKQSY-MRXNPFEDSA-N 2 2 310.413 2.419 20 10 DECDLP Oc1cc(F)c(Cl)cc1C[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000294372130 403716998 /nfs/dbraw/zinc/71/69/98/403716998.db2.gz UKLCADVXJYSWJI-UHFFFAOYSA-N 2 2 316.804 2.121 20 10 DECDLP COc1c(O)c(C[N@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510714 404201122 /nfs/dbraw/zinc/20/11/22/404201122.db2.gz POEOHDFYNMTHIU-AAEUAGOBSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510714 404201133 /nfs/dbraw/zinc/20/11/33/404201133.db2.gz POEOHDFYNMTHIU-AAEUAGOBSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510714 404201139 /nfs/dbraw/zinc/20/11/39/404201139.db2.gz POEOHDFYNMTHIU-AAEUAGOBSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510714 404201144 /nfs/dbraw/zinc/20/11/44/404201144.db2.gz POEOHDFYNMTHIU-AAEUAGOBSA-N 2 2 323.393 2.081 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844594 649853634 /nfs/dbraw/zinc/85/36/34/649853634.db2.gz RPXLFZVIUJSQNY-YJBOKZPZSA-N 2 2 305.466 2.250 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1CCC[N@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844594 649853635 /nfs/dbraw/zinc/85/36/35/649853635.db2.gz RPXLFZVIUJSQNY-YJBOKZPZSA-N 2 2 305.466 2.250 20 10 DECDLP CC1([NH+]2CCOCC2)CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000529665197 340767170 /nfs/dbraw/zinc/76/71/70/340767170.db2.gz UQKRMRMWMQFKTP-UHFFFAOYSA-N 2 2 308.397 2.218 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@](C)(O)C[NH+](C)C)cc1F ZINC000131415971 520906047 /nfs/dbraw/zinc/90/60/47/520906047.db2.gz GVOYZGJCFNGBJH-QGZVFWFLSA-N 2 2 311.445 2.074 20 10 DECDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@H+](CC(C)C)CCO2)c1O ZINC000894140219 636278517 /nfs/dbraw/zinc/27/85/17/636278517.db2.gz IZASLQRDWRPVGU-MRXNPFEDSA-N 2 2 322.449 2.156 20 10 DECDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@@H+](CC(C)C)CCO2)c1O ZINC000894140219 636278520 /nfs/dbraw/zinc/27/85/20/636278520.db2.gz IZASLQRDWRPVGU-MRXNPFEDSA-N 2 2 322.449 2.156 20 10 DECDLP C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2)[C@H](C[NH3+])C1 ZINC000923389246 637156064 /nfs/dbraw/zinc/15/60/64/637156064.db2.gz NKNMEFISRFSPJK-QAPCUYQASA-N 2 2 303.450 2.082 20 10 DECDLP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@H](C[NH3+])C1 ZINC000923389246 637156068 /nfs/dbraw/zinc/15/60/68/637156068.db2.gz NKNMEFISRFSPJK-QAPCUYQASA-N 2 2 303.450 2.082 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[NH2+]C23CCCC3)ccc1[N+](=O)[O-] ZINC000843127897 650902222 /nfs/dbraw/zinc/90/22/22/650902222.db2.gz JHRKGGGWCUTKKT-ZDUSSCGKSA-N 2 2 321.377 2.073 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000843129722 650902992 /nfs/dbraw/zinc/90/29/92/650902992.db2.gz YSNDZOVFYJJLKG-GOSISDBHSA-N 2 2 315.461 2.288 20 10 DECDLP Cc1cc(C[NH+]2CCC(CO)([NH2+]C(C)C)CC2)ccc1N(C)C ZINC000846938321 651363382 /nfs/dbraw/zinc/36/33/82/651363382.db2.gz LNBPLKMXMUBAEK-UHFFFAOYSA-N 2 2 319.493 2.386 20 10 DECDLP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@@H]3CCOC3)CC1)CC2 ZINC000850554761 651952525 /nfs/dbraw/zinc/95/25/25/651952525.db2.gz FQLJXMDBOKHDAZ-HZPDHXFCSA-N 2 2 302.418 2.222 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc3c[nH]nc32)cc1 ZINC001345104155 1150865179 /nfs/dbraw/zinc/86/51/79/1150865179.db2.gz KBPZODVGMLQNRE-QGZVFWFLSA-N 2 2 309.417 2.419 20 10 DECDLP COc1cc(C[N@@H+]2CCO[C@H](C(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139259619 796350995 /nfs/dbraw/zinc/35/09/95/796350995.db2.gz YXRGHJANFVEBIF-KRWDZBQOSA-N 2 2 322.449 2.319 20 10 DECDLP COc1cc(C[N@H+]2CCO[C@H](C(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139259619 796350999 /nfs/dbraw/zinc/35/09/99/796350999.db2.gz YXRGHJANFVEBIF-KRWDZBQOSA-N 2 2 322.449 2.319 20 10 DECDLP Oc1cc(Cl)ccc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001140465081 796526104 /nfs/dbraw/zinc/52/61/04/796526104.db2.gz HFHJKFYYUNMOLG-UHFFFAOYSA-N 2 2 323.868 2.259 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001205780889 798085316 /nfs/dbraw/zinc/08/53/16/798085316.db2.gz SXSPIWHEZSEWSV-ZDUSSCGKSA-N 2 2 313.392 2.177 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001205780889 798085320 /nfs/dbraw/zinc/08/53/20/798085320.db2.gz SXSPIWHEZSEWSV-ZDUSSCGKSA-N 2 2 313.392 2.177 20 10 DECDLP Oc1ccccc1C[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001203551975 800078107 /nfs/dbraw/zinc/07/81/07/800078107.db2.gz VSMCIGIRDBAJIB-UHFFFAOYSA-N 2 2 310.357 2.183 20 10 DECDLP Oc1ccccc1C[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001203551975 800078116 /nfs/dbraw/zinc/07/81/16/800078116.db2.gz VSMCIGIRDBAJIB-UHFFFAOYSA-N 2 2 310.357 2.183 20 10 DECDLP CN(C)c1cc(F)c(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)cc1F ZINC001331277798 1149409278 /nfs/dbraw/zinc/40/92/78/1149409278.db2.gz RFKPFFDGCKJHLZ-GFCCVEGCSA-N 2 2 306.360 2.332 20 10 DECDLP C[C@H]([NH2+]Cc1ccc2ccccc2c1O)[C@@H]1C[N@H+](C)CCN1C ZINC001660047335 1080260446 /nfs/dbraw/zinc/26/04/46/1080260446.db2.gz IVJOGPATGPGGIX-KSSFIOAISA-N 2 2 313.445 2.269 20 10 DECDLP C[C@H]([NH2+]Cc1ccc2ccccc2c1O)[C@@H]1C[N@@H+](C)CCN1C ZINC001660047335 1080260452 /nfs/dbraw/zinc/26/04/52/1080260452.db2.gz IVJOGPATGPGGIX-KSSFIOAISA-N 2 2 313.445 2.269 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@H+](Cc1cc3c4c(c1O)CCCN4CCC3)C2 ZINC001235157261 1084330323 /nfs/dbraw/zinc/33/03/23/1084330323.db2.gz CIWJVZZZLCIPDZ-HNAYVOBHSA-N 2 2 313.445 2.014 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@@H+](Cc1cc3c4c(c1O)CCCN4CCC3)C2 ZINC001235157261 1084330332 /nfs/dbraw/zinc/33/03/32/1084330332.db2.gz CIWJVZZZLCIPDZ-HNAYVOBHSA-N 2 2 313.445 2.014 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235175161 1084334982 /nfs/dbraw/zinc/33/49/82/1084334982.db2.gz YGRACAWVIMIHTB-GXFFZTMASA-N 2 2 302.296 2.214 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235175161 1084334994 /nfs/dbraw/zinc/33/49/94/1084334994.db2.gz YGRACAWVIMIHTB-GXFFZTMASA-N 2 2 302.296 2.214 20 10 DECDLP CCCC[C@@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001326077794 1148037896 /nfs/dbraw/zinc/03/78/96/1148037896.db2.gz ZAHQBXUEWANSDL-INIZCTEOSA-N 3 2 322.472 2.185 20 10 DECDLP C[NH+]1CCC(O)(C[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000077450394 355205639 /nfs/dbraw/zinc/20/56/39/355205639.db2.gz FYCFGFLYMIFKRK-UHFFFAOYSA-N 2 2 319.232 2.245 20 10 DECDLP CC[NH+]1CCC([NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)CC1 ZINC000273419056 285190940 /nfs/dbraw/zinc/19/09/40/285190940.db2.gz RRTUWSBURNBYRY-LBPRGKRZSA-N 2 2 306.406 2.314 20 10 DECDLP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)C1 ZINC000273303915 130104674 /nfs/dbraw/zinc/10/46/74/130104674.db2.gz CGPJAMAWEINYSQ-QWHCGFSZSA-N 2 2 306.406 2.171 20 10 DECDLP C[C@@H]([NH2+]CCCn1cc[nH+]c1)c1ccc(N2CCOCC2)cc1 ZINC000151107912 402016117 /nfs/dbraw/zinc/01/61/17/402016117.db2.gz JRIGXKUQRUQFNS-MRXNPFEDSA-N 2 2 314.433 2.461 20 10 DECDLP COc1ccc(N2CCC([NH2+]CCn3cc[nH+]c3)CC2)cc1 ZINC000155688189 402264803 /nfs/dbraw/zinc/26/48/03/402264803.db2.gz BQBJGKFDVHRHPQ-UHFFFAOYSA-N 2 2 300.406 2.150 20 10 DECDLP C[NH+](C)C[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000228726543 225208918 /nfs/dbraw/zinc/20/89/18/225208918.db2.gz OKADLWPXICXZBH-ZDUSSCGKSA-N 2 2 307.221 2.101 20 10 DECDLP C[NH+](C)C[C@@](C)(O)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000269761587 225386550 /nfs/dbraw/zinc/38/65/50/225386550.db2.gz BOIREPSTPHQWRJ-SFHVURJKSA-N 2 2 305.466 2.079 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC(C)([NH+]3CCC3)CC2)cc1OC ZINC000895670415 638142578 /nfs/dbraw/zinc/14/25/78/638142578.db2.gz HGIXBKKKIHDMSA-UHFFFAOYSA-N 2 2 320.433 2.470 20 10 DECDLP CC[NH2+][C@H](C)C[NH2+]Cc1cc(Br)cc(OC)c1O ZINC000841065177 650419687 /nfs/dbraw/zinc/41/96/87/650419687.db2.gz GRRZHXJFZHASBY-SECBINFHSA-N 2 2 317.227 2.251 20 10 DECDLP C[N@H+](Cc1ccon1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775715494 642084439 /nfs/dbraw/zinc/08/44/39/642084439.db2.gz ZGBWZFZWQRZRFX-UHFFFAOYSA-N 2 2 300.406 2.058 20 10 DECDLP C[N@@H+](Cc1ccon1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775715494 642084446 /nfs/dbraw/zinc/08/44/46/642084446.db2.gz ZGBWZFZWQRZRFX-UHFFFAOYSA-N 2 2 300.406 2.058 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)OCO2 ZINC000843048074 650877052 /nfs/dbraw/zinc/87/70/52/650877052.db2.gz MHCQHANBQHHKEQ-UONOGXRCSA-N 2 2 304.390 2.227 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)OCO2 ZINC000843048074 650877053 /nfs/dbraw/zinc/87/70/53/650877053.db2.gz MHCQHANBQHHKEQ-UONOGXRCSA-N 2 2 304.390 2.227 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+](C2CC2)C2CC[NH2+]CC2)c1O ZINC000843345398 650953352 /nfs/dbraw/zinc/95/33/52/650953352.db2.gz HKOIETVMBXTJPP-UHFFFAOYSA-N 2 2 306.381 2.450 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)c1O ZINC000843345398 650953354 /nfs/dbraw/zinc/95/33/54/650953354.db2.gz HKOIETVMBXTJPP-UHFFFAOYSA-N 2 2 306.381 2.450 20 10 DECDLP CCN(CC)c1ccc(C[N@H+](C)C[C@H](O)C[NH+](C)C2CC2)cc1 ZINC000809932994 646301918 /nfs/dbraw/zinc/30/19/18/646301918.db2.gz MHOMKYUAVDDDBI-IBGZPJMESA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)C[NH+](C)C2CC2)cc1 ZINC000809932994 646301920 /nfs/dbraw/zinc/30/19/20/646301920.db2.gz MHOMKYUAVDDDBI-IBGZPJMESA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@H](O)C[N@H+](C)C2CC2)cc1 ZINC000809932994 646301927 /nfs/dbraw/zinc/30/19/27/646301927.db2.gz MHOMKYUAVDDDBI-IBGZPJMESA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@H](O)C[N@@H+](C)C2CC2)cc1 ZINC000809932994 646301930 /nfs/dbraw/zinc/30/19/30/646301930.db2.gz MHOMKYUAVDDDBI-IBGZPJMESA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@H](O)C[N@H+](C)C2CC2)cc1F ZINC000819041057 647570112 /nfs/dbraw/zinc/57/01/12/647570112.db2.gz DQIXGIGADPKDQU-MRXNPFEDSA-N 2 2 323.456 2.217 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@H](O)C[N@@H+](C)C2CC2)cc1F ZINC000819041057 647570115 /nfs/dbraw/zinc/57/01/15/647570115.db2.gz DQIXGIGADPKDQU-MRXNPFEDSA-N 2 2 323.456 2.217 20 10 DECDLP COCC[NH2+]C1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000844900518 651180674 /nfs/dbraw/zinc/18/06/74/651180674.db2.gz QCRDHTNWDRNZGX-SNAWJCMRSA-N 2 2 317.477 2.466 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC000849350778 651655841 /nfs/dbraw/zinc/65/58/41/651655841.db2.gz VZGJSRDRZUZZEY-FQEVSTJZSA-N 3 2 324.472 2.188 20 10 DECDLP [NH3+][C@H]1CCCCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000873215638 689186172 /nfs/dbraw/zinc/18/61/72/689186172.db2.gz JSZUSWMSHJANPN-INIZCTEOSA-N 2 2 321.440 2.366 20 10 DECDLP [NH3+][C@H]1CCCCC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000873215638 689186176 /nfs/dbraw/zinc/18/61/76/689186176.db2.gz JSZUSWMSHJANPN-INIZCTEOSA-N 2 2 321.440 2.366 20 10 DECDLP CCc1cccc(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c1O ZINC000877670390 690184911 /nfs/dbraw/zinc/18/49/11/690184911.db2.gz MKKNAGKLZHPFFS-QZTJIDSGSA-N 3 2 319.493 2.126 20 10 DECDLP [NH3+]Cc1nc2c(s1)CC[N@@H+]([C@@H]1CCc3cccc(O)c31)C2 ZINC000925749155 693335241 /nfs/dbraw/zinc/33/52/41/693335241.db2.gz HLDOMQJXGNFHKQ-GFCCVEGCSA-N 2 2 301.415 2.353 20 10 DECDLP [NH3+]Cc1nc2c(s1)CC[N@H+]([C@@H]1CCc3cccc(O)c31)C2 ZINC000925749155 693335243 /nfs/dbraw/zinc/33/52/43/693335243.db2.gz HLDOMQJXGNFHKQ-GFCCVEGCSA-N 2 2 301.415 2.353 20 10 DECDLP Oc1cc(O)c(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)c(O)c1 ZINC001144504307 790935518 /nfs/dbraw/zinc/93/55/18/790935518.db2.gz OXPVQPDMMYHHAL-UHFFFAOYSA-N 2 2 316.357 2.242 20 10 DECDLP CC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177066302 794572558 /nfs/dbraw/zinc/57/25/58/794572558.db2.gz RHNIRNVYZVXQLJ-IBGZPJMESA-N 3 2 316.493 2.012 20 10 DECDLP CC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177066302 794572561 /nfs/dbraw/zinc/57/25/61/794572561.db2.gz RHNIRNVYZVXQLJ-IBGZPJMESA-N 3 2 316.493 2.012 20 10 DECDLP COc1cc(C[N@@H+]2CCO[C@@H](C(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139259620 796351158 /nfs/dbraw/zinc/35/11/58/796351158.db2.gz YXRGHJANFVEBIF-QGZVFWFLSA-N 2 2 322.449 2.319 20 10 DECDLP COc1cc(C[N@H+]2CCO[C@@H](C(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139259620 796351159 /nfs/dbraw/zinc/35/11/59/796351159.db2.gz YXRGHJANFVEBIF-QGZVFWFLSA-N 2 2 322.449 2.319 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205101305 800296191 /nfs/dbraw/zinc/29/61/91/800296191.db2.gz CYPYVUXTZQOQIO-LBPRGKRZSA-N 2 2 302.374 2.120 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001205101305 800296193 /nfs/dbraw/zinc/29/61/93/800296193.db2.gz CYPYVUXTZQOQIO-LBPRGKRZSA-N 2 2 302.374 2.120 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCCC[C@](F)(C[NH3+])C2)c(OC)c1 ZINC001206352228 800514611 /nfs/dbraw/zinc/51/46/11/800514611.db2.gz RMZXLGMPUYDZJG-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCCC[C@](F)(C[NH3+])C2)c(OC)c1 ZINC001206352228 800514614 /nfs/dbraw/zinc/51/46/14/800514614.db2.gz RMZXLGMPUYDZJG-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP CC[N@H+](Cc1ccc(CC(=O)OC)cc1O)C1CC[NH+](C)CC1 ZINC001249201163 1141859012 /nfs/dbraw/zinc/85/90/12/1141859012.db2.gz IJUJUZXBUSGKNW-UHFFFAOYSA-N 2 2 320.433 2.024 20 10 DECDLP CC[N@@H+](Cc1ccc(CC(=O)OC)cc1O)C1CC[NH+](C)CC1 ZINC001249201163 1141859014 /nfs/dbraw/zinc/85/90/14/1141859014.db2.gz IJUJUZXBUSGKNW-UHFFFAOYSA-N 2 2 320.433 2.024 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(C(F)F)C3)cc2F)CC1 ZINC001324711286 1147833913 /nfs/dbraw/zinc/83/39/13/1147833913.db2.gz VHZBAXIRPMJTRD-UHFFFAOYSA-N 2 2 313.367 2.274 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)[N@@H+](C3CC3)C2)c1 ZINC000273551179 130134881 /nfs/dbraw/zinc/13/48/81/130134881.db2.gz FZEOJMIEUUMBNJ-OBJOEFQTSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1 ZINC000273551179 130134883 /nfs/dbraw/zinc/13/48/83/130134883.db2.gz FZEOJMIEUUMBNJ-OBJOEFQTSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCn2cc[nH+]c2C)c1 ZINC000273604795 130144517 /nfs/dbraw/zinc/14/45/17/130144517.db2.gz SYBAUBJDMBTCGP-LLVKDONJSA-N 2 2 303.362 2.035 20 10 DECDLP CC[N@H+](CCO)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000184539357 402272970 /nfs/dbraw/zinc/27/29/70/402272970.db2.gz BXMMFFVSSHTHHC-UHFFFAOYSA-N 2 2 305.466 2.081 20 10 DECDLP CC[N@@H+](CCO)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000184539357 402272976 /nfs/dbraw/zinc/27/29/76/402272976.db2.gz BXMMFFVSSHTHHC-UHFFFAOYSA-N 2 2 305.466 2.081 20 10 DECDLP C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)CN1CC[NH+](C)CC1 ZINC000185343805 402345037 /nfs/dbraw/zinc/34/50/37/402345037.db2.gz YJCKBEWUQORPNW-KBPBESRZSA-N 2 2 309.429 2.065 20 10 DECDLP C[N@@H+]1CCN(CC[NH2+]Cc2cccc(Cl)c2O)CC1(C)C ZINC000282180134 403129870 /nfs/dbraw/zinc/12/98/70/403129870.db2.gz FNTNCVFWKPYGAT-UHFFFAOYSA-N 2 2 311.857 2.161 20 10 DECDLP C[N@H+]1CCN(CC[NH2+]Cc2cccc(Cl)c2O)CC1(C)C ZINC000282180134 403129872 /nfs/dbraw/zinc/12/98/72/403129872.db2.gz FNTNCVFWKPYGAT-UHFFFAOYSA-N 2 2 311.857 2.161 20 10 DECDLP COCC[N@@H+]1CCC[C@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036104 649869854 /nfs/dbraw/zinc/86/98/54/649869854.db2.gz HSSZLNOKHVLBMT-OQBYNLHGSA-N 2 2 317.477 2.466 20 10 DECDLP COCC[N@H+]1CCC[C@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036104 649869857 /nfs/dbraw/zinc/86/98/57/649869857.db2.gz HSSZLNOKHVLBMT-OQBYNLHGSA-N 2 2 317.477 2.466 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000273439633 536792986 /nfs/dbraw/zinc/79/29/86/536792986.db2.gz YBCPTAHUCDUOLY-STQMWFEESA-N 2 2 318.417 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000273439633 536792992 /nfs/dbraw/zinc/79/29/92/536792992.db2.gz YBCPTAHUCDUOLY-STQMWFEESA-N 2 2 318.417 2.314 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCC[N@@H+]2CCCO)cc1 ZINC000835055812 649872958 /nfs/dbraw/zinc/87/29/58/649872958.db2.gz ZMJMRGDWKJYXTA-NAASZUNDSA-N 2 2 317.477 2.202 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCC[N@H+]2CCCO)cc1 ZINC000835055812 649872960 /nfs/dbraw/zinc/87/29/60/649872960.db2.gz ZMJMRGDWKJYXTA-NAASZUNDSA-N 2 2 317.477 2.202 20 10 DECDLP CCO[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000922753050 636375923 /nfs/dbraw/zinc/37/59/23/636375923.db2.gz BSABYDLUBUCNTI-ZEVQVBBLSA-N 2 2 305.466 2.322 20 10 DECDLP COc1ccc(N2CCC[N@H+](CCc3c[nH+]cn3C)CC2)cc1 ZINC000838799875 637653338 /nfs/dbraw/zinc/65/33/38/637653338.db2.gz YWFVDWJBHWSPBT-UHFFFAOYSA-N 2 2 314.433 2.184 20 10 DECDLP COc1ccc(N2CCC[N@@H+](CCc3c[nH+]cn3C)CC2)cc1 ZINC000838799875 637653342 /nfs/dbraw/zinc/65/33/42/637653342.db2.gz YWFVDWJBHWSPBT-UHFFFAOYSA-N 2 2 314.433 2.184 20 10 DECDLP COc1ccc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000841042347 650411781 /nfs/dbraw/zinc/41/17/81/650411781.db2.gz INXCFVGKPZULBJ-INIZCTEOSA-N 2 2 315.417 2.256 20 10 DECDLP CCOCc1cc(C[NH2+]C[C@@]2(COC)CCC[NH2+]2)ccc1OC ZINC000841066707 650421026 /nfs/dbraw/zinc/42/10/26/650421026.db2.gz FJVHRMHKDIRLKX-GOSISDBHSA-N 2 2 322.449 2.090 20 10 DECDLP COc1c(O)c(C[NH2+]CCCCn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000774977458 641990022 /nfs/dbraw/zinc/99/00/22/641990022.db2.gz KJMGYEMHEAZBOE-UHFFFAOYSA-N 2 2 320.349 2.076 20 10 DECDLP C[C@H]([NH2+]CC1([NH3+])CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000902416931 643032622 /nfs/dbraw/zinc/03/26/22/643032622.db2.gz PRFUDVQDVGHDAB-LBPRGKRZSA-N 2 2 309.841 2.319 20 10 DECDLP C[NH+](C)Cc1cnc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000796284913 644711478 /nfs/dbraw/zinc/71/14/78/644711478.db2.gz UVBCRIXWOUDOJP-UHFFFAOYSA-N 2 2 303.431 2.429 20 10 DECDLP Oc1c(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)ccc2ccccc21 ZINC000816548477 647150746 /nfs/dbraw/zinc/15/07/46/647150746.db2.gz JGEQCWVDZOVVJL-IAGOWNOFSA-N 2 2 312.413 2.498 20 10 DECDLP Oc1c(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)ccc2ccccc21 ZINC000816548477 647150747 /nfs/dbraw/zinc/15/07/47/647150747.db2.gz JGEQCWVDZOVVJL-IAGOWNOFSA-N 2 2 312.413 2.498 20 10 DECDLP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Br)cc(F)c1O ZINC000817977849 647398886 /nfs/dbraw/zinc/39/88/86/647398886.db2.gz QOYWWTRUBYFACA-XUJCCDQDSA-N 2 2 315.186 2.162 20 10 DECDLP Oc1cccc(Cl)c1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000850397631 651920880 /nfs/dbraw/zinc/92/08/80/651920880.db2.gz ZQRDOHPMTNXJAA-ZDUSSCGKSA-N 2 2 310.825 2.389 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000854230592 652662935 /nfs/dbraw/zinc/66/29/35/652662935.db2.gz VFDSGORCCKRRGM-DNVCBOLYSA-N 2 2 317.477 2.268 20 10 DECDLP Fc1cc(C[NH2+][C@H]2CC[NH2+]C23CCC3)ccc1N1CCOCC1 ZINC000863481513 686508018 /nfs/dbraw/zinc/50/80/18/686508018.db2.gz FVJKKERWLIEJPV-KRWDZBQOSA-N 2 2 319.424 2.037 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccon3)cc2F)CC1 ZINC000873047899 689148144 /nfs/dbraw/zinc/14/81/44/689148144.db2.gz HYJIIHZIWNFHRD-UHFFFAOYSA-N 2 2 318.396 2.245 20 10 DECDLP CC(C)[C@@H](C[NH2+][C@H](C)c1c(O)cccc1F)N1CC[NH+](C)CC1 ZINC000886500212 692094437 /nfs/dbraw/zinc/09/44/37/692094437.db2.gz LHMVSWZOSYMLMN-GDBMZVCRSA-N 2 2 323.456 2.454 20 10 DECDLP C[N@@H+]1CCCN(CCC[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000894378083 692984070 /nfs/dbraw/zinc/98/40/70/692984070.db2.gz LLEXUNAFYARZGQ-UHFFFAOYSA-N 2 2 311.857 2.163 20 10 DECDLP C[N@H+]1CCCN(CCC[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000894378083 692984082 /nfs/dbraw/zinc/98/40/82/692984082.db2.gz LLEXUNAFYARZGQ-UHFFFAOYSA-N 2 2 311.857 2.163 20 10 DECDLP COc1ccc(N2CC[C@@H]([NH2+][C@@H]3CC[NH2+]C34CCC4)C2)cc1 ZINC000925710042 693328038 /nfs/dbraw/zinc/32/80/38/693328038.db2.gz BGXVUYDFVBGTJG-RHSMWYFYSA-N 2 2 301.434 2.148 20 10 DECDLP CC[C@@]12C[C@@H](CO1)[N@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)C2 ZINC001139259330 796351831 /nfs/dbraw/zinc/35/18/31/796351831.db2.gz RKRFYIPBBVJCBQ-YJBOKZPZSA-N 2 2 320.433 2.216 20 10 DECDLP CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)C2 ZINC001139259330 796351836 /nfs/dbraw/zinc/35/18/36/796351836.db2.gz RKRFYIPBBVJCBQ-YJBOKZPZSA-N 2 2 320.433 2.216 20 10 DECDLP CC[N@H+]([C@H]1CCOC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141160217 796642798 /nfs/dbraw/zinc/64/27/98/796642798.db2.gz UGVPUEIHBUCTKQ-INIZCTEOSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141160217 796642802 /nfs/dbraw/zinc/64/28/02/796642802.db2.gz UGVPUEIHBUCTKQ-INIZCTEOSA-N 2 2 320.433 2.173 20 10 DECDLP C[C@@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001474030690 1060799815 /nfs/dbraw/zinc/79/98/15/1060799815.db2.gz LWYNXCVXJBTYRP-MRXNPFEDSA-N 2 2 303.450 2.097 20 10 DECDLP C[C@@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001474030690 1060799829 /nfs/dbraw/zinc/79/98/29/1060799829.db2.gz LWYNXCVXJBTYRP-MRXNPFEDSA-N 2 2 303.450 2.097 20 10 DECDLP CCCCOC1C[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235710158 1084509285 /nfs/dbraw/zinc/50/92/85/1084509285.db2.gz NEWAQWOXGJNQAQ-UHFFFAOYSA-N 2 2 303.450 2.097 20 10 DECDLP COCCC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[NH2+]C1 ZINC001235806754 1084532786 /nfs/dbraw/zinc/53/27/86/1084532786.db2.gz LFMWDURUBQXIEA-GOSISDBHSA-N 2 2 305.466 2.343 20 10 DECDLP COCCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[NH2+]C1 ZINC001235806754 1084532790 /nfs/dbraw/zinc/53/27/90/1084532790.db2.gz LFMWDURUBQXIEA-GOSISDBHSA-N 2 2 305.466 2.343 20 10 DECDLP CC[C@H]([NH3+])C[N@H+](C)Cc1cc(Br)c(OC)cc1O ZINC001236883887 1138447123 /nfs/dbraw/zinc/44/71/23/1138447123.db2.gz HIBRLKNTDKOWHN-JTQLQIEISA-N 2 2 317.227 2.332 20 10 DECDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1cc(Br)c(OC)cc1O ZINC001236883887 1138447126 /nfs/dbraw/zinc/44/71/26/1138447126.db2.gz HIBRLKNTDKOWHN-JTQLQIEISA-N 2 2 317.227 2.332 20 10 DECDLP COc1cc(N2CC[NH+](C)CC2)ccc1-c1cc[nH+]c2c1CCN2 ZINC001244163343 1140316008 /nfs/dbraw/zinc/31/60/08/1140316008.db2.gz PFLBQKCJSGWSOF-UHFFFAOYSA-N 2 2 324.428 2.120 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H](C)CO1 ZINC001319932057 1140804848 /nfs/dbraw/zinc/80/48/48/1140804848.db2.gz HGNSZLIHBBYDET-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H](C)CO1 ZINC001319932057 1140804850 /nfs/dbraw/zinc/80/48/50/1140804850.db2.gz HGNSZLIHBBYDET-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@H](O)C[NH+]2CCCC2)cc1F ZINC001308223232 1147457094 /nfs/dbraw/zinc/45/70/94/1147457094.db2.gz VGMLSEKGBZLJHJ-MRXNPFEDSA-N 2 2 323.456 2.218 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844593 649853518 /nfs/dbraw/zinc/85/35/18/649853518.db2.gz RPXLFZVIUJSQNY-QAPCUYQASA-N 2 2 305.466 2.250 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844593 649853520 /nfs/dbraw/zinc/85/35/20/649853520.db2.gz RPXLFZVIUJSQNY-QAPCUYQASA-N 2 2 305.466 2.250 20 10 DECDLP C[NH+](C)C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152987476 402120984 /nfs/dbraw/zinc/12/09/84/402120984.db2.gz VQCBAAURNHXPPV-HNNXBMFYSA-N 2 2 300.402 2.308 20 10 DECDLP C[NH+](C)C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152987476 402120986 /nfs/dbraw/zinc/12/09/86/402120986.db2.gz VQCBAAURNHXPPV-HNNXBMFYSA-N 2 2 300.402 2.308 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCn2cc[nH+]c2)c1 ZINC000273303869 536793723 /nfs/dbraw/zinc/79/37/23/536793723.db2.gz CFJADZXSGPZEEG-LBPRGKRZSA-N 2 2 303.362 2.116 20 10 DECDLP Oc1ccc(Br)cc1C[NH2+][C@H]1CCn2cc[nH+]c2C1 ZINC000778187690 642350302 /nfs/dbraw/zinc/35/03/02/642350302.db2.gz DFGAKUJYEDOSFY-LBPRGKRZSA-N 2 2 322.206 2.456 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000903918339 643506528 /nfs/dbraw/zinc/50/65/28/643506528.db2.gz XAUJFYIUMUZMIG-FQEVSTJZSA-N 3 2 324.472 2.188 20 10 DECDLP Oc1cccc(Cl)c1C[NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903974386 643531750 /nfs/dbraw/zinc/53/17/50/643531750.db2.gz PNTMEOTXOJFHQX-LBPRGKRZSA-N 2 2 310.825 2.294 20 10 DECDLP CC[C@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810216211 646339648 /nfs/dbraw/zinc/33/96/48/646339648.db2.gz FUHSPPDKVNRHJM-AAEUAGOBSA-N 2 2 320.355 2.374 20 10 DECDLP Oc1c(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)ccc2ccccc21 ZINC000816548479 647150753 /nfs/dbraw/zinc/15/07/53/647150753.db2.gz JGEQCWVDZOVVJL-SJORKVTESA-N 2 2 312.413 2.498 20 10 DECDLP Oc1c(C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc2ccccc21 ZINC000816548479 647150755 /nfs/dbraw/zinc/15/07/55/647150755.db2.gz JGEQCWVDZOVVJL-SJORKVTESA-N 2 2 312.413 2.498 20 10 DECDLP C[C@@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898398 647376518 /nfs/dbraw/zinc/37/65/18/647376518.db2.gz HNBPQJZEQJMKAW-RDJZCZTQSA-N 2 2 303.450 2.143 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2([NH3+])CCCCC2)c1 ZINC000817938858 647388303 /nfs/dbraw/zinc/38/83/03/647388303.db2.gz UOZHICWUJHKPMV-LBPRGKRZSA-N 2 2 306.406 2.491 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817952013 647391981 /nfs/dbraw/zinc/39/19/81/647391981.db2.gz MTSRSXHHDWOCAZ-UKRRQHHQSA-N 2 2 307.413 2.065 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(C(F)(F)F)cc1O ZINC000817982805 647400035 /nfs/dbraw/zinc/40/00/35/647400035.db2.gz HNAVQXLFVZVPBQ-AAEUAGOBSA-N 2 2 318.339 2.440 20 10 DECDLP Oc1cc(Br)ccc1C[NH2+][C@@H]1CCn2cc[nH+]c2C1 ZINC000825563364 648780729 /nfs/dbraw/zinc/78/07/29/648780729.db2.gz WIEIGAZOKLNNSZ-GFCCVEGCSA-N 2 2 322.206 2.456 20 10 DECDLP CC(C)C[N@@H+]1CCO[C@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001177061741 794571128 /nfs/dbraw/zinc/57/11/28/794571128.db2.gz SYGPIUZXZBAIAQ-MRXNPFEDSA-N 2 2 323.456 2.338 20 10 DECDLP CC(C)C[N@H+]1CCO[C@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001177061741 794571131 /nfs/dbraw/zinc/57/11/31/794571131.db2.gz SYGPIUZXZBAIAQ-MRXNPFEDSA-N 2 2 323.456 2.338 20 10 DECDLP CC(C)C[N@@H+]1CCO[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001177062014 794571499 /nfs/dbraw/zinc/57/14/99/794571499.db2.gz ZFHVRSSRQSMVSC-SFHVURJKSA-N 2 2 318.461 2.458 20 10 DECDLP CC(C)C[N@H+]1CCO[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001177062014 794571505 /nfs/dbraw/zinc/57/15/05/794571505.db2.gz ZFHVRSSRQSMVSC-SFHVURJKSA-N 2 2 318.461 2.458 20 10 DECDLP CC[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177066303 794572272 /nfs/dbraw/zinc/57/22/72/794572272.db2.gz RHNIRNVYZVXQLJ-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP CC[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001177066303 794572276 /nfs/dbraw/zinc/57/22/76/794572276.db2.gz RHNIRNVYZVXQLJ-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP CC[NH+](CC)CCCN1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137838706 796143680 /nfs/dbraw/zinc/14/36/80/796143680.db2.gz IEHHWUZYWWXIKZ-UHFFFAOYSA-N 2 2 323.456 2.381 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@@H+]3C[C@@H]4CC[C@]4([NH3+])C3)ccc2O1 ZINC001235994114 1084584394 /nfs/dbraw/zinc/58/43/94/1084584394.db2.gz NHEDQGWAQXKBIL-UGSOOPFHSA-N 2 2 300.402 2.500 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@H+]3C[C@@H]4CC[C@]4([NH3+])C3)ccc2O1 ZINC001235994114 1084584402 /nfs/dbraw/zinc/58/44/02/1084584402.db2.gz NHEDQGWAQXKBIL-UGSOOPFHSA-N 2 2 300.402 2.500 20 10 DECDLP CC[N@H+](C)C1CC[NH+](Cc2cc(OC)cc(OC)c2O)CC1 ZINC001237686103 1138758532 /nfs/dbraw/zinc/75/85/32/1138758532.db2.gz XMKKWDZNYMJRTG-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](C)C1CC[NH+](Cc2cc(OC)cc(OC)c2O)CC1 ZINC001237686103 1138758546 /nfs/dbraw/zinc/75/85/46/1138758546.db2.gz XMKKWDZNYMJRTG-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP C[C@H]1OCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H]1C ZINC001254010944 1143024819 /nfs/dbraw/zinc/02/48/19/1143024819.db2.gz QLFGCCOAZUKSKZ-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@H]1OCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H]1C ZINC001254010944 1143024828 /nfs/dbraw/zinc/02/48/28/1143024828.db2.gz QLFGCCOAZUKSKZ-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(F)cc1O ZINC000185352981 296120753 /nfs/dbraw/zinc/12/07/53/296120753.db2.gz KXVPWRPHYKJUNN-CQSZACIVSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1ccc(F)cc1O ZINC000185352981 296120756 /nfs/dbraw/zinc/12/07/56/296120756.db2.gz KXVPWRPHYKJUNN-CQSZACIVSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592795 130142029 /nfs/dbraw/zinc/14/20/29/130142029.db2.gz PQUNOARZOKNHJA-RHSMWYFYSA-N 2 2 317.477 2.167 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592795 130142031 /nfs/dbraw/zinc/14/20/31/130142031.db2.gz PQUNOARZOKNHJA-RHSMWYFYSA-N 2 2 317.477 2.167 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000154643179 402223526 /nfs/dbraw/zinc/22/35/26/402223526.db2.gz JYCZFOBUSNSOLH-GOEBONIOSA-N 2 2 321.440 2.407 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000154643179 402223528 /nfs/dbraw/zinc/22/35/28/402223528.db2.gz JYCZFOBUSNSOLH-GOEBONIOSA-N 2 2 321.440 2.407 20 10 DECDLP C[C@@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCOCC2)cc1 ZINC000155628433 402263767 /nfs/dbraw/zinc/26/37/67/402263767.db2.gz XBSRWRGSWUMDRG-OAHLLOKOSA-N 2 2 300.406 2.071 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1O ZINC000367588252 405095596 /nfs/dbraw/zinc/09/55/96/405095596.db2.gz LRJKQWFHWLRLMT-FMKPAKJESA-N 2 2 308.397 2.435 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1O ZINC000367588252 405095600 /nfs/dbraw/zinc/09/56/00/405095600.db2.gz LRJKQWFHWLRLMT-FMKPAKJESA-N 2 2 308.397 2.435 20 10 DECDLP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000180069369 521693298 /nfs/dbraw/zinc/69/32/98/521693298.db2.gz IJPNGZXUGBDRIC-OAHLLOKOSA-N 2 2 323.868 2.257 20 10 DECDLP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000180069369 521693300 /nfs/dbraw/zinc/69/33/00/521693300.db2.gz IJPNGZXUGBDRIC-OAHLLOKOSA-N 2 2 323.868 2.257 20 10 DECDLP COCC[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191201770 523584959 /nfs/dbraw/zinc/58/49/59/523584959.db2.gz JAWRNGJODCUQIL-NSHDSACASA-N 2 2 302.365 2.289 20 10 DECDLP COCC[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191201770 523584962 /nfs/dbraw/zinc/58/49/62/523584962.db2.gz JAWRNGJODCUQIL-NSHDSACASA-N 2 2 302.365 2.289 20 10 DECDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000131005910 526363071 /nfs/dbraw/zinc/36/30/71/526363071.db2.gz OFCYOCKTVUODGB-CYBMUJFWSA-N 2 2 310.825 2.200 20 10 DECDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000131005910 526363078 /nfs/dbraw/zinc/36/30/78/526363078.db2.gz OFCYOCKTVUODGB-CYBMUJFWSA-N 2 2 310.825 2.200 20 10 DECDLP [NH3+][C@@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000841050629 650414921 /nfs/dbraw/zinc/41/49/21/650414921.db2.gz JMKYJHRPGCFXMU-HNNXBMFYSA-N 2 2 318.421 2.412 20 10 DECDLP COC[C@@]1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CCC[NH2+]1 ZINC000841067911 650420817 /nfs/dbraw/zinc/42/08/17/650420817.db2.gz QMCBIMPSDNJPEN-SUZKBHRPSA-N 2 2 303.450 2.124 20 10 DECDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000781911802 642798048 /nfs/dbraw/zinc/79/80/48/642798048.db2.gz RUUHQNFQLZTFEJ-TXEJJXNPSA-N 2 2 311.223 2.114 20 10 DECDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000781911802 642798051 /nfs/dbraw/zinc/79/80/51/642798051.db2.gz RUUHQNFQLZTFEJ-TXEJJXNPSA-N 2 2 311.223 2.114 20 10 DECDLP c1cc2c(cc1C[NH2+][C@H]1C[NH2+]CC3(CCOCC3)C1)CCCO2 ZINC000904388262 643657729 /nfs/dbraw/zinc/65/77/29/643657729.db2.gz GURMHVBIPQJXJA-QGZVFWFLSA-N 2 2 316.445 2.260 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)OCO2 ZINC000843048075 650877100 /nfs/dbraw/zinc/87/71/00/650877100.db2.gz MHCQHANBQHHKEQ-ZIAGYGMSSA-N 2 2 304.390 2.227 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)OCO2 ZINC000843048075 650877101 /nfs/dbraw/zinc/87/71/01/650877101.db2.gz MHCQHANBQHHKEQ-ZIAGYGMSSA-N 2 2 304.390 2.227 20 10 DECDLP Cc1cc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)n(C)n1 ZINC000817942407 647389255 /nfs/dbraw/zinc/38/92/55/647389255.db2.gz ORKXIQFCNHBQTR-BBRMVZONSA-N 2 2 301.438 2.145 20 10 DECDLP CN(C)c1ccc(C[N@H+](C[C@H](O)C[NH+]2CCCC2)C2CC2)cc1 ZINC000917013932 647955582 /nfs/dbraw/zinc/95/55/82/647955582.db2.gz ITPIWIVLCXYIEV-LJQANCHMSA-N 2 2 317.477 2.174 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C[C@H](O)C[NH+]2CCCC2)C2CC2)cc1 ZINC000917013932 647955586 /nfs/dbraw/zinc/95/55/86/647955586.db2.gz ITPIWIVLCXYIEV-LJQANCHMSA-N 2 2 317.477 2.174 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)cc1F ZINC000827855654 649095449 /nfs/dbraw/zinc/09/54/49/649095449.db2.gz GDVDJAKSLHAYIY-MRXNPFEDSA-N 2 2 323.456 2.434 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)cc1F ZINC000827855654 649095452 /nfs/dbraw/zinc/09/54/52/649095452.db2.gz GDVDJAKSLHAYIY-MRXNPFEDSA-N 2 2 323.456 2.434 20 10 DECDLP COc1cccc(O)c1C[N@@H+]1CCC[C@H]([NH+]2CCOCC2)CC1 ZINC000848930615 651565724 /nfs/dbraw/zinc/56/57/24/651565724.db2.gz UCGGAUKAKPJJLV-HNNXBMFYSA-N 2 2 320.433 2.088 20 10 DECDLP COc1cccc(O)c1C[N@H+]1CCC[C@H]([NH+]2CCOCC2)CC1 ZINC000848930615 651565731 /nfs/dbraw/zinc/56/57/31/651565731.db2.gz UCGGAUKAKPJJLV-HNNXBMFYSA-N 2 2 320.433 2.088 20 10 DECDLP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+]2C)cc1Cn1cccn1 ZINC000873023689 689143747 /nfs/dbraw/zinc/14/37/47/689143747.db2.gz SCRUEJCSGRIVRW-KRWDZBQOSA-N 2 2 314.433 2.124 20 10 DECDLP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+]2C)cc1Cn1cccn1 ZINC000873023689 689143748 /nfs/dbraw/zinc/14/37/48/689143748.db2.gz SCRUEJCSGRIVRW-KRWDZBQOSA-N 2 2 314.433 2.124 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCCC[C@@](F)(C[NH3+])C2)c(OC)c1 ZINC001206352229 795020161 /nfs/dbraw/zinc/02/01/61/795020161.db2.gz RMZXLGMPUYDZJG-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCCC[C@@](F)(C[NH3+])C2)c(OC)c1 ZINC001206352229 795020167 /nfs/dbraw/zinc/02/01/67/795020167.db2.gz RMZXLGMPUYDZJG-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP CCCCOC1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139409990 796372221 /nfs/dbraw/zinc/37/22/21/796372221.db2.gz ZJEBXSPLGDHBKA-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP CN1CCOc2cc(C[NH+]3CCC([NH+]4CCC4)CC3)ccc21 ZINC001141146613 796639780 /nfs/dbraw/zinc/63/97/80/796639780.db2.gz ZVNPUETZAWIBDO-UHFFFAOYSA-N 2 2 301.434 2.185 20 10 DECDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(Cl)c1O)C2 ZINC001276380250 1083746314 /nfs/dbraw/zinc/74/63/14/1083746314.db2.gz LRZBDXZXSDQMEF-HIFRSBDPSA-N 2 2 323.868 2.113 20 10 DECDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(Cl)c1O)C2 ZINC001276380250 1083746321 /nfs/dbraw/zinc/74/63/21/1083746321.db2.gz LRZBDXZXSDQMEF-HIFRSBDPSA-N 2 2 323.868 2.113 20 10 DECDLP COCCC[N@H+](Cc1cc(F)cc(C)c1O)[C@@H]1CCC[NH2+]C1 ZINC001235808523 1084535418 /nfs/dbraw/zinc/53/54/18/1084535418.db2.gz DPECTVLSNNYZAH-MRXNPFEDSA-N 2 2 310.413 2.430 20 10 DECDLP COCCC[N@@H+](Cc1cc(F)cc(C)c1O)[C@@H]1CCC[NH2+]C1 ZINC001235808523 1084535427 /nfs/dbraw/zinc/53/54/27/1084535427.db2.gz DPECTVLSNNYZAH-MRXNPFEDSA-N 2 2 310.413 2.430 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(CSC4)C3)c(F)c2)CC1 ZINC001236948125 1138463705 /nfs/dbraw/zinc/46/37/05/1138463705.db2.gz UUWNXMINMAHQQL-UHFFFAOYSA-N 2 2 321.465 2.126 20 10 DECDLP CCCC[C@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001326077795 1148037620 /nfs/dbraw/zinc/03/76/20/1148037620.db2.gz ZAHQBXUEWANSDL-MRXNPFEDSA-N 3 2 322.472 2.185 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000273442931 130122693 /nfs/dbraw/zinc/12/26/93/130122693.db2.gz ZCLWYCVCDMGZHI-GFCCVEGCSA-N 2 2 318.417 2.456 20 10 DECDLP COc1ccc(O)c(C[NH+]2CCC(C)([NH+]3CCOCC3)CC2)c1 ZINC000529663277 405763511 /nfs/dbraw/zinc/76/35/11/405763511.db2.gz IQRHCAWKALNYTK-UHFFFAOYSA-N 2 2 320.433 2.088 20 10 DECDLP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000286323393 288047196 /nfs/dbraw/zinc/04/71/96/288047196.db2.gz XQRXDSDKSRMYDR-YOEHRIQHSA-N 2 2 323.456 2.456 20 10 DECDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000311211905 625303246 /nfs/dbraw/zinc/30/32/46/625303246.db2.gz LMRJEHXCWSADQF-ZWNOBZJWSA-N 2 2 311.223 2.339 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000311211905 625303251 /nfs/dbraw/zinc/30/32/51/625303251.db2.gz LMRJEHXCWSADQF-ZWNOBZJWSA-N 2 2 311.223 2.339 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCCC[NH2+]2)c1 ZINC000902482107 643056874 /nfs/dbraw/zinc/05/68/74/643056874.db2.gz JFNCQIAJKAWRSL-JSGCOSHPSA-N 2 2 306.406 2.362 20 10 DECDLP CN(C)c1ccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)cc1 ZINC000903974267 643531726 /nfs/dbraw/zinc/53/17/26/643531726.db2.gz NOOAIXGKYRWRAD-MRXNPFEDSA-N 2 2 303.450 2.001 20 10 DECDLP COc1cc(O)c(C[NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])cc1OC ZINC000904461887 643670099 /nfs/dbraw/zinc/67/00/99/643670099.db2.gz PQJBXJZGWMVHPP-RDTXWAMCSA-N 2 2 314.385 2.124 20 10 DECDLP COc1c(O)c(C[N@H+](C)CC[C@H]([NH3+])C(C)C)ccc1[N+](=O)[O-] ZINC000843055902 650879148 /nfs/dbraw/zinc/87/91/48/650879148.db2.gz ALMOQUAUWPFJOM-LBPRGKRZSA-N 2 2 311.382 2.114 20 10 DECDLP COc1c(O)c(C[N@@H+](C)CC[C@H]([NH3+])C(C)C)ccc1[N+](=O)[O-] ZINC000843055902 650879150 /nfs/dbraw/zinc/87/91/50/650879150.db2.gz ALMOQUAUWPFJOM-LBPRGKRZSA-N 2 2 311.382 2.114 20 10 DECDLP Cc1cc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)n(C)n1 ZINC000817942409 647389132 /nfs/dbraw/zinc/38/91/32/647389132.db2.gz ORKXIQFCNHBQTR-CJNGLKHVSA-N 2 2 301.438 2.145 20 10 DECDLP C[C@H]([NH2+][C@@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000863545161 686518932 /nfs/dbraw/zinc/51/89/32/686518932.db2.gz JQBBTHAQHFYOGM-IJEWVQPXSA-N 2 2 321.440 2.453 20 10 DECDLP Cc1cc(O)c(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)cc1C ZINC000872639158 689053972 /nfs/dbraw/zinc/05/39/72/689053972.db2.gz ZZFIACCYEWCNHM-QZTJIDSGSA-N 3 2 319.493 2.180 20 10 DECDLP C[C@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877154680 690032213 /nfs/dbraw/zinc/03/22/13/690032213.db2.gz WXJHOYLECZCHPR-INIZCTEOSA-N 2 2 317.477 2.079 20 10 DECDLP C[C@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877154680 690032218 /nfs/dbraw/zinc/03/22/18/690032218.db2.gz WXJHOYLECZCHPR-INIZCTEOSA-N 2 2 317.477 2.079 20 10 DECDLP CC[NH+](CC)CC[C@@H](CO)[NH2+]Cc1c(O)cccc1Cl ZINC000883161594 691445016 /nfs/dbraw/zinc/44/50/16/691445016.db2.gz VYXAUMXDURKSJD-LBPRGKRZSA-N 2 2 300.830 2.228 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000925764445 693337242 /nfs/dbraw/zinc/33/72/42/693337242.db2.gz YYUAEBVDJCJTJS-APWZRJJASA-N 3 2 316.493 2.059 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc3c[nH]nc32)cc1 ZINC001345104154 1150865060 /nfs/dbraw/zinc/86/50/60/1150865060.db2.gz KBPZODVGMLQNRE-KRWDZBQOSA-N 2 2 309.417 2.419 20 10 DECDLP CN(C)C1=[NH+]OC2(C1)CC[NH+](Cc1c(O)cccc1F)CC2 ZINC001137836360 796144452 /nfs/dbraw/zinc/14/44/52/796144452.db2.gz ZVDCQCGIFDGXGV-UHFFFAOYSA-N 2 2 307.369 2.161 20 10 DECDLP CC[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CC[NH+](C)CC1 ZINC001138497650 796227315 /nfs/dbraw/zinc/22/73/15/796227315.db2.gz MKKVQXIPWNFPIO-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC[NH+](C)CC1 ZINC001138497650 796227320 /nfs/dbraw/zinc/22/73/20/796227320.db2.gz MKKVQXIPWNFPIO-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP Cc1cccc(CNc2cccc(N3CC[NH+](C)CC3)[nH+]2)c1O ZINC001160770211 798738550 /nfs/dbraw/zinc/73/85/50/798738550.db2.gz SYHNTJZIPXUYEQ-UHFFFAOYSA-N 2 2 312.417 2.460 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@H+](C)CCN2C)cc1Cl ZINC001660047245 1080261246 /nfs/dbraw/zinc/26/12/46/1080261246.db2.gz HMOWUXZTAPESSE-WFASDCNBSA-N 2 2 311.857 2.078 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1Cl ZINC001660047245 1080261255 /nfs/dbraw/zinc/26/12/55/1080261255.db2.gz HMOWUXZTAPESSE-WFASDCNBSA-N 2 2 311.857 2.078 20 10 DECDLP Oc1c(F)cccc1C[NH+]1CCC([NH2+]C2CCOCC2)CC1 ZINC001665518828 1081034869 /nfs/dbraw/zinc/03/48/69/1081034869.db2.gz MVTVXGFVRYGXGT-UHFFFAOYSA-N 2 2 308.397 2.264 20 10 DECDLP C[N@@H+]1CCc2ncnc(N3C[C@H](CC[NH3+])c4ccccc43)c2C1 ZINC001168544460 1083819434 /nfs/dbraw/zinc/81/94/34/1083819434.db2.gz PGRJDAHZFKJJNK-ZDUSSCGKSA-N 2 2 309.417 2.049 20 10 DECDLP C[N@H+]1CCc2ncnc(N3C[C@H](CC[NH3+])c4ccccc43)c2C1 ZINC001168544460 1083819446 /nfs/dbraw/zinc/81/94/46/1083819446.db2.gz PGRJDAHZFKJJNK-ZDUSSCGKSA-N 2 2 309.417 2.049 20 10 DECDLP C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1C[NH2+]C(C)(C)O1 ZINC001235694090 1084501941 /nfs/dbraw/zinc/50/19/41/1084501941.db2.gz LLGYXYOVQBWWNB-KRWDZBQOSA-N 2 2 303.450 2.443 20 10 DECDLP C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1C[NH2+]C(C)(C)O1 ZINC001235694090 1084501944 /nfs/dbraw/zinc/50/19/44/1084501944.db2.gz LLGYXYOVQBWWNB-KRWDZBQOSA-N 2 2 303.450 2.443 20 10 DECDLP [NH3+][C@@]12CC[C@@H]1C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992587 1084584214 /nfs/dbraw/zinc/58/42/14/1084584214.db2.gz PTUAILVZNVKXLE-BXUZGUMPSA-N 2 2 316.323 2.256 20 10 DECDLP [NH3+][C@@]12CC[C@@H]1C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992587 1084584222 /nfs/dbraw/zinc/58/42/22/1084584222.db2.gz PTUAILVZNVKXLE-BXUZGUMPSA-N 2 2 316.323 2.256 20 10 DECDLP COCC[N@H+](Cc1c(C)cc(OC)cc1O)C1CC[NH+](C)CC1 ZINC001236814521 1138437007 /nfs/dbraw/zinc/43/70/07/1138437007.db2.gz TUXZJJMZNCYURM-UHFFFAOYSA-N 2 2 322.449 2.252 20 10 DECDLP COCC[N@@H+](Cc1c(C)cc(OC)cc1O)C1CC[NH+](C)CC1 ZINC001236814521 1138437010 /nfs/dbraw/zinc/43/70/10/1138437010.db2.gz TUXZJJMZNCYURM-UHFFFAOYSA-N 2 2 322.449 2.252 20 10 DECDLP COCCC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@H]1CC[NH2+]C1 ZINC001236945148 1138463256 /nfs/dbraw/zinc/46/32/56/1138463256.db2.gz FNDBOCMWKCWANB-KRWDZBQOSA-N 2 2 305.466 2.261 20 10 DECDLP COCCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H]1CC[NH2+]C1 ZINC001236945148 1138463264 /nfs/dbraw/zinc/46/32/64/1138463264.db2.gz FNDBOCMWKCWANB-KRWDZBQOSA-N 2 2 305.466 2.261 20 10 DECDLP CC[N@H+](Cc1cc(OC)cc(OC)c1O)C1CC[NH+](C)CC1 ZINC001237676857 1138749529 /nfs/dbraw/zinc/74/95/29/1138749529.db2.gz RKPDGNUSSPVJDR-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](Cc1cc(OC)cc(OC)c1O)C1CC[NH+](C)CC1 ZINC001237676857 1138749553 /nfs/dbraw/zinc/74/95/53/1138749553.db2.gz RKPDGNUSSPVJDR-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP COc1cc(N2CC[NH2+]CC2)ccc1-c1c[nH+]c2c(c1)CCCN2 ZINC001244288910 1140334482 /nfs/dbraw/zinc/33/44/82/1140334482.db2.gz REKZAZNDXJFHGY-UHFFFAOYSA-N 2 2 324.428 2.168 20 10 DECDLP C[NH+](C)C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152987380 402120824 /nfs/dbraw/zinc/12/08/24/402120824.db2.gz VQCBAAURNHXPPV-OAHLLOKOSA-N 2 2 300.402 2.308 20 10 DECDLP C[NH+](C)C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152987380 402120826 /nfs/dbraw/zinc/12/08/26/402120826.db2.gz VQCBAAURNHXPPV-OAHLLOKOSA-N 2 2 300.402 2.308 20 10 DECDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262028 402981110 /nfs/dbraw/zinc/98/11/10/402981110.db2.gz XGFZFGLSNHSGGW-HOTGVXAUSA-N 2 2 319.449 2.081 20 10 DECDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262028 402981112 /nfs/dbraw/zinc/98/11/12/402981112.db2.gz XGFZFGLSNHSGGW-HOTGVXAUSA-N 2 2 319.449 2.081 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)cc1 ZINC000835037264 649869781 /nfs/dbraw/zinc/86/97/81/649869781.db2.gz IZNOSXCIMSYNCQ-FBDDWCLBSA-N 2 2 315.461 2.219 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1 ZINC000835037264 649869784 /nfs/dbraw/zinc/86/97/84/649869784.db2.gz IZNOSXCIMSYNCQ-FBDDWCLBSA-N 2 2 315.461 2.219 20 10 DECDLP COCC[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921667290 634316963 /nfs/dbraw/zinc/31/69/63/634316963.db2.gz OHSGHYMJOQUQMQ-QGZVFWFLSA-N 2 2 304.434 2.212 20 10 DECDLP COCC[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921667290 634316966 /nfs/dbraw/zinc/31/69/66/634316966.db2.gz OHSGHYMJOQUQMQ-QGZVFWFLSA-N 2 2 304.434 2.212 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000841042961 650412884 /nfs/dbraw/zinc/41/28/84/650412884.db2.gz NEZROIPKSNQMLF-GOSISDBHSA-N 2 2 311.429 2.477 20 10 DECDLP C[C@@H]([NH3+])[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000841076529 650423911 /nfs/dbraw/zinc/42/39/11/650423911.db2.gz HYAWRZHJZWJGHX-CHWSQXEVSA-N 2 2 306.410 2.410 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000756609952 639679079 /nfs/dbraw/zinc/67/90/79/639679079.db2.gz GOSXHKBNZHAVEA-SGMGOOAPSA-N 2 2 306.406 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000756609952 639679081 /nfs/dbraw/zinc/67/90/81/639679081.db2.gz GOSXHKBNZHAVEA-SGMGOOAPSA-N 2 2 306.406 2.312 20 10 DECDLP Oc1c(C[NH2+]C[C@@H](O)C[NH+]2CCCC2)ccc2ccccc21 ZINC000816538529 647148866 /nfs/dbraw/zinc/14/88/66/647148866.db2.gz USIMNGSNNPGCCD-MRXNPFEDSA-N 2 2 300.402 2.092 20 10 DECDLP Cc1nn(C)cc1[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939003 647388245 /nfs/dbraw/zinc/38/82/45/647388245.db2.gz XIJJQCULGLNTCI-YVEFUNNKSA-N 2 2 301.438 2.145 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[NH2+]C23CCC3)c1 ZINC000863541356 686518353 /nfs/dbraw/zinc/51/83/53/686518353.db2.gz HPOMYOHJHQIZCN-XHDPSFHLSA-N 2 2 304.390 2.114 20 10 DECDLP CC[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876881997 689962827 /nfs/dbraw/zinc/96/28/27/689962827.db2.gz WGAVEPJZTZECOT-GOSISDBHSA-N 2 2 317.477 2.222 20 10 DECDLP CC[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876881997 689962830 /nfs/dbraw/zinc/96/28/30/689962830.db2.gz WGAVEPJZTZECOT-GOSISDBHSA-N 2 2 317.477 2.222 20 10 DECDLP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000925764354 693337338 /nfs/dbraw/zinc/33/73/38/693337338.db2.gz YSINMGLEOCXBIQ-OALUTQOASA-N 3 2 316.493 2.059 20 10 DECDLP COc1ccc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c(O)c1Cl ZINC001206201587 793734432 /nfs/dbraw/zinc/73/44/32/793734432.db2.gz XXOHHHZBHMNSPE-MNOVXSKESA-N 2 2 302.777 2.315 20 10 DECDLP COc1ccc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c(O)c1Cl ZINC001206201587 793734439 /nfs/dbraw/zinc/73/44/39/793734439.db2.gz XXOHHHZBHMNSPE-MNOVXSKESA-N 2 2 302.777 2.315 20 10 DECDLP CCN(CC)c1ccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)cc1 ZINC001222492114 802694045 /nfs/dbraw/zinc/69/40/45/802694045.db2.gz ONVQHTKLALIFCB-OALUTQOASA-N 2 2 316.493 2.059 20 10 DECDLP [NH3+][C@@]12CC[C@H]1C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995126 1084585807 /nfs/dbraw/zinc/58/58/07/1084585807.db2.gz VGHIOWAPFZPHMH-GXFFZTMASA-N 2 2 302.296 2.214 20 10 DECDLP [NH3+][C@@]12CC[C@H]1C[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995126 1084585813 /nfs/dbraw/zinc/58/58/13/1084585813.db2.gz VGHIOWAPFZPHMH-GXFFZTMASA-N 2 2 302.296 2.214 20 10 DECDLP C[C@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@H](C)O1 ZINC001236931358 1138460055 /nfs/dbraw/zinc/46/00/55/1138460055.db2.gz JYQNWVRTANNIMQ-GJZGRUSLSA-N 2 2 321.440 2.187 20 10 DECDLP CC[C@@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001337010343 1142657366 /nfs/dbraw/zinc/65/73/66/1142657366.db2.gz RLYPLRSUOZCDDV-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001337010343 1142657374 /nfs/dbraw/zinc/65/73/74/1142657374.db2.gz RLYPLRSUOZCDDV-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cccc(Cl)c1O ZINC000186595573 402446043 /nfs/dbraw/zinc/44/60/43/402446043.db2.gz HNWWDDGTBMZFTC-CYBMUJFWSA-N 2 2 311.857 2.161 20 10 DECDLP COCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c(F)c2O)CC1 ZINC000191222177 402651931 /nfs/dbraw/zinc/65/19/31/402651931.db2.gz CZZFVFMOMXZEIX-NSHDSACASA-N 2 2 314.376 2.432 20 10 DECDLP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285977128 403423306 /nfs/dbraw/zinc/42/33/06/403423306.db2.gz HMARHLMJRZXVTI-CZUORRHYSA-N 2 2 309.429 2.208 20 10 DECDLP COc1cc[nH+]c(N2CC[NH+](Cc3cc(F)ccc3O)CC2)c1 ZINC000180072093 524845598 /nfs/dbraw/zinc/84/55/98/524845598.db2.gz PFHGCWVEUMUMHX-UHFFFAOYSA-N 2 2 317.364 2.257 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000925764446 634765847 /nfs/dbraw/zinc/76/58/47/634765847.db2.gz YYUAEBVDJCJTJS-LPHOPBHVSA-N 3 2 316.493 2.059 20 10 DECDLP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@@H+]2C2CCOCC2)cc1 ZINC000922950780 636880192 /nfs/dbraw/zinc/88/01/92/636880192.db2.gz DFAJMVMQSYLLOE-GOSISDBHSA-N 2 2 303.450 2.096 20 10 DECDLP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@H+]2C2CCOCC2)cc1 ZINC000922950780 636880193 /nfs/dbraw/zinc/88/01/93/636880193.db2.gz DFAJMVMQSYLLOE-GOSISDBHSA-N 2 2 303.450 2.096 20 10 DECDLP CN(C)c1ncc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841041207 650411875 /nfs/dbraw/zinc/41/18/75/650411875.db2.gz BXFJLEJQXKNFFU-OAHLLOKOSA-N 2 2 319.478 2.065 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000841042086 650411892 /nfs/dbraw/zinc/41/18/92/650411892.db2.gz HLHKQODCSIRISC-QGZVFWFLSA-N 2 2 314.389 2.450 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C[NH3+])C3CCCC3)cc2)CC1 ZINC000841085805 650427000 /nfs/dbraw/zinc/42/70/00/650427000.db2.gz BBWYPTINJLTCOY-LJQANCHMSA-N 3 2 316.493 2.046 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CN)C3CCCC3)cc2)CC1 ZINC000841085805 650427001 /nfs/dbraw/zinc/42/70/01/650427001.db2.gz BBWYPTINJLTCOY-LJQANCHMSA-N 2 2 316.493 2.046 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2CCCO[C@@H](C[NH3+])C2)cc1F ZINC000841100943 650431300 /nfs/dbraw/zinc/43/13/00/650431300.db2.gz PMRMSAMWAUGUAD-HNNXBMFYSA-N 2 2 309.429 2.222 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2CCCO[C@@H](C[NH3+])C2)cc1F ZINC000841100943 650431304 /nfs/dbraw/zinc/43/13/04/650431304.db2.gz PMRMSAMWAUGUAD-HNNXBMFYSA-N 2 2 309.429 2.222 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000756553952 639674050 /nfs/dbraw/zinc/67/40/50/639674050.db2.gz NKRJXFKUTGVDJR-QWHCGFSZSA-N 2 2 306.406 2.171 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)c1 ZINC000756553952 639674053 /nfs/dbraw/zinc/67/40/53/639674053.db2.gz NKRJXFKUTGVDJR-QWHCGFSZSA-N 2 2 306.406 2.171 20 10 DECDLP COc1c(O)c(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)ccc1[N+](=O)[O-] ZINC000843055899 650879282 /nfs/dbraw/zinc/87/92/82/650879282.db2.gz ALMOQUAUWPFJOM-GFCCVEGCSA-N 2 2 311.382 2.114 20 10 DECDLP COc1c(O)c(C[N@@H+](C)CC[C@@H]([NH3+])C(C)C)ccc1[N+](=O)[O-] ZINC000843055899 650879283 /nfs/dbraw/zinc/87/92/83/650879283.db2.gz ALMOQUAUWPFJOM-GFCCVEGCSA-N 2 2 311.382 2.114 20 10 DECDLP COc1ccc(N(C)CC[N@H+](C)CCCn2cc[nH+]c2)cc1 ZINC000844402113 651123489 /nfs/dbraw/zinc/12/34/89/651123489.db2.gz VEWVABOLKUQSFM-UHFFFAOYSA-N 2 2 302.422 2.350 20 10 DECDLP COc1ccc(N(C)CC[N@@H+](C)CCCn2cc[nH+]c2)cc1 ZINC000844402113 651123491 /nfs/dbraw/zinc/12/34/91/651123491.db2.gz VEWVABOLKUQSFM-UHFFFAOYSA-N 2 2 302.422 2.350 20 10 DECDLP CCN(C)c1ccc(C[NH+]2CCC(CO)([NH2+]C(C)C)CC2)cc1 ZINC000846942242 651363625 /nfs/dbraw/zinc/36/36/25/651363625.db2.gz YRHZUGGJPCAWPN-UHFFFAOYSA-N 2 2 319.493 2.468 20 10 DECDLP COCCC1([NH2+]Cc2cc(Cl)cc(F)c2O)CC[NH2+]CC1 ZINC000873224618 689187973 /nfs/dbraw/zinc/18/79/73/689187973.db2.gz ILTPYRJWHOVTHA-UHFFFAOYSA-N 2 2 316.804 2.433 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C2)cc1F ZINC000873226785 689188109 /nfs/dbraw/zinc/18/81/09/689188109.db2.gz BKVRVJLWFBZHAT-NEPJUHHUSA-N 2 2 319.346 2.461 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C2)cc1F ZINC000873226785 689188111 /nfs/dbraw/zinc/18/81/11/689188111.db2.gz BKVRVJLWFBZHAT-NEPJUHHUSA-N 2 2 319.346 2.461 20 10 DECDLP CCO[C@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)C[NH+](C)C ZINC001119614494 795329591 /nfs/dbraw/zinc/32/95/91/795329591.db2.gz BRIBZFAFMXMCPO-GOSISDBHSA-N 2 2 305.466 2.343 20 10 DECDLP CC[NH+]1C[C@@H]2C[NH+](Cc3cc(Cl)cc(OC)c3O)C[C@H]2C1 ZINC001233291403 802065950 /nfs/dbraw/zinc/06/59/50/802065950.db2.gz ZRLXQPLCQYPJJC-CHWSQXEVSA-N 2 2 310.825 2.438 20 10 DECDLP CN1CCOc2cc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)ccc21 ZINC001222247674 802661081 /nfs/dbraw/zinc/66/10/81/802661081.db2.gz HVZMMGVLABKTGC-GOSISDBHSA-N 2 2 301.434 2.233 20 10 DECDLP CN1CCOc2cc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)ccc21 ZINC001222247674 802661082 /nfs/dbraw/zinc/66/10/82/802661082.db2.gz HVZMMGVLABKTGC-GOSISDBHSA-N 2 2 301.434 2.233 20 10 DECDLP C[C@@H](CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[NH+](C)C ZINC001331549582 1149527033 /nfs/dbraw/zinc/52/70/33/1149527033.db2.gz SAGTUMKDJNWISD-HNNXBMFYSA-N 3 2 322.472 2.007 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@H](C)[C@H]2C[N@H+](C)CCN2C)c1 ZINC001462598852 1058858420 /nfs/dbraw/zinc/85/84/20/1058858420.db2.gz YOJWYIAANBFLCW-RHSMWYFYSA-N 2 2 305.466 2.240 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@H](C)[C@H]2C[N@@H+](C)CCN2C)c1 ZINC001462598852 1058858446 /nfs/dbraw/zinc/85/84/46/1058858446.db2.gz YOJWYIAANBFLCW-RHSMWYFYSA-N 2 2 305.466 2.240 20 10 DECDLP Cn1ccc2c1cc[nH+]c2-c1ccc(N2CC[NH+](C)CC2)nc1 ZINC001235967243 1084573608 /nfs/dbraw/zinc/57/36/08/1084573608.db2.gz YYJQTGPUHOEOEA-UHFFFAOYSA-N 2 2 307.401 2.387 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](C)[N@@H+](C3CC3)C2)c1 ZINC000273551175 130134639 /nfs/dbraw/zinc/13/46/39/130134639.db2.gz FZEOJMIEUUMBNJ-DYEKYZERSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1 ZINC000273551175 130134642 /nfs/dbraw/zinc/13/46/42/130134642.db2.gz FZEOJMIEUUMBNJ-DYEKYZERSA-N 2 2 318.417 2.455 20 10 DECDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[N@H+](C)CCN2C)cc1 ZINC000268908225 403121366 /nfs/dbraw/zinc/12/13/66/403121366.db2.gz MJCZUCVQHVATSJ-YJBOKZPZSA-N 2 2 304.482 2.039 20 10 DECDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2C[N@@H+](C)CCN2C)cc1 ZINC000268908225 403121367 /nfs/dbraw/zinc/12/13/67/403121367.db2.gz MJCZUCVQHVATSJ-YJBOKZPZSA-N 2 2 304.482 2.039 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000365821540 404726725 /nfs/dbraw/zinc/72/67/25/404726725.db2.gz LGGTYWWYMGGKSK-STQMWFEESA-N 2 2 321.377 2.025 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000365821540 404726727 /nfs/dbraw/zinc/72/67/27/404726727.db2.gz LGGTYWWYMGGKSK-STQMWFEESA-N 2 2 321.377 2.025 20 10 DECDLP COCC[N@@H+]1CCC[C@@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036102 649869940 /nfs/dbraw/zinc/86/99/40/649869940.db2.gz HSSZLNOKHVLBMT-FHHGHWCOSA-N 2 2 317.477 2.466 20 10 DECDLP COCC[N@H+]1CCC[C@@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036102 649869941 /nfs/dbraw/zinc/86/99/41/649869941.db2.gz HSSZLNOKHVLBMT-FHHGHWCOSA-N 2 2 317.477 2.466 20 10 DECDLP CCO[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000922753049 636375959 /nfs/dbraw/zinc/37/59/59/636375959.db2.gz BSABYDLUBUCNTI-LKGOPFMKSA-N 2 2 305.466 2.322 20 10 DECDLP CCO[C@H](C[NH2+]Cc1cc(Cl)cc(OC)c1O)C[NH+](C)C ZINC000896879534 638753613 /nfs/dbraw/zinc/75/36/13/638753613.db2.gz CXIRTIDHTYECOA-CYBMUJFWSA-N 2 2 316.829 2.111 20 10 DECDLP Oc1c(Br)cccc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904421104 643669551 /nfs/dbraw/zinc/66/95/51/643669551.db2.gz OROIWRQVXSBBPT-CMPLNLGQSA-N 2 2 311.223 2.196 20 10 DECDLP Oc1c(Br)cccc1C[N@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904421104 643669556 /nfs/dbraw/zinc/66/95/56/643669556.db2.gz OROIWRQVXSBBPT-CMPLNLGQSA-N 2 2 311.223 2.196 20 10 DECDLP COc1cc(O)c(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)cc1OC ZINC000843129131 650902365 /nfs/dbraw/zinc/90/23/65/650902365.db2.gz RTAKZQVIPRJCRH-MRXNPFEDSA-N 2 2 306.406 2.174 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1O ZINC000843368640 650959607 /nfs/dbraw/zinc/95/96/07/650959607.db2.gz PYLSNTYRUFAZQL-KNXALSJPSA-N 2 2 306.381 2.293 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1O ZINC000843368640 650959610 /nfs/dbraw/zinc/95/96/10/650959610.db2.gz PYLSNTYRUFAZQL-KNXALSJPSA-N 2 2 306.381 2.293 20 10 DECDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616375 647036299 /nfs/dbraw/zinc/03/62/99/647036299.db2.gz NEZYHXGQMRTEJH-HZMBPMFUSA-N 2 2 318.339 2.128 20 10 DECDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616375 647036302 /nfs/dbraw/zinc/03/63/02/647036302.db2.gz NEZYHXGQMRTEJH-HZMBPMFUSA-N 2 2 318.339 2.128 20 10 DECDLP CCN(CC)c1ccc(C[N@H+](C)C[C@H](O)C[NH+](C)CC)cc1 ZINC000846766488 651350410 /nfs/dbraw/zinc/35/04/10/651350410.db2.gz SRDYELDMXCQGKT-GOSISDBHSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)C[NH+](C)CC)cc1 ZINC000846766488 651350412 /nfs/dbraw/zinc/35/04/12/651350412.db2.gz SRDYELDMXCQGKT-GOSISDBHSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@H](O)C[N@H+](C)CC)cc1 ZINC000846766488 651350414 /nfs/dbraw/zinc/35/04/14/651350414.db2.gz SRDYELDMXCQGKT-GOSISDBHSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@H](O)C[N@@H+](C)CC)cc1 ZINC000846766488 651350416 /nfs/dbraw/zinc/35/04/16/651350416.db2.gz SRDYELDMXCQGKT-GOSISDBHSA-N 2 2 307.482 2.277 20 10 DECDLP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000848911581 651557005 /nfs/dbraw/zinc/55/70/05/651557005.db2.gz HGLFTBCLLFPENQ-DZGCQCFKSA-N 2 2 320.433 2.305 20 10 DECDLP C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)c1ccc(N2CCOCC2)cc1 ZINC000863540210 686517402 /nfs/dbraw/zinc/51/74/02/686517402.db2.gz CITGBLJWXLXWKX-QAPCUYQASA-N 2 2 315.461 2.458 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CC[NH2+]C23CCC3)c1 ZINC000863541238 686518461 /nfs/dbraw/zinc/51/84/61/686518461.db2.gz HPOMYOHJHQIZCN-NHYWBVRUSA-N 2 2 304.390 2.114 20 10 DECDLP Fc1cc(C[NH2+][C@]23CCC[C@H]2[NH2+]CC3)ccc1N1CCOCC1 ZINC000873229842 689190154 /nfs/dbraw/zinc/19/01/54/689190154.db2.gz HIQFMCYAOODYDL-MSOLQXFVSA-N 2 2 319.424 2.037 20 10 DECDLP CC[NH+](CC)CC[C@@H](CO)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000883161573 691445026 /nfs/dbraw/zinc/44/50/26/691445026.db2.gz VLGAWAHPHSODSK-HNNXBMFYSA-N 2 2 311.445 2.074 20 10 DECDLP Oc1cccc2c1[C@H]([NH2+][C@H]1C[NH2+]CC3(CCOCC3)C1)CC2 ZINC000925796124 693343728 /nfs/dbraw/zinc/34/37/28/693343728.db2.gz KSPOMKKTLAEJSC-HUUCEWRRSA-N 2 2 302.418 2.128 20 10 DECDLP CC[NH+](CC)C1CC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)CC1 ZINC001116437348 794957005 /nfs/dbraw/zinc/95/70/05/794957005.db2.gz ZSZPLOCTKWCSDA-QGZVFWFLSA-N 2 2 320.433 2.124 20 10 DECDLP COc1cc(C[N@@H+]2CCCC[C@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139259359 796351304 /nfs/dbraw/zinc/35/13/04/796351304.db2.gz SPRZYOCSHNYSAB-INIZCTEOSA-N 2 2 320.433 2.406 20 10 DECDLP COc1cc(C[N@H+]2CCCC[C@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139259359 796351310 /nfs/dbraw/zinc/35/13/10/796351310.db2.gz SPRZYOCSHNYSAB-INIZCTEOSA-N 2 2 320.433 2.406 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)CC1 ZINC001139409946 796372538 /nfs/dbraw/zinc/37/25/38/796372538.db2.gz WOXWZUVXXNIDGV-UHFFFAOYSA-N 2 2 308.429 2.349 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3Cc4ccncc4C3)cc2)CC1 ZINC001139409946 796372541 /nfs/dbraw/zinc/37/25/41/796372541.db2.gz WOXWZUVXXNIDGV-UHFFFAOYSA-N 2 2 308.429 2.349 20 10 DECDLP C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)C[C@H]1C[NH3+] ZINC001205146097 800305573 /nfs/dbraw/zinc/30/55/73/800305573.db2.gz OCVCTFPSUQVLND-WCBMZHEXSA-N 2 2 317.202 2.320 20 10 DECDLP C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)C[C@H]1C[NH3+] ZINC001205146097 800305575 /nfs/dbraw/zinc/30/55/75/800305575.db2.gz OCVCTFPSUQVLND-WCBMZHEXSA-N 2 2 317.202 2.320 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206622543 800567485 /nfs/dbraw/zinc/56/74/85/800567485.db2.gz FIBLQMCGSHCWGP-ZDUSSCGKSA-N 2 2 316.401 2.368 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206622543 800567489 /nfs/dbraw/zinc/56/74/89/800567489.db2.gz FIBLQMCGSHCWGP-ZDUSSCGKSA-N 2 2 316.401 2.368 20 10 DECDLP CC[N@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)cc(OC)c3O)C[C@@H]2C1 ZINC001233291402 802067106 /nfs/dbraw/zinc/06/71/06/802067106.db2.gz ZRLXQPLCQYPJJC-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[N@@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)cc(OC)c3O)C[C@@H]2C1 ZINC001233291402 802067112 /nfs/dbraw/zinc/06/71/12/802067112.db2.gz ZRLXQPLCQYPJJC-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@@H+](Cc3cc(Cl)cc(OC)c3O)C[C@@H]2C1 ZINC001233291402 802067119 /nfs/dbraw/zinc/06/71/19/802067119.db2.gz ZRLXQPLCQYPJJC-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@H+](Cc3cc(Cl)cc(OC)c3O)C[C@@H]2C1 ZINC001233291402 802067125 /nfs/dbraw/zinc/06/71/25/802067125.db2.gz ZRLXQPLCQYPJJC-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC[C@]23CCC[NH2+]C3)cc1OC ZINC001222253193 802661928 /nfs/dbraw/zinc/66/19/28/802661928.db2.gz NYERSRWTCNABLD-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC[C@]23CCC[NH2+]C3)cc1OC ZINC001222253193 802661931 /nfs/dbraw/zinc/66/19/31/802661931.db2.gz NYERSRWTCNABLD-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP CC[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCO1 ZINC001319931994 1140804653 /nfs/dbraw/zinc/80/46/53/1140804653.db2.gz GJCSCSRNVVDJLQ-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCO1 ZINC001319931994 1140804654 /nfs/dbraw/zinc/80/46/54/1140804654.db2.gz GJCSCSRNVVDJLQ-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844592 649853608 /nfs/dbraw/zinc/85/36/08/649853608.db2.gz RPXLFZVIUJSQNY-MAUKXSAKSA-N 2 2 305.466 2.250 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844592 649853610 /nfs/dbraw/zinc/85/36/10/649853610.db2.gz RPXLFZVIUJSQNY-MAUKXSAKSA-N 2 2 305.466 2.250 20 10 DECDLP COCC[N@H+](C)CCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293821078 403572340 /nfs/dbraw/zinc/57/23/40/403572340.db2.gz DGKWFZRBFZTGGR-UHFFFAOYSA-N 2 2 304.793 2.243 20 10 DECDLP COCC[N@@H+](C)CCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293821078 403572343 /nfs/dbraw/zinc/57/23/43/403572343.db2.gz DGKWFZRBFZTGGR-UHFFFAOYSA-N 2 2 304.793 2.243 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[N@@H+]1C1CCOCC1 ZINC000897229848 639262894 /nfs/dbraw/zinc/26/28/94/639262894.db2.gz XMCREDLHZAOPFH-LJQANCHMSA-N 2 2 317.477 2.404 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[N@H+]1C1CCOCC1 ZINC000897229848 639262898 /nfs/dbraw/zinc/26/28/98/639262898.db2.gz XMCREDLHZAOPFH-LJQANCHMSA-N 2 2 317.477 2.404 20 10 DECDLP CCOc1ccc(C[NH+]2CCC([N@H+](C)CCCO)CC2)c(O)c1 ZINC000769428747 641238736 /nfs/dbraw/zinc/23/87/36/641238736.db2.gz SSUGMVMHYMBCEH-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP CCOc1ccc(C[NH+]2CCC([N@@H+](C)CCCO)CC2)c(O)c1 ZINC000769428747 641238742 /nfs/dbraw/zinc/23/87/42/641238742.db2.gz SSUGMVMHYMBCEH-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817889348 647371769 /nfs/dbraw/zinc/37/17/69/647371769.db2.gz SSUCJHQKFNHMKM-YOEHRIQHSA-N 2 2 305.491 2.327 20 10 DECDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000817900379 647377211 /nfs/dbraw/zinc/37/72/11/647377211.db2.gz SCHWRBDMCVWLCW-RTBURBONSA-N 2 2 315.461 2.143 20 10 DECDLP CC(C)[C@@H](Cn1cccn1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940257 647388314 /nfs/dbraw/zinc/38/83/14/647388314.db2.gz FBSIKVMKYSNZNP-QZTJIDSGSA-N 2 2 315.465 2.263 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817945998 647390741 /nfs/dbraw/zinc/39/07/41/647390741.db2.gz PMWUBKFVRVVQLG-GOEBONIOSA-N 2 2 321.440 2.455 20 10 DECDLP C[C@@H]([NH2+][C@@H]1CCCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817984458 647400845 /nfs/dbraw/zinc/40/08/45/647400845.db2.gz TWAHGSOEIXVVFO-GDBMZVCRSA-N 2 2 321.440 2.455 20 10 DECDLP CN(C)c1ccc(C[N@H+](C[C@@H](O)C[NH+]2CCCC2)C2CC2)cc1 ZINC000917013931 647955471 /nfs/dbraw/zinc/95/54/71/647955471.db2.gz ITPIWIVLCXYIEV-IBGZPJMESA-N 2 2 317.477 2.174 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C[C@@H](O)C[NH+]2CCCC2)C2CC2)cc1 ZINC000917013931 647955476 /nfs/dbraw/zinc/95/54/76/647955476.db2.gz ITPIWIVLCXYIEV-IBGZPJMESA-N 2 2 317.477 2.174 20 10 DECDLP CCN(CC)c1ccc(C[N@H+](C)C[C@@H](O)C[NH+](C)CC)cc1 ZINC000846766490 651350372 /nfs/dbraw/zinc/35/03/72/651350372.db2.gz SRDYELDMXCQGKT-SFHVURJKSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)C[NH+](C)CC)cc1 ZINC000846766490 651350373 /nfs/dbraw/zinc/35/03/73/651350373.db2.gz SRDYELDMXCQGKT-SFHVURJKSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@@H](O)C[N@H+](C)CC)cc1 ZINC000846766490 651350374 /nfs/dbraw/zinc/35/03/74/651350374.db2.gz SRDYELDMXCQGKT-SFHVURJKSA-N 2 2 307.482 2.277 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@@H](O)C[N@@H+](C)CC)cc1 ZINC000846766490 651350375 /nfs/dbraw/zinc/35/03/75/651350375.db2.gz SRDYELDMXCQGKT-SFHVURJKSA-N 2 2 307.482 2.277 20 10 DECDLP C[N@@H+]1CCC[C@@H]2[C@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621999 694441850 /nfs/dbraw/zinc/44/18/50/694441850.db2.gz MVPNFDLYKXGNIG-RTBURBONSA-N 2 2 315.461 2.192 20 10 DECDLP C[N@H+]1CCC[C@@H]2[C@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621999 694441851 /nfs/dbraw/zinc/44/18/51/694441851.db2.gz MVPNFDLYKXGNIG-RTBURBONSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@@H]2[C@H]1CC[N@@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621999 694441855 /nfs/dbraw/zinc/44/18/55/694441855.db2.gz MVPNFDLYKXGNIG-RTBURBONSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@@H]2[C@H]1CC[N@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621999 694441856 /nfs/dbraw/zinc/44/18/56/694441856.db2.gz MVPNFDLYKXGNIG-RTBURBONSA-N 2 2 315.461 2.192 20 10 DECDLP C[C@H]1C[N@H+](CCC[NH2+]Cc2cc(F)c(F)cc2O)CCCO1 ZINC001180865964 795386740 /nfs/dbraw/zinc/38/67/40/795386740.db2.gz WTDDLFRARCEXTK-LBPRGKRZSA-N 2 2 314.376 2.261 20 10 DECDLP C[C@H]1C[N@@H+](CCC[NH2+]Cc2cc(F)c(F)cc2O)CCCO1 ZINC001180865964 795386747 /nfs/dbraw/zinc/38/67/47/795386747.db2.gz WTDDLFRARCEXTK-LBPRGKRZSA-N 2 2 314.376 2.261 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)cc1Cl ZINC001205777124 800417916 /nfs/dbraw/zinc/41/79/16/800417916.db2.gz AJNZBPNKVQNQBZ-JTQLQIEISA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)cc1Cl ZINC001205777124 800417919 /nfs/dbraw/zinc/41/79/19/800417919.db2.gz AJNZBPNKVQNQBZ-JTQLQIEISA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(Cl)c1 ZINC001205789333 800420946 /nfs/dbraw/zinc/42/09/46/800420946.db2.gz YFNJVDKLTMVOJO-SECBINFHSA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(Cl)c1 ZINC001205789333 800420948 /nfs/dbraw/zinc/42/09/48/800420948.db2.gz YFNJVDKLTMVOJO-SECBINFHSA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@@](F)(C[NH3+])C1 ZINC001206361232 800517958 /nfs/dbraw/zinc/51/79/58/800517958.db2.gz GUCJIMZMDPXLGT-QGZVFWFLSA-N 2 2 309.429 2.414 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCCC[C@@](F)(C[NH3+])C1 ZINC001206361232 800517962 /nfs/dbraw/zinc/51/79/62/800517962.db2.gz GUCJIMZMDPXLGT-QGZVFWFLSA-N 2 2 309.429 2.414 20 10 DECDLP COc1cc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)cc1O ZINC001231637582 801701574 /nfs/dbraw/zinc/70/15/74/801701574.db2.gz NIHMKYTVTSYQGO-CQSZACIVSA-N 2 2 316.357 2.155 20 10 DECDLP COc1cc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)cc1O ZINC001231637582 801701582 /nfs/dbraw/zinc/70/15/82/801701582.db2.gz NIHMKYTVTSYQGO-CQSZACIVSA-N 2 2 316.357 2.155 20 10 DECDLP C[N@H+]1C[C@@H]2C[NH+](Cc3cccc(C(F)(F)F)c3O)C[C@@H]2C1 ZINC001233418722 802111193 /nfs/dbraw/zinc/11/11/93/802111193.db2.gz SKSKMEGNQCAESA-TXEJJXNPSA-N 2 2 300.324 2.404 20 10 DECDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3cccc(C(F)(F)F)c3O)C[C@@H]2C1 ZINC001233418722 802111197 /nfs/dbraw/zinc/11/11/97/802111197.db2.gz SKSKMEGNQCAESA-TXEJJXNPSA-N 2 2 300.324 2.404 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2cc(O)c(O)cc2O)C1 ZINC001233487724 802129428 /nfs/dbraw/zinc/12/94/28/802129428.db2.gz PPZWUSCZPCNJQJ-ZDUSSCGKSA-N 2 2 316.357 2.160 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2cc(O)c(O)cc2O)C1 ZINC001233487724 802129432 /nfs/dbraw/zinc/12/94/32/802129432.db2.gz PPZWUSCZPCNJQJ-ZDUSSCGKSA-N 2 2 316.357 2.160 20 10 DECDLP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)C1 ZINC000273303911 130105520 /nfs/dbraw/zinc/10/55/20/130105520.db2.gz CGPJAMAWEINYSQ-OLZOCXBDSA-N 2 2 306.406 2.171 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000273362496 130111556 /nfs/dbraw/zinc/11/15/56/130111556.db2.gz DFAJSNYTFDHCNP-LBPRGKRZSA-N 2 2 308.422 2.417 20 10 DECDLP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000180069385 279372016 /nfs/dbraw/zinc/37/20/16/279372016.db2.gz IJPNGZXUGBDRIC-HNNXBMFYSA-N 2 2 323.868 2.257 20 10 DECDLP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000180069385 279372019 /nfs/dbraw/zinc/37/20/19/279372019.db2.gz IJPNGZXUGBDRIC-HNNXBMFYSA-N 2 2 323.868 2.257 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)cc1F ZINC000130994602 522182258 /nfs/dbraw/zinc/18/22/58/522182258.db2.gz PTDCINNTSAPPHH-INIZCTEOSA-N 2 2 321.440 2.046 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)cc1F ZINC000130994602 522182268 /nfs/dbraw/zinc/18/22/68/522182268.db2.gz PTDCINNTSAPPHH-INIZCTEOSA-N 2 2 321.440 2.046 20 10 DECDLP COc1ccc(N2CC[NH+](CCn3cc[nH+]c3C)CC2)cc1F ZINC000270818948 524425721 /nfs/dbraw/zinc/42/57/21/524425721.db2.gz ASCCBPCIJVREEC-UHFFFAOYSA-N 2 2 318.396 2.161 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCn2cc[nH+]c2C)c1 ZINC000273297559 536793504 /nfs/dbraw/zinc/79/35/04/536793504.db2.gz AMSLODMNUSQETB-LBPRGKRZSA-N 2 2 317.389 2.425 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(C(F)(F)F)C3)cc2)CC1 ZINC000894891618 637298754 /nfs/dbraw/zinc/29/87/54/637298754.db2.gz KVEJWTZZRPJWMI-UHFFFAOYSA-N 2 2 313.367 2.433 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cnn(C(C)(C)C)c2)cc1 ZINC000841044766 641466403 /nfs/dbraw/zinc/46/64/03/641466403.db2.gz YUDXNIAYOLPBFW-KRWDZBQOSA-N 2 2 315.465 2.494 20 10 DECDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360083 641895494 /nfs/dbraw/zinc/89/54/94/641895494.db2.gz RGQZHFJKLNTEOC-YMTOWFKASA-N 2 2 319.232 2.416 20 10 DECDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360083 641895500 /nfs/dbraw/zinc/89/55/00/641895500.db2.gz RGQZHFJKLNTEOC-YMTOWFKASA-N 2 2 319.232 2.416 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH2+]CC3CC3)CC2)cc1OC ZINC000843054324 650878520 /nfs/dbraw/zinc/87/85/20/650878520.db2.gz KRGKBEPIMDYSJR-UHFFFAOYSA-N 2 2 320.433 2.373 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCc3nn(C)cc32)cc1 ZINC000817943560 647389585 /nfs/dbraw/zinc/38/95/85/647389585.db2.gz VLQTUABSEQJFGU-IAGOWNOFSA-N 2 2 313.449 2.153 20 10 DECDLP C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(F)cc1O ZINC000817982042 647399748 /nfs/dbraw/zinc/39/97/48/647399748.db2.gz BFKJYBHKAGWUJZ-JEYLPNPQSA-N 2 2 321.440 2.398 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)cc1Cl ZINC000827698661 649070498 /nfs/dbraw/zinc/07/04/98/649070498.db2.gz ALFODENUUNETGP-HNNXBMFYSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1Cl ZINC000827698661 649070501 /nfs/dbraw/zinc/07/05/01/649070501.db2.gz ALFODENUUNETGP-HNNXBMFYSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c(Cl)c1 ZINC000827699523 649070927 /nfs/dbraw/zinc/07/09/27/649070927.db2.gz IGOGCFTVTATESN-AWEZNQCLSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c(Cl)c1 ZINC000827699523 649070933 /nfs/dbraw/zinc/07/09/33/649070933.db2.gz IGOGCFTVTATESN-AWEZNQCLSA-N 2 2 324.852 2.385 20 10 DECDLP CCc1cccc(C[NH2+]C[C@H]2C[N@H+](CC(C)C)CCO2)c1O ZINC000848891645 651548252 /nfs/dbraw/zinc/54/82/52/651548252.db2.gz WNZQUYPZZHVFRT-KRWDZBQOSA-N 2 2 306.450 2.401 20 10 DECDLP CCc1cccc(C[NH2+]C[C@H]2C[N@@H+](CC(C)C)CCO2)c1O ZINC000848891645 651548256 /nfs/dbraw/zinc/54/82/56/651548256.db2.gz WNZQUYPZZHVFRT-KRWDZBQOSA-N 2 2 306.450 2.401 20 10 DECDLP COc1cc(Br)cc(C[N@H+](C)CC(C)(C)[NH3+])c1O ZINC000849350323 651655750 /nfs/dbraw/zinc/65/57/50/651655750.db2.gz NRUWFIWGXQLABP-UHFFFAOYSA-N 2 2 317.227 2.332 20 10 DECDLP COc1cc(Br)cc(C[N@@H+](C)CC(C)(C)[NH3+])c1O ZINC000849350323 651655753 /nfs/dbraw/zinc/65/57/53/651655753.db2.gz NRUWFIWGXQLABP-UHFFFAOYSA-N 2 2 317.227 2.332 20 10 DECDLP CCC1([NH+]2CCOCC2)CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001356083533 1152056611 /nfs/dbraw/zinc/05/66/11/1152056611.db2.gz RJUDOERZOVTGTF-UHFFFAOYSA-N 2 2 303.450 2.346 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](F)[C@@H]([NH3+])CC1 ZINC001206173473 793477810 /nfs/dbraw/zinc/47/78/10/793477810.db2.gz HMIVRQOYTCOZQI-KGLIPLIRSA-N 2 2 320.364 2.068 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](F)[C@@H]([NH3+])CC1 ZINC001206173473 793477813 /nfs/dbraw/zinc/47/78/13/793477813.db2.gz HMIVRQOYTCOZQI-KGLIPLIRSA-N 2 2 320.364 2.068 20 10 DECDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500281 796228996 /nfs/dbraw/zinc/22/89/96/796228996.db2.gz WBKJXZDQOBQYPH-IEBWSBKVSA-N 2 2 315.461 2.049 20 10 DECDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500281 796229001 /nfs/dbraw/zinc/22/90/01/796229001.db2.gz WBKJXZDQOBQYPH-IEBWSBKVSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500281 796229008 /nfs/dbraw/zinc/22/90/08/796229008.db2.gz WBKJXZDQOBQYPH-IEBWSBKVSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500281 796229014 /nfs/dbraw/zinc/22/90/14/796229014.db2.gz WBKJXZDQOBQYPH-IEBWSBKVSA-N 2 2 315.461 2.049 20 10 DECDLP CC(C)(C)c1ccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222511191 802698177 /nfs/dbraw/zinc/69/81/77/802698177.db2.gz SIFBEIJYVCCWSU-IRXDYDNUSA-N 2 2 317.477 2.216 20 10 DECDLP COCC[N@H+](Cc1cc(F)cc(C)c1O)C1CC[NH+](C)CC1 ZINC001238060423 1138819450 /nfs/dbraw/zinc/81/94/50/1138819450.db2.gz ATGDHOPGAUSIFL-UHFFFAOYSA-N 2 2 310.413 2.382 20 10 DECDLP COCC[N@@H+](Cc1cc(F)cc(C)c1O)C1CC[NH+](C)CC1 ZINC001238060423 1138819451 /nfs/dbraw/zinc/81/94/51/1138819451.db2.gz ATGDHOPGAUSIFL-UHFFFAOYSA-N 2 2 310.413 2.382 20 10 DECDLP C[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789837 1141061951 /nfs/dbraw/zinc/06/19/51/1141061951.db2.gz KFKZNZFKCYUKSJ-CRAIPNDOSA-N 2 2 303.450 2.096 20 10 DECDLP C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789837 1141061961 /nfs/dbraw/zinc/06/19/61/1141061961.db2.gz KFKZNZFKCYUKSJ-CRAIPNDOSA-N 2 2 303.450 2.096 20 10 DECDLP Cc1ccc(O)c(C[NH+]2CCN(C3=[NH+]C[C@H](C)S3)CC2)c1 ZINC000093663188 402018467 /nfs/dbraw/zinc/01/84/67/402018467.db2.gz XBDUKZBXNFDSID-ZDUSSCGKSA-N 2 2 305.447 2.310 20 10 DECDLP COc1c(O)c(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000278390088 402863823 /nfs/dbraw/zinc/86/38/23/402863823.db2.gz MRJXVUAQUVAFFA-CYBMUJFWSA-N 2 2 323.393 2.225 20 10 DECDLP COc1c(O)c(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000278390088 402863824 /nfs/dbraw/zinc/86/38/24/402863824.db2.gz MRJXVUAQUVAFFA-CYBMUJFWSA-N 2 2 323.393 2.225 20 10 DECDLP COc1cccc(O)c1C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044001 650412728 /nfs/dbraw/zinc/41/27/28/650412728.db2.gz SPHHQWJSFATYLG-INIZCTEOSA-N 2 2 315.417 2.256 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000817941446 647388732 /nfs/dbraw/zinc/38/87/32/647388732.db2.gz JTEWUBQWKXUBLY-IAGOWNOFSA-N 2 2 303.450 2.301 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(C(F)(F)F)cc1O ZINC000817982808 647400029 /nfs/dbraw/zinc/40/00/29/647400029.db2.gz HNAVQXLFVZVPBQ-YPMHNXCESA-N 2 2 318.339 2.440 20 10 DECDLP CCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000850394897 651919271 /nfs/dbraw/zinc/91/92/71/651919271.db2.gz HPSAXHAKKHDSGQ-SFHVURJKSA-N 3 2 316.493 2.012 20 10 DECDLP CCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000850394897 651919279 /nfs/dbraw/zinc/91/92/79/651919279.db2.gz HPSAXHAKKHDSGQ-SFHVURJKSA-N 3 2 316.493 2.012 20 10 DECDLP CC[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cccc(Cl)c1O ZINC000854231223 652662667 /nfs/dbraw/zinc/66/26/67/652662667.db2.gz CQLQYCYNCDERMA-GFCCVEGCSA-N 2 2 322.796 2.241 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ncco1 ZINC000886274746 692042422 /nfs/dbraw/zinc/04/24/22/692042422.db2.gz ZWXAAWFEKHCAFJ-CQSZACIVSA-N 2 2 300.406 2.277 20 10 DECDLP CC(C)[C@H](C[NH2+][C@H](C)c1c(O)cccc1F)N1CC[NH+](C)CC1 ZINC000886500215 692094394 /nfs/dbraw/zinc/09/43/94/692094394.db2.gz LHMVSWZOSYMLMN-ZBFHGGJFSA-N 2 2 323.456 2.454 20 10 DECDLP C[C@H](C[NH2+][C@H](C)c1c(O)cccc1F)CN1CC[NH+](C)CC1 ZINC000886522271 692100754 /nfs/dbraw/zinc/10/07/54/692100754.db2.gz GFFSPFVFDLDVMX-ZIAGYGMSSA-N 2 2 309.429 2.065 20 10 DECDLP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C34CCC4)cc2)CC1 ZINC000925715118 693328628 /nfs/dbraw/zinc/32/86/28/693328628.db2.gz DJKOSOBILHVLHQ-GOSISDBHSA-N 2 2 315.461 2.022 20 10 DECDLP COc1cc[nH+]cc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167431404 777026196 /nfs/dbraw/zinc/02/61/96/777026196.db2.gz XYCHRXVUUZVORQ-UHFFFAOYSA-N 2 2 312.417 2.454 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2c(O)cc(O)cc2O)C1 ZINC001144515992 790943726 /nfs/dbraw/zinc/94/37/26/790943726.db2.gz MBZOOZUVUMSMDM-CYBMUJFWSA-N 2 2 316.357 2.160 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2c(O)cc(O)cc2O)C1 ZINC001144515992 790943733 /nfs/dbraw/zinc/94/37/33/790943733.db2.gz MBZOOZUVUMSMDM-CYBMUJFWSA-N 2 2 316.357 2.160 20 10 DECDLP COc1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139259350 796351410 /nfs/dbraw/zinc/35/14/10/796351410.db2.gz SFDWHJQCXIZFEI-CHWSQXEVSA-N 2 2 308.422 2.072 20 10 DECDLP COc1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cc(C[NH+](C)C)c1O ZINC001139259350 796351414 /nfs/dbraw/zinc/35/14/14/796351414.db2.gz SFDWHJQCXIZFEI-CHWSQXEVSA-N 2 2 308.422 2.072 20 10 DECDLP CCOc1ccc(N2CC[NH+](Cc3c[nH+]ccc3N)CC2)cc1 ZINC001209733160 801266794 /nfs/dbraw/zinc/26/67/94/801266794.db2.gz PUKSJKZJWXDJNN-UHFFFAOYSA-N 2 2 312.417 2.215 20 10 DECDLP C[C@@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@@H](C)O1 ZINC001236931360 1138460035 /nfs/dbraw/zinc/46/00/35/1138460035.db2.gz JYQNWVRTANNIMQ-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP COCCC[N@H+](Cc1ccc2c(c1)CCCN2C)[C@H]1CC[NH2+]C1 ZINC001236946359 1138463797 /nfs/dbraw/zinc/46/37/97/1138463797.db2.gz MEPCFOPDZMGMAU-SFHVURJKSA-N 2 2 317.477 2.269 20 10 DECDLP COCCC[N@@H+](Cc1ccc2c(c1)CCCN2C)[C@H]1CC[NH2+]C1 ZINC001236946359 1138463806 /nfs/dbraw/zinc/46/38/06/1138463806.db2.gz MEPCFOPDZMGMAU-SFHVURJKSA-N 2 2 317.477 2.269 20 10 DECDLP C[C@H]1OCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H]1C ZINC001254010943 1143024858 /nfs/dbraw/zinc/02/48/58/1143024858.db2.gz QLFGCCOAZUKSKZ-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@H]1OCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H]1C ZINC001254010943 1143024868 /nfs/dbraw/zinc/02/48/68/1143024868.db2.gz QLFGCCOAZUKSKZ-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@H](O)C[NH+]2CCCC2)cc1F ZINC001308223231 1147457429 /nfs/dbraw/zinc/45/74/29/1147457429.db2.gz VGMLSEKGBZLJHJ-INIZCTEOSA-N 2 2 323.456 2.218 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cn2cc[nH+]c2)c1 ZINC000273413951 130118993 /nfs/dbraw/zinc/11/89/93/130118993.db2.gz QJPZTVFBWVQVQD-NWDGAFQWSA-N 2 2 303.362 2.115 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592801 130142312 /nfs/dbraw/zinc/14/23/12/130142312.db2.gz PQUNOARZOKNHJA-YOEHRIQHSA-N 2 2 317.477 2.167 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592801 130142314 /nfs/dbraw/zinc/14/23/14/130142314.db2.gz PQUNOARZOKNHJA-YOEHRIQHSA-N 2 2 317.477 2.167 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905394 403120652 /nfs/dbraw/zinc/12/06/52/403120652.db2.gz LSMMOVHZADFFMH-MSOLQXFVSA-N 2 2 304.482 2.039 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905394 403120654 /nfs/dbraw/zinc/12/06/54/403120654.db2.gz LSMMOVHZADFFMH-MSOLQXFVSA-N 2 2 304.482 2.039 20 10 DECDLP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3cc(Cl)ccc3O)CC2)C1 ZINC000367472808 405061645 /nfs/dbraw/zinc/06/16/45/405061645.db2.gz WFMLLHNNGLXXIO-INIZCTEOSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3cc(Cl)ccc3O)CC2)C1 ZINC000367472808 405061649 /nfs/dbraw/zinc/06/16/49/405061649.db2.gz WFMLLHNNGLXXIO-INIZCTEOSA-N 2 2 323.868 2.257 20 10 DECDLP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000180031624 524392006 /nfs/dbraw/zinc/39/20/06/524392006.db2.gz SRPRUPUFYCDIFI-MRXNPFEDSA-N 2 2 304.434 2.245 20 10 DECDLP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000180031624 524392015 /nfs/dbraw/zinc/39/20/15/524392015.db2.gz SRPRUPUFYCDIFI-MRXNPFEDSA-N 2 2 304.434 2.245 20 10 DECDLP COc1ccc(N2CC[NH+](CCCn3cc[nH+]c3)CC2)cc1F ZINC000182841428 524423734 /nfs/dbraw/zinc/42/37/34/524423734.db2.gz WCHXHNUUYNRCOT-UHFFFAOYSA-N 2 2 318.396 2.243 20 10 DECDLP C[C@@H]([NH2+]CC[NH+]1CCCC1)c1ccc(N2CCOCC2)cc1 ZINC000178306785 625612540 /nfs/dbraw/zinc/61/25/40/625612540.db2.gz VIZRAFQVGFZZJZ-MRXNPFEDSA-N 2 2 303.450 2.270 20 10 DECDLP COc1ccc(C[NH+]2CCC([NH2+]C(C)C)CC2)c(O)c1OC ZINC000891875779 624640282 /nfs/dbraw/zinc/64/02/82/624640282.db2.gz GRBUZNRHAPKXRM-UHFFFAOYSA-N 2 2 308.422 2.372 20 10 DECDLP COc1ccc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000841042349 650411593 /nfs/dbraw/zinc/41/15/93/650411593.db2.gz INXCFVGKPZULBJ-MRXNPFEDSA-N 2 2 315.417 2.256 20 10 DECDLP CCCn1cc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841043380 641445200 /nfs/dbraw/zinc/44/52/00/641445200.db2.gz OEGLVTWQYGFGQI-QGZVFWFLSA-N 2 2 301.438 2.149 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817890396 647372161 /nfs/dbraw/zinc/37/21/61/647372161.db2.gz XJORDKSLHOQTCU-PBHICJAKSA-N 2 2 305.491 2.470 20 10 DECDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C[C@@H]1COCC[NH2+]1 ZINC000817934998 647387035 /nfs/dbraw/zinc/38/70/35/647387035.db2.gz SCLVUURAFUEALC-XYJFISCASA-N 2 2 319.493 2.349 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCc3nn(C)cc32)cc1 ZINC000817943561 647389834 /nfs/dbraw/zinc/38/98/34/647389834.db2.gz VLQTUABSEQJFGU-IRXDYDNUSA-N 2 2 313.449 2.153 20 10 DECDLP C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1cccc(Cl)c1O ZINC000826902276 648944885 /nfs/dbraw/zinc/94/48/85/648944885.db2.gz JQPCOSFPMMRMFB-ZDUSSCGKSA-N 2 2 313.873 2.407 20 10 DECDLP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+]([C@@H]3CCOC3)CC1)CC2 ZINC000850554757 651952859 /nfs/dbraw/zinc/95/28/59/651952859.db2.gz FQLJXMDBOKHDAZ-CVEARBPZSA-N 2 2 302.418 2.222 20 10 DECDLP Cc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c(O)c1 ZINC000877619876 690170086 /nfs/dbraw/zinc/17/00/86/690170086.db2.gz BADLINYDZBZNLW-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c(O)c1 ZINC000877619876 690170089 /nfs/dbraw/zinc/17/00/89/690170089.db2.gz BADLINYDZBZNLW-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925505147 693285175 /nfs/dbraw/zinc/28/51/75/693285175.db2.gz REELQWUOMUFPCL-SFHVURJKSA-N 2 2 317.477 2.125 20 10 DECDLP COc1ccc(N2CC[C@H]([NH2+][C@H]3CC[NH2+]C34CCC4)C2)cc1 ZINC000925710047 693327997 /nfs/dbraw/zinc/32/79/97/693327997.db2.gz BGXVUYDFVBGTJG-YOEHRIQHSA-N 2 2 301.434 2.148 20 10 DECDLP OC1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C34CCC4)cc2)CC1 ZINC000925715119 693328582 /nfs/dbraw/zinc/32/85/82/693328582.db2.gz DJKOSOBILHVLHQ-SFHVURJKSA-N 2 2 315.461 2.022 20 10 DECDLP [NH3+][C@@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@H]1F ZINC001206172784 793473562 /nfs/dbraw/zinc/47/35/62/793473562.db2.gz BZFAFEYKTKMEPM-VXGBXAGGSA-N 2 2 317.202 2.416 20 10 DECDLP [NH3+][C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)CC[C@H]1F ZINC001206172784 793473567 /nfs/dbraw/zinc/47/35/67/793473567.db2.gz BZFAFEYKTKMEPM-VXGBXAGGSA-N 2 2 317.202 2.416 20 10 DECDLP COc1cc(C[N@@H+]2CCCC[C@@](F)(C[NH3+])C2)c(O)c(OC)c1 ZINC001206371820 795075708 /nfs/dbraw/zinc/07/57/08/795075708.db2.gz WOLAYMXABWZDSD-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(C[N@H+]2CCCC[C@@](F)(C[NH3+])C2)c(O)c(OC)c1 ZINC001206371820 795075712 /nfs/dbraw/zinc/07/57/12/795075712.db2.gz WOLAYMXABWZDSD-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP Cc1[nH+]ccn1CC[NH2+]Cc1c(O)cccc1Br ZINC000706807764 1086651968 /nfs/dbraw/zinc/65/19/68/1086651968.db2.gz DZIBCMQHPHLAOF-UHFFFAOYSA-N 2 2 310.195 2.449 20 10 DECDLP C[NH+](C)Cc1ccc(N2CC[NH+](C)CC2)c(Br)c1 ZINC001237089664 1138502143 /nfs/dbraw/zinc/50/21/43/1138502143.db2.gz JDZSVXSMIPNYSW-UHFFFAOYSA-N 2 2 312.255 2.263 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[N@@H+](C3CC3)C[C@H]2C)c1 ZINC000273555682 130136781 /nfs/dbraw/zinc/13/67/81/130136781.db2.gz GWZIPLLPMYMSDY-WQGACYEGSA-N 2 2 318.417 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[N@H+](C3CC3)C[C@H]2C)c1 ZINC000273555682 130136783 /nfs/dbraw/zinc/13/67/83/130136783.db2.gz GWZIPLLPMYMSDY-WQGACYEGSA-N 2 2 318.417 2.312 20 10 DECDLP CC[N@H+](CCO)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000274436028 130234216 /nfs/dbraw/zinc/23/42/16/130234216.db2.gz TURAQCXOSYLVHU-UHFFFAOYSA-N 2 2 314.429 2.463 20 10 DECDLP CC[N@@H+](CCO)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000274436028 130234219 /nfs/dbraw/zinc/23/42/19/130234219.db2.gz TURAQCXOSYLVHU-UHFFFAOYSA-N 2 2 314.429 2.463 20 10 DECDLP Oc1cc2c(cc1C[NH+]1CCC(n3cc[nH+]c3)CC1)OCO2 ZINC000152097006 402075178 /nfs/dbraw/zinc/07/51/78/402075178.db2.gz AIASKNUCPUPAJV-UHFFFAOYSA-N 2 2 301.346 2.155 20 10 DECDLP Cc1cccc(C[NH+]2CCN(C3=[NH+]C[C@H](C)S3)CC2)c1O ZINC000180447909 524399548 /nfs/dbraw/zinc/39/95/48/524399548.db2.gz YVWHQINMGRSRQC-ZDUSSCGKSA-N 2 2 305.447 2.310 20 10 DECDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@H+](CC(C)C)CCO2)c1O ZINC000894140217 636278573 /nfs/dbraw/zinc/27/85/73/636278573.db2.gz IZASLQRDWRPVGU-INIZCTEOSA-N 2 2 322.449 2.156 20 10 DECDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@@H+](CC(C)C)CCO2)c1O ZINC000894140217 636278583 /nfs/dbraw/zinc/27/85/83/636278583.db2.gz IZASLQRDWRPVGU-INIZCTEOSA-N 2 2 322.449 2.156 20 10 DECDLP COC(=O)c1c(C[NH2+]CCC[NH+](C)C)c2cc(F)ccc2n1C ZINC000894146130 636294537 /nfs/dbraw/zinc/29/45/37/636294537.db2.gz MJLCATRYJDSBOE-UHFFFAOYSA-N 2 2 321.396 2.145 20 10 DECDLP C[NH2+]C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000923424145 637169772 /nfs/dbraw/zinc/16/97/72/637169772.db2.gz OJONQCFRLNHHKP-GOSISDBHSA-N 2 2 303.450 2.097 20 10 DECDLP C[NH2+]C[C@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000923424145 637169778 /nfs/dbraw/zinc/16/97/78/637169778.db2.gz OJONQCFRLNHHKP-GOSISDBHSA-N 2 2 303.450 2.097 20 10 DECDLP [NH3+]C[C@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000841028336 650408092 /nfs/dbraw/zinc/40/80/92/650408092.db2.gz OWFQPIZXLZKADM-HNNXBMFYSA-N 2 2 318.421 2.412 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H](C[NH3+])C2CCCCC2)ccc1[N+](=O)[O-] ZINC000841039116 650411595 /nfs/dbraw/zinc/41/15/95/650411595.db2.gz AXQRIBQYUTWLPA-ZDUSSCGKSA-N 2 2 323.393 2.306 20 10 DECDLP Oc1c(Br)cccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000841080069 650424844 /nfs/dbraw/zinc/42/48/44/650424844.db2.gz QCQVOUKCCKWWBZ-GFCCVEGCSA-N 2 2 311.223 2.386 20 10 DECDLP CCn1nc(C)c(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000841043681 641451443 /nfs/dbraw/zinc/45/14/43/641451443.db2.gz QAINFLPTKNAPNC-GOSISDBHSA-N 2 2 315.465 2.375 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@@H+]1C ZINC000898447181 641665173 /nfs/dbraw/zinc/66/51/73/641665173.db2.gz GJHJVUHGEAEERR-SZVBFZGTSA-N 2 2 318.509 2.428 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@H+]1C ZINC000898447181 641665178 /nfs/dbraw/zinc/66/51/78/641665178.db2.gz GJHJVUHGEAEERR-SZVBFZGTSA-N 2 2 318.509 2.428 20 10 DECDLP C[C@@H]([NH2+]CC1([NH3+])CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000902416930 643032573 /nfs/dbraw/zinc/03/25/73/643032573.db2.gz PRFUDVQDVGHDAB-GFCCVEGCSA-N 2 2 309.841 2.319 20 10 DECDLP CC[C@@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810216213 646340291 /nfs/dbraw/zinc/34/02/91/646340291.db2.gz FUHSPPDKVNRHJM-WCQYABFASA-N 2 2 320.355 2.374 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817893084 647373532 /nfs/dbraw/zinc/37/35/32/647373532.db2.gz DNICTRBYGNIUFI-GUYCJALGSA-N 2 2 321.440 2.017 20 10 DECDLP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892842 647373769 /nfs/dbraw/zinc/37/37/69/647373769.db2.gz WERZZUVMYDRIFX-RKVPGOIHSA-N 2 2 303.450 2.314 20 10 DECDLP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892845 647373860 /nfs/dbraw/zinc/37/38/60/647373860.db2.gz WERZZUVMYDRIFX-RLFYNMQTSA-N 2 2 303.450 2.314 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C2CCC3(CC2)OCCO3)cc1 ZINC000817940759 647388273 /nfs/dbraw/zinc/38/82/73/647388273.db2.gz HSEDJVJESAFDOI-KRWDZBQOSA-N 2 2 319.449 2.028 20 10 DECDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817967489 647395643 /nfs/dbraw/zinc/39/56/43/647395643.db2.gz JMIDOYAWODKPIP-GRDNDAEWSA-N 2 2 321.440 2.311 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c(Cl)c1 ZINC000827699525 649071284 /nfs/dbraw/zinc/07/12/84/649071284.db2.gz IGOGCFTVTATESN-CQSZACIVSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(Cl)c1 ZINC000827699525 649071286 /nfs/dbraw/zinc/07/12/86/649071286.db2.gz IGOGCFTVTATESN-CQSZACIVSA-N 2 2 324.852 2.385 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)cc1F ZINC000873226787 689188091 /nfs/dbraw/zinc/18/80/91/689188091.db2.gz BKVRVJLWFBZHAT-RYUDHWBXSA-N 2 2 319.346 2.461 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)cc1F ZINC000873226787 689188093 /nfs/dbraw/zinc/18/80/93/689188093.db2.gz BKVRVJLWFBZHAT-RYUDHWBXSA-N 2 2 319.346 2.461 20 10 DECDLP C[C@@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877154681 690032048 /nfs/dbraw/zinc/03/20/48/690032048.db2.gz WXJHOYLECZCHPR-MRXNPFEDSA-N 2 2 317.477 2.079 20 10 DECDLP C[C@@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877154681 690032049 /nfs/dbraw/zinc/03/20/49/690032049.db2.gz WXJHOYLECZCHPR-MRXNPFEDSA-N 2 2 317.477 2.079 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925507083 693285602 /nfs/dbraw/zinc/28/56/02/693285602.db2.gz YFCDOVRRERZPPX-HNAYVOBHSA-N 2 2 317.477 2.125 20 10 DECDLP Cc1ccc(C)n1-c1ccc(-c2noc([C@H]3C[NH2+]C[C@@H]3[NH3+])n2)cc1 ZINC001211755647 778836265 /nfs/dbraw/zinc/83/62/65/778836265.db2.gz XFDZMRDREUQNMB-HOTGVXAUSA-N 2 2 323.400 2.158 20 10 DECDLP C[C@]1([NH3+])CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001204801352 779950955 /nfs/dbraw/zinc/95/09/55/779950955.db2.gz NXUXXDXTCGIEAK-ZDUSSCGKSA-N 2 2 304.312 2.256 20 10 DECDLP C[C@]1([NH3+])CC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001204801352 779950975 /nfs/dbraw/zinc/95/09/75/779950975.db2.gz NXUXXDXTCGIEAK-ZDUSSCGKSA-N 2 2 304.312 2.256 20 10 DECDLP CC[N@H+](C)C1CC[NH+](Cc2c(O)cc(OC)cc2OC)CC1 ZINC001141032964 796622546 /nfs/dbraw/zinc/62/25/46/796622546.db2.gz VCGVOQVVMXPCNW-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](C)C1CC[NH+](Cc2c(O)cc(OC)cc2OC)CC1 ZINC001141032964 796622547 /nfs/dbraw/zinc/62/25/47/796622547.db2.gz VCGVOQVVMXPCNW-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP Oc1ccccc1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccn3)C[C@@H]2C1 ZINC001203551862 800079352 /nfs/dbraw/zinc/07/93/52/800079352.db2.gz RCIRBXYEFKTNLG-CALCHBBNSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccn3)C[C@@H]2C1 ZINC001203551862 800079360 /nfs/dbraw/zinc/07/93/60/800079360.db2.gz RCIRBXYEFKTNLG-CALCHBBNSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccn3)C[C@@H]2C1 ZINC001203551862 800079367 /nfs/dbraw/zinc/07/93/67/800079367.db2.gz RCIRBXYEFKTNLG-CALCHBBNSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccn3)C[C@@H]2C1 ZINC001203551862 800079376 /nfs/dbraw/zinc/07/93/76/800079376.db2.gz RCIRBXYEFKTNLG-CALCHBBNSA-N 2 2 309.413 2.351 20 10 DECDLP [NH3+][C@@H]1CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205123432 800301231 /nfs/dbraw/zinc/30/12/31/800301231.db2.gz AWRJQISTIYNTAU-SNVBAGLBSA-N 2 2 315.211 2.174 20 10 DECDLP [NH3+][C@@H]1CCC[N@@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205123432 800301239 /nfs/dbraw/zinc/30/12/39/800301239.db2.gz AWRJQISTIYNTAU-SNVBAGLBSA-N 2 2 315.211 2.174 20 10 DECDLP CN(C)c1cc(F)c(C[NH2+][C@H]2CCn3cc[nH+]c3C2)cc1F ZINC001331277799 1149409618 /nfs/dbraw/zinc/40/96/18/1149409618.db2.gz RFKPFFDGCKJHLZ-LBPRGKRZSA-N 2 2 306.360 2.332 20 10 DECDLP OCCC[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001324379096 1142065770 /nfs/dbraw/zinc/06/57/70/1142065770.db2.gz SNDAQZDFRKXBAZ-LJQANCHMSA-N 2 2 317.477 2.223 20 10 DECDLP OCCC[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001324379096 1142065780 /nfs/dbraw/zinc/06/57/80/1142065780.db2.gz SNDAQZDFRKXBAZ-LJQANCHMSA-N 2 2 317.477 2.223 20 10 DECDLP COc1c(O)c(C[NH2+]C2CC[NH+](C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000278609112 402868981 /nfs/dbraw/zinc/86/89/81/402868981.db2.gz DPSXJSJQZPFOMR-UHFFFAOYSA-N 2 2 321.377 2.025 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(F)cc1O ZINC000367588249 405095141 /nfs/dbraw/zinc/09/51/41/405095141.db2.gz LRJKQWFHWLRLMT-DZKIICNBSA-N 2 2 308.397 2.435 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(F)cc1O ZINC000367588249 405095148 /nfs/dbraw/zinc/09/51/48/405095148.db2.gz LRJKQWFHWLRLMT-DZKIICNBSA-N 2 2 308.397 2.435 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000423083695 230344639 /nfs/dbraw/zinc/34/46/39/230344639.db2.gz GISHGMGDTBUDET-RBUKOAKNSA-N 2 2 313.445 2.343 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCn2cc[nH+]c2C)c1 ZINC000273604799 536793491 /nfs/dbraw/zinc/79/34/91/536793491.db2.gz SYBAUBJDMBTCGP-NSHDSACASA-N 2 2 303.362 2.035 20 10 DECDLP Cc1cc(O)c(C[NH2+]CCC[NH+]2CCC(O)CC2)c(Cl)c1 ZINC000840885013 650371185 /nfs/dbraw/zinc/37/11/85/650371185.db2.gz SJWMZHIAIPDHLG-UHFFFAOYSA-N 2 2 312.841 2.290 20 10 DECDLP COc1cc(Br)cc(C[NH2+][C@@H]2CCC[NH2+]C2)c1O ZINC000841041654 650411670 /nfs/dbraw/zinc/41/16/70/650411670.db2.gz CVWSESZWYRTGDP-LLVKDONJSA-N 2 2 315.211 2.005 20 10 DECDLP COc1ccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)cc1C ZINC000903974241 643531900 /nfs/dbraw/zinc/53/19/00/643531900.db2.gz MXFMNVNHYRSQQN-MRXNPFEDSA-N 2 2 304.434 2.252 20 10 DECDLP COc1ccc(N2CC[NH+](C[C@]3(C)CCC[NH2+]C3)CC2)cc1F ZINC000904346409 643640994 /nfs/dbraw/zinc/64/09/94/643640994.db2.gz TYBXZCQRSSCVDS-GOSISDBHSA-N 2 2 321.440 2.346 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000311211903 646811705 /nfs/dbraw/zinc/81/17/05/646811705.db2.gz LMRJEHXCWSADQF-GXFFZTMASA-N 2 2 311.223 2.339 20 10 DECDLP C[C@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898397 647376447 /nfs/dbraw/zinc/37/64/47/647376447.db2.gz HNBPQJZEQJMKAW-NVXWUHKLSA-N 2 2 303.450 2.143 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)cc1 ZINC000817984482 647400389 /nfs/dbraw/zinc/40/03/89/647400389.db2.gz YMAUAOLEAVTZNP-YJBOKZPZSA-N 2 2 303.450 2.316 20 10 DECDLP CCc1cccc(C[NH2+]C[C@@H]2C[N@H+](CC(C)C)CCO2)c1O ZINC000848891646 651547592 /nfs/dbraw/zinc/54/75/92/651547592.db2.gz WNZQUYPZZHVFRT-QGZVFWFLSA-N 2 2 306.450 2.401 20 10 DECDLP CCc1cccc(C[NH2+]C[C@@H]2C[N@@H+](CC(C)C)CCO2)c1O ZINC000848891646 651547594 /nfs/dbraw/zinc/54/75/94/651547594.db2.gz WNZQUYPZZHVFRT-QGZVFWFLSA-N 2 2 306.450 2.401 20 10 DECDLP Oc1ccc(Cl)cc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC000119521395 684082703 /nfs/dbraw/zinc/08/27/03/684082703.db2.gz MVTKHOSPQAYZPJ-UHFFFAOYSA-N 2 2 323.868 2.259 20 10 DECDLP Oc1ccccc1C[N@H+](C[C@@H]1CCCO1)CC12CC(C1)C[NH2+]2 ZINC000873209791 689184569 /nfs/dbraw/zinc/18/45/69/689184569.db2.gz RPHGXTOZCQPINB-HQVVEAJESA-N 2 2 302.418 2.125 20 10 DECDLP Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)CC12CC(C1)C[NH2+]2 ZINC000873209791 689184571 /nfs/dbraw/zinc/18/45/71/689184571.db2.gz RPHGXTOZCQPINB-HQVVEAJESA-N 2 2 302.418 2.125 20 10 DECDLP COc1cc(C[N@@H+]2CCOC(C)(C)C2)cc(C[NH+](C)C)c1O ZINC001139253324 796348921 /nfs/dbraw/zinc/34/89/21/796348921.db2.gz QVMFOPMSMGGYMJ-UHFFFAOYSA-N 2 2 308.422 2.073 20 10 DECDLP COc1cc(C[N@H+]2CCOC(C)(C)C2)cc(C[NH+](C)C)c1O ZINC001139253324 796348925 /nfs/dbraw/zinc/34/89/25/796348925.db2.gz QVMFOPMSMGGYMJ-UHFFFAOYSA-N 2 2 308.422 2.073 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC[N@@H+]3C)cc2)CC1 ZINC001474289293 1060843601 /nfs/dbraw/zinc/84/36/01/1060843601.db2.gz ULDYUDIRGDZKCC-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC[N@H+]3C)cc2)CC1 ZINC001474289293 1060843613 /nfs/dbraw/zinc/84/36/13/1060843613.db2.gz ULDYUDIRGDZKCC-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP Oc1c(Cl)cccc1C[NH2+][C@H]1CCOC2(CC[NH2+]CC2)C1 ZINC001580885492 1076013586 /nfs/dbraw/zinc/01/35/86/1076013586.db2.gz AHUZJVODNVPHDB-ZDUSSCGKSA-N 2 2 310.825 2.436 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@H+](C)CCN2C)cc1Cl ZINC001660047244 1080259980 /nfs/dbraw/zinc/25/99/80/1080259980.db2.gz HMOWUXZTAPESSE-SWLSCSKDSA-N 2 2 311.857 2.078 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1Cl ZINC001660047244 1080259987 /nfs/dbraw/zinc/25/99/87/1080259987.db2.gz HMOWUXZTAPESSE-SWLSCSKDSA-N 2 2 311.857 2.078 20 10 DECDLP CCO[C@@H](C[NH2+]Cc1ccc(N2CCCC2)cc1)C[NH+](C)C ZINC001119614495 1090452875 /nfs/dbraw/zinc/45/28/75/1090452875.db2.gz BRIBZFAFMXMCPO-SFHVURJKSA-N 2 2 305.466 2.343 20 10 DECDLP C[C@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C[C@@H]1n1cc[nH+]c1 ZINC000121707235 402049764 /nfs/dbraw/zinc/04/97/64/402049764.db2.gz QSVCFCBOYXSXPM-JSGCOSHPSA-N 2 2 315.373 2.401 20 10 DECDLP C[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@@H]1n1cc[nH+]c1 ZINC000121707235 402049767 /nfs/dbraw/zinc/04/97/67/402049767.db2.gz QSVCFCBOYXSXPM-JSGCOSHPSA-N 2 2 315.373 2.401 20 10 DECDLP COc1c(O)c(C[N@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510727 286186738 /nfs/dbraw/zinc/18/67/38/286186738.db2.gz POEOHDFYNMTHIU-YPMHNXCESA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510727 286186739 /nfs/dbraw/zinc/18/67/39/286186739.db2.gz POEOHDFYNMTHIU-YPMHNXCESA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510727 286186740 /nfs/dbraw/zinc/18/67/40/286186740.db2.gz POEOHDFYNMTHIU-YPMHNXCESA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510727 286186741 /nfs/dbraw/zinc/18/67/41/286186741.db2.gz POEOHDFYNMTHIU-YPMHNXCESA-N 2 2 323.393 2.081 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365589 402998274 /nfs/dbraw/zinc/99/82/74/402998274.db2.gz BJFVIMUJTBWMNI-ZBFHGGJFSA-N 2 2 313.445 2.442 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365589 402998276 /nfs/dbraw/zinc/99/82/76/402998276.db2.gz BJFVIMUJTBWMNI-ZBFHGGJFSA-N 2 2 313.445 2.442 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+](C)CCCn2cc[nH+]c2)c1O ZINC000181113510 518283275 /nfs/dbraw/zinc/28/32/75/518283275.db2.gz MBPGXPISWGBACJ-UHFFFAOYSA-N 2 2 305.353 2.453 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+](C)CCCn2cc[nH+]c2)c1O ZINC000181113510 518283280 /nfs/dbraw/zinc/28/32/80/518283280.db2.gz MBPGXPISWGBACJ-UHFFFAOYSA-N 2 2 305.353 2.453 20 10 DECDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000311211902 625586532 /nfs/dbraw/zinc/58/65/32/625586532.db2.gz LMRJEHXCWSADQF-GWCFXTLKSA-N 2 2 311.223 2.339 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000311211902 625586537 /nfs/dbraw/zinc/58/65/37/625586537.db2.gz LMRJEHXCWSADQF-GWCFXTLKSA-N 2 2 311.223 2.339 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c[nH]nc3c2)cc1 ZINC000841044587 650412518 /nfs/dbraw/zinc/41/25/18/650412518.db2.gz WNCMHPPCRWOXOR-KRWDZBQOSA-N 2 2 309.417 2.419 20 10 DECDLP [NH3+][C@@H](CC(F)F)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000903905478 643503823 /nfs/dbraw/zinc/50/38/23/643503823.db2.gz GTZGMJAIATUQMA-KBPBESRZSA-N 2 2 314.376 2.356 20 10 DECDLP [NH3+][C@@H](CC(F)F)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000903905478 643503825 /nfs/dbraw/zinc/50/38/25/643503825.db2.gz GTZGMJAIATUQMA-KBPBESRZSA-N 2 2 314.376 2.356 20 10 DECDLP [NH3+]C[C@H]1CC2(CO1)CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC000904392466 643652509 /nfs/dbraw/zinc/65/25/09/643652509.db2.gz RJHORHNFXFKPJP-CYBMUJFWSA-N 2 2 310.825 2.375 20 10 DECDLP c1cc2c(cc1C[NH2+][C@@H]1C[NH2+]CC3(CCOCC3)C1)CCCO2 ZINC000904388260 643657815 /nfs/dbraw/zinc/65/78/15/643657815.db2.gz GURMHVBIPQJXJA-KRWDZBQOSA-N 2 2 316.445 2.260 20 10 DECDLP C[C@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046165 650876367 /nfs/dbraw/zinc/87/63/67/650876367.db2.gz PAKCEBLVVXIDPJ-QFBILLFUSA-N 3 2 316.493 2.140 20 10 DECDLP C[C@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046165 650876370 /nfs/dbraw/zinc/87/63/70/650876370.db2.gz PAKCEBLVVXIDPJ-QFBILLFUSA-N 3 2 316.493 2.140 20 10 DECDLP Cn1c[nH+]cc1CC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000809575927 646240643 /nfs/dbraw/zinc/24/06/43/646240643.db2.gz NGANQWZDVFDTMJ-QGZVFWFLSA-N 2 2 315.417 2.349 20 10 DECDLP Cn1c[nH+]cc1CC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000809575927 646240647 /nfs/dbraw/zinc/24/06/47/646240647.db2.gz NGANQWZDVFDTMJ-QGZVFWFLSA-N 2 2 315.417 2.349 20 10 DECDLP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892848 647374066 /nfs/dbraw/zinc/37/40/66/647374066.db2.gz WERZZUVMYDRIFX-VKJFTORMSA-N 2 2 303.450 2.314 20 10 DECDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C[C@@H]1COCC[NH2+]1 ZINC000817934997 647386831 /nfs/dbraw/zinc/38/68/31/647386831.db2.gz SCLVUURAFUEALC-LZLYRXPVSA-N 2 2 319.493 2.349 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817952015 647391577 /nfs/dbraw/zinc/39/15/77/647391577.db2.gz MTSRSXHHDWOCAZ-ZFWWWQNUSA-N 2 2 307.413 2.065 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)cc1 ZINC000817984476 647400418 /nfs/dbraw/zinc/40/04/18/647400418.db2.gz YMAUAOLEAVTZNP-CRAIPNDOSA-N 2 2 303.450 2.316 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)cc1 ZINC000817984478 647400427 /nfs/dbraw/zinc/40/04/27/647400427.db2.gz YMAUAOLEAVTZNP-MAUKXSAKSA-N 2 2 303.450 2.316 20 10 DECDLP CCc1nc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)co1 ZINC000825057405 648693829 /nfs/dbraw/zinc/69/38/29/648693829.db2.gz MUFNCTPJUZKAIQ-UHFFFAOYSA-N 2 2 314.433 2.279 20 10 DECDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827698902 649071383 /nfs/dbraw/zinc/07/13/83/649071383.db2.gz CRTMGQQKEGBGTP-INIZCTEOSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827698902 649071385 /nfs/dbraw/zinc/07/13/85/649071385.db2.gz CRTMGQQKEGBGTP-INIZCTEOSA-N 2 2 324.852 2.385 20 10 DECDLP [NH3+]C[C@H]1C[N@H+](Cc2cccc(F)c2O)CC[C@@H]1C(F)(F)F ZINC000863645471 686538892 /nfs/dbraw/zinc/53/88/92/686538892.db2.gz IBWCUICTILEQQO-QWRGUYRKSA-N 2 2 306.303 2.490 20 10 DECDLP [NH3+]C[C@H]1C[N@@H+](Cc2cccc(F)c2O)CC[C@@H]1C(F)(F)F ZINC000863645471 686538894 /nfs/dbraw/zinc/53/88/94/686538894.db2.gz IBWCUICTILEQQO-QWRGUYRKSA-N 2 2 306.303 2.490 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+][C@H]2CC[N@H+](CC(C)(C)O)C2)cc1 ZINC000865659334 687292629 /nfs/dbraw/zinc/29/26/29/687292629.db2.gz HNTKFVFSBLNVDR-OSJSJHBBSA-N 2 2 317.477 2.201 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+][C@H]2CC[N@@H+](CC(C)(C)O)C2)cc1 ZINC000865659334 687292631 /nfs/dbraw/zinc/29/26/31/687292631.db2.gz HNTKFVFSBLNVDR-OSJSJHBBSA-N 2 2 317.477 2.201 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCCC[C@@H]([NH3+])C3)cc2)CC1 ZINC000873216348 689186313 /nfs/dbraw/zinc/18/63/13/689186313.db2.gz QRXCDFIMHRGPMF-GOSISDBHSA-N 3 2 316.493 2.142 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCCC[C@@H]([NH3+])C3)cc2)CC1 ZINC000873216348 689186316 /nfs/dbraw/zinc/18/63/16/689186316.db2.gz QRXCDFIMHRGPMF-GOSISDBHSA-N 3 2 316.493 2.142 20 10 DECDLP COc1ccc(N2CC[C@@H]([NH2+][C@H]3CC[NH2+]C34CCC4)C2)cc1 ZINC000925710040 693328315 /nfs/dbraw/zinc/32/83/15/693328315.db2.gz BGXVUYDFVBGTJG-PBHICJAKSA-N 2 2 301.434 2.148 20 10 DECDLP C[C@@H]([NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1)c1cc(F)ccc1O ZINC000925793983 693342649 /nfs/dbraw/zinc/34/26/49/693342649.db2.gz SXIWVZIECGNURJ-OCCSQVGLSA-N 2 2 308.397 2.341 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]([NH3+])[C@@H](F)CC1 ZINC001206173475 793478218 /nfs/dbraw/zinc/47/82/18/793478218.db2.gz HMIVRQOYTCOZQI-UONOGXRCSA-N 2 2 320.364 2.068 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]([NH3+])[C@@H](F)CC1 ZINC001206173475 793478222 /nfs/dbraw/zinc/47/82/22/793478222.db2.gz HMIVRQOYTCOZQI-UONOGXRCSA-N 2 2 320.364 2.068 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCCC[C@@](F)(C[NH3+])C2)cc1OC ZINC001206371774 800519709 /nfs/dbraw/zinc/51/97/09/800519709.db2.gz WBDYRUIJYIOSSE-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCCC[C@@](F)(C[NH3+])C2)cc1OC ZINC001206371774 800519713 /nfs/dbraw/zinc/51/97/13/800519713.db2.gz WBDYRUIJYIOSSE-MRXNPFEDSA-N 2 2 312.385 2.062 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1OC ZINC001231858430 801738796 /nfs/dbraw/zinc/73/87/96/801738796.db2.gz WCBKPYWAAQGMNH-UHFFFAOYSA-N 2 2 302.422 2.480 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1OC ZINC001231858430 801738799 /nfs/dbraw/zinc/73/87/99/801738799.db2.gz WCBKPYWAAQGMNH-UHFFFAOYSA-N 2 2 302.422 2.480 20 10 DECDLP COc1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)c1Cl ZINC001236321955 1138352098 /nfs/dbraw/zinc/35/20/98/1138352098.db2.gz XOGJKTSIBINZRQ-TXEJJXNPSA-N 2 2 310.825 2.486 20 10 DECDLP COc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)c1Cl ZINC001236321955 1138352102 /nfs/dbraw/zinc/35/21/02/1138352102.db2.gz XOGJKTSIBINZRQ-TXEJJXNPSA-N 2 2 310.825 2.486 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)[N@@H+](C3CC3)C2)c1 ZINC000273551177 130135696 /nfs/dbraw/zinc/13/56/96/130135696.db2.gz FZEOJMIEUUMBNJ-MBNYWOFBSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1 ZINC000273551177 130135697 /nfs/dbraw/zinc/13/56/97/130135697.db2.gz FZEOJMIEUUMBNJ-MBNYWOFBSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000273439621 292014099 /nfs/dbraw/zinc/01/40/99/292014099.db2.gz YBCPTAHUCDUOLY-CHWSQXEVSA-N 2 2 318.417 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000273439621 292014101 /nfs/dbraw/zinc/01/41/01/292014101.db2.gz YBCPTAHUCDUOLY-CHWSQXEVSA-N 2 2 318.417 2.314 20 10 DECDLP COCC[N@@H+](C)CC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185315123 402342787 /nfs/dbraw/zinc/34/27/87/402342787.db2.gz QYUXBFCIYOJSIR-AWEZNQCLSA-N 2 2 306.450 2.500 20 10 DECDLP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3cc(Cl)ccc3O)CC2)C1 ZINC000367472809 405061122 /nfs/dbraw/zinc/06/11/22/405061122.db2.gz WFMLLHNNGLXXIO-MRXNPFEDSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3cc(Cl)ccc3O)CC2)C1 ZINC000367472809 405061129 /nfs/dbraw/zinc/06/11/29/405061129.db2.gz WFMLLHNNGLXXIO-MRXNPFEDSA-N 2 2 323.868 2.257 20 10 DECDLP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000286323389 280189577 /nfs/dbraw/zinc/18/95/77/280189577.db2.gz XQRXDSDKSRMYDR-WMLDXEAASA-N 2 2 323.456 2.456 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@](C)(O)C[NH+](C)C)cc1F ZINC000131415792 520908740 /nfs/dbraw/zinc/90/87/40/520908740.db2.gz GVOYZGJCFNGBJH-KRWDZBQOSA-N 2 2 311.445 2.074 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]CC3CC3)CC2)cc1 ZINC000237270653 524423001 /nfs/dbraw/zinc/42/30/01/524423001.db2.gz BLOBJKZXMNLAKJ-UHFFFAOYSA-N 2 2 303.450 2.207 20 10 DECDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000306076736 623110172 /nfs/dbraw/zinc/11/01/72/623110172.db2.gz GNVZBSPXJRJEDF-CQSZACIVSA-N 2 2 311.223 2.340 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000306076736 623110174 /nfs/dbraw/zinc/11/01/74/623110174.db2.gz GNVZBSPXJRJEDF-CQSZACIVSA-N 2 2 311.223 2.340 20 10 DECDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925502468 625100744 /nfs/dbraw/zinc/10/07/44/625100744.db2.gz LJKJCAHAXQLMMG-KRWDZBQOSA-N 2 2 321.440 2.017 20 10 DECDLP Oc1cccc2c1[C@H]([NH2+][C@@H]1C[NH2+]CC3(CCOCC3)C1)CC2 ZINC000925796127 635365631 /nfs/dbraw/zinc/36/56/31/635365631.db2.gz KSPOMKKTLAEJSC-LSDHHAIUSA-N 2 2 302.418 2.128 20 10 DECDLP COc1ccc(C[NH+]2CCC(C)([NH+]3CCC3)CC2)c(O)c1OC ZINC000896026040 638315459 /nfs/dbraw/zinc/31/54/59/638315459.db2.gz XNOZNZYGFHNYDQ-UHFFFAOYSA-N 2 2 320.433 2.470 20 10 DECDLP CCOCc1cc(C[NH2+]C[C@]2(COC)CCC[NH2+]2)ccc1OC ZINC000841066709 650421053 /nfs/dbraw/zinc/42/10/53/650421053.db2.gz FJVHRMHKDIRLKX-SFHVURJKSA-N 2 2 322.449 2.090 20 10 DECDLP COc1cccc(C[N@H+](CC[NH3+])CCc2ccccc2)c1O ZINC000843123055 650900290 /nfs/dbraw/zinc/90/02/90/650900290.db2.gz YMOLIXCAXSAXNI-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP COc1cccc(C[N@@H+](CC[NH3+])CCc2ccccc2)c1O ZINC000843123055 650900292 /nfs/dbraw/zinc/90/02/92/650900292.db2.gz YMOLIXCAXSAXNI-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000843124639 650900895 /nfs/dbraw/zinc/90/08/95/650900895.db2.gz DZNZKOBWPNDEIS-ZBFHGGJFSA-N 2 2 310.825 2.374 20 10 DECDLP CC[NH2+][C@H](C)C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817973225 647397918 /nfs/dbraw/zinc/39/79/18/647397918.db2.gz RBYAASRYGQLBBU-ZIAGYGMSSA-N 2 2 309.429 2.311 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)cc1 ZINC000848929472 651565918 /nfs/dbraw/zinc/56/59/18/651565918.db2.gz FJFSDKWZBAIYKJ-LJQANCHMSA-N 2 2 317.477 2.439 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)cc1 ZINC000848929472 651565921 /nfs/dbraw/zinc/56/59/21/651565921.db2.gz FJFSDKWZBAIYKJ-LJQANCHMSA-N 2 2 317.477 2.439 20 10 DECDLP C[C@H]([NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1)c1cc(F)ccc1O ZINC000925793976 693342719 /nfs/dbraw/zinc/34/27/19/693342719.db2.gz SXIWVZIECGNURJ-GXTWGEPZSA-N 2 2 308.397 2.341 20 10 DECDLP Oc1cc(F)c(F)cc1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001142502559 780777767 /nfs/dbraw/zinc/77/77/67/780777767.db2.gz SMVWGTRQFNFUST-UHFFFAOYSA-N 2 2 305.328 2.388 20 10 DECDLP Oc1cc(O)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c(O)c1 ZINC001144514894 790942427 /nfs/dbraw/zinc/94/24/27/790942427.db2.gz WVDPLSSYKWNCOD-UHFFFAOYSA-N 2 2 324.396 2.202 20 10 DECDLP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3ccc(Cl)cc3O)CC2)C1 ZINC001180262568 795267599 /nfs/dbraw/zinc/26/75/99/795267599.db2.gz ZLSHVAYXMQFTPH-INIZCTEOSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3ccc(Cl)cc3O)CC2)C1 ZINC001180262568 795267603 /nfs/dbraw/zinc/26/76/03/795267603.db2.gz ZLSHVAYXMQFTPH-INIZCTEOSA-N 2 2 323.868 2.257 20 10 DECDLP Cc1cc(C)c(CNc2ccc(N3CC[NH2+]CC3)c[nH+]2)c(O)c1 ZINC001160810087 798744707 /nfs/dbraw/zinc/74/47/07/798744707.db2.gz IVCFVUYPLFKLBO-UHFFFAOYSA-N 2 2 312.417 2.426 20 10 DECDLP Oc1ccccc1C[NH+]1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246359233 1140888320 /nfs/dbraw/zinc/88/83/20/1140888320.db2.gz MLYBVIJFHPPWRM-JWTNVVGKSA-N 3 2 315.461 2.229 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000273439625 292013915 /nfs/dbraw/zinc/01/39/15/292013915.db2.gz YBCPTAHUCDUOLY-OLZOCXBDSA-N 2 2 318.417 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000273439625 292013917 /nfs/dbraw/zinc/01/39/17/292013917.db2.gz YBCPTAHUCDUOLY-OLZOCXBDSA-N 2 2 318.417 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000273439629 292014367 /nfs/dbraw/zinc/01/43/67/292014367.db2.gz YBCPTAHUCDUOLY-QWHCGFSZSA-N 2 2 318.417 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000273439629 292014369 /nfs/dbraw/zinc/01/43/69/292014369.db2.gz YBCPTAHUCDUOLY-QWHCGFSZSA-N 2 2 318.417 2.314 20 10 DECDLP Oc1ccccc1C[N@H+](CCn1cc[nH+]c1)C[C@@H]1CCCO1 ZINC000123510204 402131814 /nfs/dbraw/zinc/13/18/14/402131814.db2.gz DWNUEXNLURBWFZ-INIZCTEOSA-N 2 2 301.390 2.270 20 10 DECDLP Oc1ccccc1C[N@@H+](CCn1cc[nH+]c1)C[C@@H]1CCCO1 ZINC000123510204 402131818 /nfs/dbraw/zinc/13/18/18/402131818.db2.gz DWNUEXNLURBWFZ-INIZCTEOSA-N 2 2 301.390 2.270 20 10 DECDLP COCC[N@@H+](C)CC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185315145 402342704 /nfs/dbraw/zinc/34/27/04/402342704.db2.gz QYUXBFCIYOJSIR-CQSZACIVSA-N 2 2 306.450 2.500 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905400 403120528 /nfs/dbraw/zinc/12/05/28/403120528.db2.gz LSMMOVHZADFFMH-ROUUACIJSA-N 2 2 304.482 2.039 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905400 403120530 /nfs/dbraw/zinc/12/05/30/403120530.db2.gz LSMMOVHZADFFMH-ROUUACIJSA-N 2 2 304.482 2.039 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c(c2)ncn3C)cc1 ZINC000841045641 650413776 /nfs/dbraw/zinc/41/37/76/650413776.db2.gz NNHGOWQAWIHWPR-KRWDZBQOSA-N 2 2 323.444 2.429 20 10 DECDLP CC[C@@H]([NH3+])C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000841072950 650422345 /nfs/dbraw/zinc/42/23/45/650422345.db2.gz SUYHMWAMPGVJRD-CQSZACIVSA-N 2 2 306.410 2.412 20 10 DECDLP Oc1cc2c(cc1C[NH+]1CCC([NH2+]C3CCC3)CC1)OCO2 ZINC000897981387 640994118 /nfs/dbraw/zinc/99/41/18/640994118.db2.gz LDDXUANOJBZDFN-UHFFFAOYSA-N 2 2 304.390 2.227 20 10 DECDLP COc1ccc(O)c(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000841045903 641471419 /nfs/dbraw/zinc/47/14/19/641471419.db2.gz SINNIRQEYMZLFD-KRWDZBQOSA-N 2 2 315.417 2.256 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925479448 648220558 /nfs/dbraw/zinc/22/05/58/648220558.db2.gz ZRKWJQQJARMANA-WMLDXEAASA-N 2 2 305.491 2.470 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000854230591 652662717 /nfs/dbraw/zinc/66/27/17/652662717.db2.gz VFDSGORCCKRRGM-BEFAXECRSA-N 2 2 317.477 2.268 20 10 DECDLP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)c1ccc(N2CCOCC2)cc1 ZINC000863540211 686517504 /nfs/dbraw/zinc/51/75/04/686517504.db2.gz CITGBLJWXLXWKX-YJBOKZPZSA-N 2 2 315.461 2.458 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[NH2+]C23CCC3)c1 ZINC000863541235 686518142 /nfs/dbraw/zinc/51/81/42/686518142.db2.gz HPOMYOHJHQIZCN-ABAIWWIYSA-N 2 2 304.390 2.114 20 10 DECDLP C[NH+]1CCN(C2CC[NH+](Cc3cccc(Cl)c3O)CC2)CC1 ZINC000877746128 690213349 /nfs/dbraw/zinc/21/33/49/690213349.db2.gz ISSBKNXDLYDKRR-UHFFFAOYSA-N 2 2 323.868 2.257 20 10 DECDLP COc1cc(C[NH+]2CCC([NH+]3CCCC3)CC2)c(O)cc1O ZINC001231635464 801700156 /nfs/dbraw/zinc/70/01/56/801700156.db2.gz ZXBGSASKCAQZEH-UHFFFAOYSA-N 2 2 306.406 2.167 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@H+](C)CCN2C)c1 ZINC001462598854 1058859295 /nfs/dbraw/zinc/85/92/95/1058859295.db2.gz YOJWYIAANBFLCW-YOEHRIQHSA-N 2 2 305.466 2.240 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1 ZINC001462598854 1058859319 /nfs/dbraw/zinc/85/93/19/1058859319.db2.gz YOJWYIAANBFLCW-YOEHRIQHSA-N 2 2 305.466 2.240 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@@H+]3C[C@H]4CC[C@@]4([NH3+])C3)ccc2O1 ZINC001235994107 1084584067 /nfs/dbraw/zinc/58/40/67/1084584067.db2.gz NHEDQGWAQXKBIL-FZKQIMNGSA-N 2 2 300.402 2.500 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@H+]3C[C@H]4CC[C@@]4([NH3+])C3)ccc2O1 ZINC001235994107 1084584070 /nfs/dbraw/zinc/58/40/70/1084584070.db2.gz NHEDQGWAQXKBIL-FZKQIMNGSA-N 2 2 300.402 2.500 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[N@@H+](C3CC3)C[C@H]2C)c1 ZINC000273555660 130137056 /nfs/dbraw/zinc/13/70/56/130137056.db2.gz GWZIPLLPMYMSDY-BFQNTYOBSA-N 2 2 318.417 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1 ZINC000273555660 130137058 /nfs/dbraw/zinc/13/70/58/130137058.db2.gz GWZIPLLPMYMSDY-BFQNTYOBSA-N 2 2 318.417 2.312 20 10 DECDLP Cc1cc(Br)cc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1O ZINC000775747747 642089103 /nfs/dbraw/zinc/08/91/03/642089103.db2.gz MYWSAKOMPSUEKQ-VXGBXAGGSA-N 2 2 311.223 2.114 20 10 DECDLP [NH3+][C@@H](CC(F)F)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000903905480 643503224 /nfs/dbraw/zinc/50/32/24/643503224.db2.gz GTZGMJAIATUQMA-UONOGXRCSA-N 2 2 314.376 2.356 20 10 DECDLP [NH3+][C@@H](CC(F)F)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000903905480 643503237 /nfs/dbraw/zinc/50/32/37/643503237.db2.gz GTZGMJAIATUQMA-UONOGXRCSA-N 2 2 314.376 2.356 20 10 DECDLP CCN(CC)c1ccc(C[N@H+](C)C[C@@H](O)C[NH+](C)C2CC2)cc1 ZINC000809932995 646301637 /nfs/dbraw/zinc/30/16/37/646301637.db2.gz MHOMKYUAVDDDBI-LJQANCHMSA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)C[NH+](C)C2CC2)cc1 ZINC000809932995 646301642 /nfs/dbraw/zinc/30/16/42/646301642.db2.gz MHOMKYUAVDDDBI-LJQANCHMSA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@@H](O)C[N@H+](C)C2CC2)cc1 ZINC000809932995 646301644 /nfs/dbraw/zinc/30/16/44/646301644.db2.gz MHOMKYUAVDDDBI-LJQANCHMSA-N 2 2 319.493 2.420 20 10 DECDLP CCN(CC)c1ccc(C[NH+](C)C[C@@H](O)C[N@@H+](C)C2CC2)cc1 ZINC000809932995 646301650 /nfs/dbraw/zinc/30/16/50/646301650.db2.gz MHOMKYUAVDDDBI-LJQANCHMSA-N 2 2 319.493 2.420 20 10 DECDLP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(N2CCOCC2)cc1Cl ZINC000817977847 647398613 /nfs/dbraw/zinc/39/86/13/647398613.db2.gz QNLDXAQIQFQPEK-ZYIUAKIQSA-N 2 2 321.852 2.045 20 10 DECDLP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(C(F)(F)F)cc1O ZINC000817982806 647399829 /nfs/dbraw/zinc/39/98/29/647399829.db2.gz HNAVQXLFVZVPBQ-DGCLKSJQSA-N 2 2 318.339 2.440 20 10 DECDLP C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(F)cc1O ZINC000817982039 647400062 /nfs/dbraw/zinc/40/00/62/647400062.db2.gz BFKJYBHKAGWUJZ-IUDNXUCKSA-N 2 2 321.440 2.398 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+]2CCCO)cc1 ZINC000824558961 648610732 /nfs/dbraw/zinc/61/07/32/648610732.db2.gz ATSYGHIYTUQKRN-IBGZPJMESA-N 2 2 319.493 2.469 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+]2CCCO)cc1 ZINC000824558961 648610736 /nfs/dbraw/zinc/61/07/36/648610736.db2.gz ATSYGHIYTUQKRN-IBGZPJMESA-N 2 2 319.493 2.469 20 10 DECDLP C[C@@]1([NH3+])CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001204801347 779941038 /nfs/dbraw/zinc/94/10/38/779941038.db2.gz NXUXXDXTCGIEAK-CYBMUJFWSA-N 2 2 304.312 2.256 20 10 DECDLP C[C@@]1([NH3+])CC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001204801347 779941043 /nfs/dbraw/zinc/94/10/43/779941043.db2.gz NXUXXDXTCGIEAK-CYBMUJFWSA-N 2 2 304.312 2.256 20 10 DECDLP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cc(F)c(F)cc2O)CCCO1 ZINC001180865963 795386067 /nfs/dbraw/zinc/38/60/67/795386067.db2.gz WTDDLFRARCEXTK-GFCCVEGCSA-N 2 2 314.376 2.261 20 10 DECDLP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2cc(F)c(F)cc2O)CCCO1 ZINC001180865963 795386069 /nfs/dbraw/zinc/38/60/69/795386069.db2.gz WTDDLFRARCEXTK-GFCCVEGCSA-N 2 2 314.376 2.261 20 10 DECDLP COc1cc(C[NH+]2CC3(CSC3)C2)cc(C[NH+](C)C)c1O ZINC001139260290 796351074 /nfs/dbraw/zinc/35/10/74/796351074.db2.gz KVMPXEZOBDCYJL-UHFFFAOYSA-N 2 2 308.447 2.011 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001205725911 797957182 /nfs/dbraw/zinc/95/71/82/797957182.db2.gz NEJKJZKBWXYXMA-CQSZACIVSA-N 2 2 319.232 2.375 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001205725911 797957189 /nfs/dbraw/zinc/95/71/89/797957189.db2.gz NEJKJZKBWXYXMA-CQSZACIVSA-N 2 2 319.232 2.375 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3nccs3)cc2F)CC1 ZINC001473948475 1060779592 /nfs/dbraw/zinc/77/95/92/1060779592.db2.gz KJCKGRISGKNFQF-UHFFFAOYSA-N 2 2 320.437 2.324 20 10 DECDLP [NH3+]C1(C[NH2+]Cc2cc(Br)cc(F)c2O)CCC1 ZINC001580152903 1067510967 /nfs/dbraw/zinc/51/09/67/1067510967.db2.gz XIMGXINECKTYNM-UHFFFAOYSA-N 2 2 303.175 2.265 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)c(O)c1 ZINC001236061506 1084600729 /nfs/dbraw/zinc/60/07/29/1084600729.db2.gz UNIYYDDGZVJDAI-HOCLYGCPSA-N 2 2 303.450 2.422 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)c(O)c1 ZINC001236061506 1084600731 /nfs/dbraw/zinc/60/07/31/1084600731.db2.gz UNIYYDDGZVJDAI-HOCLYGCPSA-N 2 2 303.450 2.422 20 10 DECDLP CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236946225 1138463122 /nfs/dbraw/zinc/46/31/22/1138463122.db2.gz MWFMDHCWOOCRBV-SFHVURJKSA-N 2 2 319.424 2.131 20 10 DECDLP CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236946225 1138463133 /nfs/dbraw/zinc/46/31/33/1138463133.db2.gz MWFMDHCWOOCRBV-SFHVURJKSA-N 2 2 319.424 2.131 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H](C)CO1 ZINC001319932054 1140804918 /nfs/dbraw/zinc/80/49/18/1140804918.db2.gz HGNSZLIHBBYDET-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H](C)CO1 ZINC001319932054 1140804920 /nfs/dbraw/zinc/80/49/20/1140804920.db2.gz HGNSZLIHBBYDET-HUUCEWRRSA-N 2 2 321.440 2.187 20 10 DECDLP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)no1 ZINC001322611178 1141646030 /nfs/dbraw/zinc/64/60/30/1141646030.db2.gz MLTMQAAZEKPDAP-UHFFFAOYSA-N 2 2 318.396 2.164 20 10 DECDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000093664486 402018630 /nfs/dbraw/zinc/01/86/30/402018630.db2.gz HOUALGJWABUOMO-ZDUSSCGKSA-N 2 2 310.825 2.200 20 10 DECDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000093664486 402018634 /nfs/dbraw/zinc/01/86/34/402018634.db2.gz HOUALGJWABUOMO-ZDUSSCGKSA-N 2 2 310.825 2.200 20 10 DECDLP COCC[N@@H+]1CCC[C@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036105 649869953 /nfs/dbraw/zinc/86/99/53/649869953.db2.gz HSSZLNOKHVLBMT-UTSMFGRCSA-N 2 2 317.477 2.466 20 10 DECDLP COCC[N@H+]1CCC[C@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036105 649869954 /nfs/dbraw/zinc/86/99/54/649869954.db2.gz HSSZLNOKHVLBMT-UTSMFGRCSA-N 2 2 317.477 2.466 20 10 DECDLP COc1cc[nH+]c(N2CC[NH+](Cc3cccc(F)c3O)CC2)c1 ZINC000272253632 537116675 /nfs/dbraw/zinc/11/66/75/537116675.db2.gz IUHMIXJEPBYHJH-UHFFFAOYSA-N 2 2 317.364 2.257 20 10 DECDLP C[C@H]([NH2+]CC[NH+]1CCCC1)c1ccc(N2CCOCC2)cc1 ZINC000178306771 624572157 /nfs/dbraw/zinc/57/21/57/624572157.db2.gz VIZRAFQVGFZZJZ-INIZCTEOSA-N 2 2 303.450 2.270 20 10 DECDLP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+]2C2CCOCC2)cc1 ZINC000922950781 636880135 /nfs/dbraw/zinc/88/01/35/636880135.db2.gz DFAJMVMQSYLLOE-SFHVURJKSA-N 2 2 303.450 2.096 20 10 DECDLP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@H+]2C2CCOCC2)cc1 ZINC000922950781 636880141 /nfs/dbraw/zinc/88/01/41/636880141.db2.gz DFAJMVMQSYLLOE-SFHVURJKSA-N 2 2 303.450 2.096 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C[NH3+])C3CCCC3)cc2)CC1 ZINC000841085804 650426806 /nfs/dbraw/zinc/42/68/06/650426806.db2.gz BBWYPTINJLTCOY-IBGZPJMESA-N 3 2 316.493 2.046 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CN)C3CCCC3)cc2)CC1 ZINC000841085804 650426809 /nfs/dbraw/zinc/42/68/09/650426809.db2.gz BBWYPTINJLTCOY-IBGZPJMESA-N 2 2 316.493 2.046 20 10 DECDLP CCO[C@@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)C[NH+](C)C ZINC000896876222 638748311 /nfs/dbraw/zinc/74/83/11/638748311.db2.gz CFQLWAYPCULQTN-ZDUSSCGKSA-N 2 2 300.830 2.410 20 10 DECDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360079 641895411 /nfs/dbraw/zinc/89/54/11/641895411.db2.gz RGQZHFJKLNTEOC-LKFCYVNXSA-N 2 2 319.232 2.416 20 10 DECDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360079 641895413 /nfs/dbraw/zinc/89/54/13/641895413.db2.gz RGQZHFJKLNTEOC-LKFCYVNXSA-N 2 2 319.232 2.416 20 10 DECDLP CCOc1cccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)c1O ZINC000903974883 643531868 /nfs/dbraw/zinc/53/18/68/643531868.db2.gz UMLFDMQVUSLACN-HNNXBMFYSA-N 2 2 320.433 2.039 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000817895833 647375325 /nfs/dbraw/zinc/37/53/25/647375325.db2.gz WUPHETBLBLMKDT-CRAIPNDOSA-N 2 2 303.450 2.143 20 10 DECDLP CC(C)[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)N1CC[NH+](C)CC1 ZINC000886500214 692094589 /nfs/dbraw/zinc/09/45/89/692094589.db2.gz LHMVSWZOSYMLMN-HOCLYGCPSA-N 2 2 323.456 2.454 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H]([NH3+])[C@@H](F)CC1 ZINC001206173471 793477692 /nfs/dbraw/zinc/47/76/92/793477692.db2.gz HMIVRQOYTCOZQI-KBPBESRZSA-N 2 2 320.364 2.068 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H]([NH3+])[C@@H](F)CC1 ZINC001206173471 793477694 /nfs/dbraw/zinc/47/76/94/793477694.db2.gz HMIVRQOYTCOZQI-KBPBESRZSA-N 2 2 320.364 2.068 20 10 DECDLP COc1cc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253471 796348669 /nfs/dbraw/zinc/34/86/69/796348669.db2.gz VNLWAVCTBQIGAK-BETUJISGSA-N 2 2 308.422 2.072 20 10 DECDLP COc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253471 796348670 /nfs/dbraw/zinc/34/86/70/796348670.db2.gz VNLWAVCTBQIGAK-BETUJISGSA-N 2 2 308.422 2.072 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@H+](C)CCC[NH+](C)C)cc2)CC1 ZINC001140299839 796504052 /nfs/dbraw/zinc/50/40/52/796504052.db2.gz HBJUOTVYXIVCHR-UHFFFAOYSA-N 3 2 318.509 2.212 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@@H+](C)CCC[NH+](C)C)cc2)CC1 ZINC001140299839 796504053 /nfs/dbraw/zinc/50/40/53/796504053.db2.gz HBJUOTVYXIVCHR-UHFFFAOYSA-N 3 2 318.509 2.212 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC(OC(C)C)C3)cc2)CC1 ZINC001140306066 796504616 /nfs/dbraw/zinc/50/46/16/796504616.db2.gz MYTVCKFBTNRYIW-UHFFFAOYSA-N 2 2 317.477 2.438 20 10 DECDLP Cc1ccc(O)c(C[N@@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c1 ZINC001140620972 796547047 /nfs/dbraw/zinc/54/70/47/796547047.db2.gz FHRAPWFBTFJAAQ-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP Cc1ccc(O)c(C[N@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c1 ZINC001140620972 796547049 /nfs/dbraw/zinc/54/70/49/796547049.db2.gz FHRAPWFBTFJAAQ-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP CC[N@H+](Cc1c(O)cc(OC)cc1OC)C1CC[NH+](C)CC1 ZINC001141028466 796620263 /nfs/dbraw/zinc/62/02/63/796620263.db2.gz PRJWNVOZHCEDQK-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](Cc1c(O)cc(OC)cc1OC)C1CC[NH+](C)CC1 ZINC001141028466 796620268 /nfs/dbraw/zinc/62/02/68/796620268.db2.gz PRJWNVOZHCEDQK-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP COc1ccc(O)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1 ZINC001203680117 800104981 /nfs/dbraw/zinc/10/49/81/800104981.db2.gz FNAJQHGAOYJYRA-INIZCTEOSA-N 2 2 300.358 2.449 20 10 DECDLP COc1ccc(O)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1 ZINC001203680117 800104984 /nfs/dbraw/zinc/10/49/84/800104984.db2.gz FNAJQHGAOYJYRA-INIZCTEOSA-N 2 2 300.358 2.449 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203883740 800139955 /nfs/dbraw/zinc/13/99/55/800139955.db2.gz NGCODHAAPZYNBX-CQSZACIVSA-N 2 2 300.358 2.455 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203883740 800139962 /nfs/dbraw/zinc/13/99/62/800139962.db2.gz NGCODHAAPZYNBX-CQSZACIVSA-N 2 2 300.358 2.455 20 10 DECDLP [NH3+]CC1CC[NH+](Cc2cc(F)cc(Br)c2O)CC1 ZINC001205053092 800290247 /nfs/dbraw/zinc/29/02/47/800290247.db2.gz KOKVPXLSWBVZLG-UHFFFAOYSA-N 2 2 317.202 2.465 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222248289 802660688 /nfs/dbraw/zinc/66/06/88/802660688.db2.gz KKURILBDJJFVTG-SFHVURJKSA-N 2 2 303.450 2.479 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222248289 802660693 /nfs/dbraw/zinc/66/06/93/802660693.db2.gz KKURILBDJJFVTG-SFHVURJKSA-N 2 2 303.450 2.479 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc2ccccc2c1O)[C@H]1C[N@H+](C)CCN1C ZINC001660047336 1080260225 /nfs/dbraw/zinc/26/02/25/1080260225.db2.gz IVJOGPATGPGGIX-RDTXWAMCSA-N 2 2 313.445 2.269 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc2ccccc2c1O)[C@H]1C[N@@H+](C)CCN1C ZINC001660047336 1080260233 /nfs/dbraw/zinc/26/02/33/1080260233.db2.gz IVJOGPATGPGGIX-RDTXWAMCSA-N 2 2 313.445 2.269 20 10 DECDLP C[N@@H+]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001254510813 1143161553 /nfs/dbraw/zinc/16/15/53/1143161553.db2.gz YCSJIKIUHLYWQZ-QGZVFWFLSA-N 3 2 317.477 2.431 20 10 DECDLP C[N@H+]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001254510813 1143161574 /nfs/dbraw/zinc/16/15/74/1143161574.db2.gz YCSJIKIUHLYWQZ-QGZVFWFLSA-N 3 2 317.477 2.431 20 10 DECDLP Cc1ccc(O)c(C[NH+]2CCN(C3=[NH+]C[C@@H](C)S3)CC2)c1 ZINC000093663189 402018914 /nfs/dbraw/zinc/01/89/14/402018914.db2.gz XBDUKZBXNFDSID-CYBMUJFWSA-N 2 2 305.447 2.310 20 10 DECDLP C[N@H+]1C[C@@H]2C[NH+](Cc3cc(Br)ccc3O)C[C@@H]2C1 ZINC000194534861 402802101 /nfs/dbraw/zinc/80/21/01/402802101.db2.gz OCMMANOHIDLHEL-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3cc(Br)ccc3O)C[C@@H]2C1 ZINC000194534861 402802103 /nfs/dbraw/zinc/80/21/03/402802103.db2.gz OCMMANOHIDLHEL-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3cc(Br)ccc3O)C[C@@H]2C1 ZINC000194534861 402802104 /nfs/dbraw/zinc/80/21/04/402802104.db2.gz OCMMANOHIDLHEL-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@H+](Cc3cc(Br)ccc3O)C[C@@H]2C1 ZINC000194534861 402802106 /nfs/dbraw/zinc/80/21/06/402802106.db2.gz OCMMANOHIDLHEL-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP CC1(C)C[NH+]=C(N2CC[NH+](Cc3ccccc3O)CC2)S1 ZINC000271352675 402861243 /nfs/dbraw/zinc/86/12/43/402861243.db2.gz LSPBKBXDNJUOGO-UHFFFAOYSA-N 2 2 305.447 2.391 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000278472487 402866320 /nfs/dbraw/zinc/86/63/20/402866320.db2.gz HOOOCSJVROVMDA-QWHCGFSZSA-N 2 2 323.393 2.271 20 10 DECDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262031 402980934 /nfs/dbraw/zinc/98/09/34/402980934.db2.gz XGFZFGLSNHSGGW-HZPDHXFCSA-N 2 2 319.449 2.081 20 10 DECDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262031 402980935 /nfs/dbraw/zinc/98/09/35/402980935.db2.gz XGFZFGLSNHSGGW-HZPDHXFCSA-N 2 2 319.449 2.081 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540516 405242608 /nfs/dbraw/zinc/24/26/08/405242608.db2.gz YKJGEMCTLSWMEL-JCGIZDLHSA-N 2 2 303.450 2.266 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540516 405242611 /nfs/dbraw/zinc/24/26/11/405242611.db2.gz YKJGEMCTLSWMEL-JCGIZDLHSA-N 2 2 303.450 2.266 20 10 DECDLP COCC[N@H+](C)CCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840877181 650370269 /nfs/dbraw/zinc/37/02/69/650370269.db2.gz YJCJKXJLGYPIET-UHFFFAOYSA-N 2 2 300.830 2.412 20 10 DECDLP COCC[N@@H+](C)CCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840877181 650370270 /nfs/dbraw/zinc/37/02/70/650370270.db2.gz YJCJKXJLGYPIET-UHFFFAOYSA-N 2 2 300.830 2.412 20 10 DECDLP COCC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840931215 650387807 /nfs/dbraw/zinc/38/78/07/650387807.db2.gz DBOGCWBLHMOZQU-SFHVURJKSA-N 2 2 305.466 2.261 20 10 DECDLP COCC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840931215 650387809 /nfs/dbraw/zinc/38/78/09/650387809.db2.gz DBOGCWBLHMOZQU-SFHVURJKSA-N 2 2 305.466 2.261 20 10 DECDLP CC(C)C[C@@H]([NH3+])C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000841004413 650404481 /nfs/dbraw/zinc/40/44/81/650404481.db2.gz QMLMIYMGHDDLDV-QGZVFWFLSA-N 2 2 305.466 2.328 20 10 DECDLP CC(C)C[C@@H]([NH3+])C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000841004413 650404483 /nfs/dbraw/zinc/40/44/83/650404483.db2.gz QMLMIYMGHDDLDV-QGZVFWFLSA-N 2 2 305.466 2.328 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@@H](O)C[NH+]2CCCC2)c2c1c(F)ccc2O ZINC000756450701 639663898 /nfs/dbraw/zinc/66/38/98/639663898.db2.gz UAXJIDWXIJQNTC-BZPMIXESSA-N 2 2 308.397 2.126 20 10 DECDLP CC(C)(O)C[NH+]1CCC([NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000898218219 641051557 /nfs/dbraw/zinc/05/15/57/641051557.db2.gz AXUHKYHJAIHVDO-UHFFFAOYSA-N 2 2 312.841 2.371 20 10 DECDLP CCOc1ccc(O)c(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)c1 ZINC000903973197 643530969 /nfs/dbraw/zinc/53/09/69/643530969.db2.gz BCSMLDZVFJXXJJ-HNNXBMFYSA-N 2 2 320.433 2.039 20 10 DECDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817889345 647371671 /nfs/dbraw/zinc/37/16/71/647371671.db2.gz SSUCJHQKFNHMKM-PBHICJAKSA-N 2 2 305.491 2.327 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)cc1Cl ZINC000825247191 648730730 /nfs/dbraw/zinc/73/07/30/648730730.db2.gz OEOFDJFTNWPRED-UONOGXRCSA-N 2 2 310.825 2.307 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1Cl ZINC000825247191 648730735 /nfs/dbraw/zinc/73/07/35/648730735.db2.gz OEOFDJFTNWPRED-UONOGXRCSA-N 2 2 310.825 2.307 20 10 DECDLP Oc1ccc(Cl)cc1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000848919574 651561127 /nfs/dbraw/zinc/56/11/27/651561127.db2.gz NRJWENHWVAWFOI-HNNXBMFYSA-N 2 2 310.825 2.389 20 10 DECDLP Cc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930727 651565510 /nfs/dbraw/zinc/56/55/10/651565510.db2.gz VTMDTPILDAOVPT-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930727 651565515 /nfs/dbraw/zinc/56/55/15/651565515.db2.gz VTMDTPILDAOVPT-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP C[NH+]1CCN(CCCC[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000113321498 684061633 /nfs/dbraw/zinc/06/16/33/684061633.db2.gz XOVXXPYUYGKQBA-UHFFFAOYSA-N 2 2 311.857 2.163 20 10 DECDLP C[C@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877154221 690032119 /nfs/dbraw/zinc/03/21/19/690032119.db2.gz NISXJVVJJFYGFC-INIZCTEOSA-N 2 2 317.477 2.222 20 10 DECDLP C[C@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877154221 690032121 /nfs/dbraw/zinc/03/21/21/690032121.db2.gz NISXJVVJJFYGFC-INIZCTEOSA-N 2 2 317.477 2.222 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](F)C[C@H]3CF)cc2)CC1 ZINC001139407911 796372566 /nfs/dbraw/zinc/37/25/66/796372566.db2.gz GEBCSKIDUWMVNF-RDJZCZTQSA-N 2 2 309.404 2.320 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H](F)C[C@H]3CF)cc2)CC1 ZINC001139407911 796372568 /nfs/dbraw/zinc/37/25/68/796372568.db2.gz GEBCSKIDUWMVNF-RDJZCZTQSA-N 2 2 309.404 2.320 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH+]3CCC3)CC2)c(OC)c1 ZINC001141032384 796621452 /nfs/dbraw/zinc/62/14/52/796621452.db2.gz AEHLIPGVHDUNQD-UHFFFAOYSA-N 2 2 306.406 2.080 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001205725255 800408704 /nfs/dbraw/zinc/40/87/04/800408704.db2.gz FPIRKRRKEMEWMN-AWEZNQCLSA-N 2 2 319.232 2.375 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001205725255 800408705 /nfs/dbraw/zinc/40/87/05/800408705.db2.gz FPIRKRRKEMEWMN-AWEZNQCLSA-N 2 2 319.232 2.375 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC[C@]23CCC[NH2+]C3)c(OC)c1 ZINC001222247616 802660706 /nfs/dbraw/zinc/66/07/06/802660706.db2.gz GOUYSSIOKAIYKD-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC[C@]23CCC[NH2+]C3)c(OC)c1 ZINC001222247616 802660710 /nfs/dbraw/zinc/66/07/10/802660710.db2.gz GOUYSSIOKAIYKD-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3cccc(Cl)c3O)[C@@H]2C1 ZINC001276379928 1083743500 /nfs/dbraw/zinc/74/35/00/1083743500.db2.gz BXCDBMNJQRHEEX-XJKSGUPXSA-N 2 2 323.868 2.113 20 10 DECDLP C[NH+](C)CCN1C[C@@H]2CC[N@@H+](Cc3cccc(Cl)c3O)[C@@H]2C1 ZINC001276379928 1083743505 /nfs/dbraw/zinc/74/35/05/1083743505.db2.gz BXCDBMNJQRHEEX-XJKSGUPXSA-N 2 2 323.868 2.113 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2CCC[C@]3(C[NH2+]CCO3)C2)cc1 ZINC001235114106 1084315669 /nfs/dbraw/zinc/31/56/69/1084315669.db2.gz JXZAOEOOIUSQLF-IBGZPJMESA-N 2 2 317.477 2.487 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2CCC[C@]3(C[NH2+]CCO3)C2)cc1 ZINC001235114106 1084315679 /nfs/dbraw/zinc/31/56/79/1084315679.db2.gz JXZAOEOOIUSQLF-IBGZPJMESA-N 2 2 317.477 2.487 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)c(O)c1 ZINC001235219732 1084349769 /nfs/dbraw/zinc/34/97/69/1084349769.db2.gz ZKEMVSFCAQIHGP-PBHICJAKSA-N 2 2 303.450 2.422 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2C[C@H]3CCC[NH2+][C@H]3C2)c(O)c1 ZINC001235219732 1084349780 /nfs/dbraw/zinc/34/97/80/1084349780.db2.gz ZKEMVSFCAQIHGP-PBHICJAKSA-N 2 2 303.450 2.422 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC(=O)CC3)c(F)c2)CC1 ZINC001236935187 1138462403 /nfs/dbraw/zinc/46/24/03/1138462403.db2.gz FXYCRPFGCQMOPR-UHFFFAOYSA-N 2 2 319.424 2.133 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC(=O)CC3)c(F)c2)CC1 ZINC001236935187 1138462406 /nfs/dbraw/zinc/46/24/06/1138462406.db2.gz FXYCRPFGCQMOPR-UHFFFAOYSA-N 2 2 319.424 2.133 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC[NH2+]1 ZINC001246357518 1140887486 /nfs/dbraw/zinc/88/74/86/1140887486.db2.gz AHMMEYGOYZCHHD-RHSMWYFYSA-N 3 2 303.450 2.087 20 10 DECDLP COc1c(O)c(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000278323695 402863352 /nfs/dbraw/zinc/86/33/52/402863352.db2.gz YNNGFMAIZSUWLX-LBPRGKRZSA-N 2 2 323.393 2.083 20 10 DECDLP COc1c(O)c(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000278323695 402863353 /nfs/dbraw/zinc/86/33/53/402863353.db2.gz YNNGFMAIZSUWLX-LBPRGKRZSA-N 2 2 323.393 2.083 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@H](c3[nH+]ccn3C)C2)cc1OC ZINC000371366958 227070705 /nfs/dbraw/zinc/07/07/05/227070705.db2.gz QYUNPOBBXZDRCV-LBPRGKRZSA-N 2 2 317.389 2.132 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@H](c3[nH+]ccn3C)C2)cc1OC ZINC000371366958 227070706 /nfs/dbraw/zinc/07/07/06/227070706.db2.gz QYUNPOBBXZDRCV-LBPRGKRZSA-N 2 2 317.389 2.132 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923531861 637233573 /nfs/dbraw/zinc/23/35/73/637233573.db2.gz WQXJKWZXZYZGTN-LJQANCHMSA-N 2 2 315.461 2.241 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923531861 637233578 /nfs/dbraw/zinc/23/35/78/637233578.db2.gz WQXJKWZXZYZGTN-LJQANCHMSA-N 2 2 315.461 2.241 20 10 DECDLP COCC[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840931211 650387830 /nfs/dbraw/zinc/38/78/30/650387830.db2.gz DBOGCWBLHMOZQU-GOSISDBHSA-N 2 2 305.466 2.261 20 10 DECDLP COCC[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840931211 650387831 /nfs/dbraw/zinc/38/78/31/650387831.db2.gz DBOGCWBLHMOZQU-GOSISDBHSA-N 2 2 305.466 2.261 20 10 DECDLP COc1cccc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1O ZINC000841043555 650412426 /nfs/dbraw/zinc/41/24/26/650412426.db2.gz PICJYWVISFDAKQ-INIZCTEOSA-N 2 2 315.417 2.256 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c(c2)ncn3C)cc1 ZINC000841045642 650413546 /nfs/dbraw/zinc/41/35/46/650413546.db2.gz NNHGOWQAWIHWPR-QGZVFWFLSA-N 2 2 323.444 2.429 20 10 DECDLP [NH3+][C@@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000841034964 640889279 /nfs/dbraw/zinc/88/92/79/640889279.db2.gz FSQLYBFUDWRQEX-IBGZPJMESA-N 2 2 311.429 2.313 20 10 DECDLP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3c(O)cccc3Cl)CC2)C1 ZINC000769381515 641229933 /nfs/dbraw/zinc/22/99/33/641229933.db2.gz PDZVUMQHJJHJTR-CQSZACIVSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3c(O)cccc3Cl)CC2)C1 ZINC000769381515 641229938 /nfs/dbraw/zinc/22/99/38/641229938.db2.gz PDZVUMQHJJHJTR-CQSZACIVSA-N 2 2 323.868 2.257 20 10 DECDLP COc1ccc(N2CC[NH+](C[C@@]3(C)CCC[NH2+]C3)CC2)cc1F ZINC000904346410 643640927 /nfs/dbraw/zinc/64/09/27/643640927.db2.gz TYBXZCQRSSCVDS-SFHVURJKSA-N 2 2 321.440 2.346 20 10 DECDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817889347 647371784 /nfs/dbraw/zinc/37/17/84/647371784.db2.gz SSUCJHQKFNHMKM-WMLDXEAASA-N 2 2 305.491 2.327 20 10 DECDLP C[C@@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817941542 647388895 /nfs/dbraw/zinc/38/88/95/647388895.db2.gz RJADSRIUUFLAJM-HIFRSBDPSA-N 2 2 307.413 2.065 20 10 DECDLP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000848911582 651557616 /nfs/dbraw/zinc/55/76/16/651557616.db2.gz HGLFTBCLLFPENQ-HIFRSBDPSA-N 2 2 320.433 2.305 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)cc1 ZINC000848929470 651565844 /nfs/dbraw/zinc/56/58/44/651565844.db2.gz FJFSDKWZBAIYKJ-IBGZPJMESA-N 2 2 317.477 2.439 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)cc1 ZINC000848929470 651565847 /nfs/dbraw/zinc/56/58/47/651565847.db2.gz FJFSDKWZBAIYKJ-IBGZPJMESA-N 2 2 317.477 2.439 20 10 DECDLP COc1ccc(C[NH2+]CC[NH+]2CCCC2)cc1Cn1cccn1 ZINC000873008033 689140056 /nfs/dbraw/zinc/14/00/56/689140056.db2.gz MQVAWWDHWBMDKT-UHFFFAOYSA-N 2 2 314.433 2.125 20 10 DECDLP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(Br)cc1O ZINC000691463652 785813799 /nfs/dbraw/zinc/81/37/99/785813799.db2.gz OIKGECKCNIBMLA-UHFFFAOYSA-N 2 2 310.195 2.449 20 10 DECDLP [NH3+][C@@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@@H]1F ZINC001206172780 793473508 /nfs/dbraw/zinc/47/35/08/793473508.db2.gz BZFAFEYKTKMEPM-NWDGAFQWSA-N 2 2 317.202 2.416 20 10 DECDLP [NH3+][C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)CC[C@@H]1F ZINC001206172780 793473511 /nfs/dbraw/zinc/47/35/11/793473511.db2.gz BZFAFEYKTKMEPM-NWDGAFQWSA-N 2 2 317.202 2.416 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c1O ZINC001205789176 798120385 /nfs/dbraw/zinc/12/03/85/798120385.db2.gz XGXZCCUMTWJYHC-SNVBAGLBSA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c1O ZINC001205789176 798120389 /nfs/dbraw/zinc/12/03/89/798120389.db2.gz XGXZCCUMTWJYHC-SNVBAGLBSA-N 2 2 320.767 2.470 20 10 DECDLP C[NH+](C)CCC[N@H+](C)Cc1cc(O)c(Br)cc1O ZINC001236774294 1138424510 /nfs/dbraw/zinc/42/45/10/1138424510.db2.gz ZOBHQHMXCKELIM-UHFFFAOYSA-N 2 2 317.227 2.244 20 10 DECDLP C[NH+](C)CCC[N@@H+](C)Cc1cc(O)c(Br)cc1O ZINC001236774294 1138424515 /nfs/dbraw/zinc/42/45/15/1138424515.db2.gz ZOBHQHMXCKELIM-UHFFFAOYSA-N 2 2 317.227 2.244 20 10 DECDLP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H](C)CO1 ZINC001319932051 1140804593 /nfs/dbraw/zinc/80/45/93/1140804593.db2.gz HGNSZLIHBBYDET-GJZGRUSLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H](C)CO1 ZINC001319932051 1140804594 /nfs/dbraw/zinc/80/45/94/1140804594.db2.gz HGNSZLIHBBYDET-GJZGRUSLSA-N 2 2 321.440 2.187 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@H]1CC2CC[NH+](CC2)C1 ZINC001254833586 1143330536 /nfs/dbraw/zinc/33/05/36/1143330536.db2.gz PTOKPXYHSLEBFZ-SFHVURJKSA-N 2 2 315.461 2.097 20 10 DECDLP CCOc1ccc(O)c(C[NH+]2CCC([N@H+](C)CCCO)CC2)c1 ZINC000093412970 355682619 /nfs/dbraw/zinc/68/26/19/355682619.db2.gz PASUXQUSJVGMSP-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP CCOc1ccc(O)c(C[NH+]2CCC([N@@H+](C)CCCO)CC2)c1 ZINC000093412970 355682623 /nfs/dbraw/zinc/68/26/23/355682623.db2.gz PASUXQUSJVGMSP-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@@H]3CCC[N@@H+]3C)CC2)cc1 ZINC000179238301 402582942 /nfs/dbraw/zinc/58/29/42/402582942.db2.gz ZSAXGQCZRASVKV-INIZCTEOSA-N 2 2 303.450 2.302 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@@H]3CCC[N@H+]3C)CC2)cc1 ZINC000179238301 402582944 /nfs/dbraw/zinc/58/29/44/402582944.db2.gz ZSAXGQCZRASVKV-INIZCTEOSA-N 2 2 303.450 2.302 20 10 DECDLP C[C@@H]1C[NH+]=C(N2CC[NH+](Cc3cc(F)ccc3O)CC2)S1 ZINC000180199481 525090150 /nfs/dbraw/zinc/09/01/50/525090150.db2.gz KQBBFGPQNDFSQJ-LLVKDONJSA-N 2 2 309.410 2.140 20 10 DECDLP COc1ccc(C[N@H+](C)CCCn2cc[nH+]c2)c(O)c1OC ZINC000894475334 637060872 /nfs/dbraw/zinc/06/08/72/637060872.db2.gz CZQZODIHASIQIW-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP COc1ccc(C[N@@H+](C)CCCn2cc[nH+]c2)c(O)c1OC ZINC000894475334 637060873 /nfs/dbraw/zinc/06/08/73/637060873.db2.gz CZQZODIHASIQIW-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP COc1cc(Br)cc(C[NH2+]C[C@@H]2CCC[NH2+]2)c1O ZINC000841036636 650411113 /nfs/dbraw/zinc/41/11/13/650411113.db2.gz UBHQEKPQWVMEDT-NSHDSACASA-N 2 2 315.211 2.005 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@@]2(COC)CCC[NH2+]2)cc1 ZINC000841065304 650420917 /nfs/dbraw/zinc/42/09/17/650420917.db2.gz APIJPURIHXPCKB-GOSISDBHSA-N 2 2 305.466 2.391 20 10 DECDLP C[C@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046164 650876547 /nfs/dbraw/zinc/87/65/47/650876547.db2.gz PAKCEBLVVXIDPJ-LPHOPBHVSA-N 3 2 316.493 2.140 20 10 DECDLP C[C@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046164 650876552 /nfs/dbraw/zinc/87/65/52/650876552.db2.gz PAKCEBLVVXIDPJ-LPHOPBHVSA-N 3 2 316.493 2.140 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1O ZINC000843368642 650959395 /nfs/dbraw/zinc/95/93/95/650959395.db2.gz PYLSNTYRUFAZQL-UVBJJODRSA-N 2 2 306.381 2.293 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1O ZINC000843368642 650959399 /nfs/dbraw/zinc/95/93/99/650959399.db2.gz PYLSNTYRUFAZQL-UVBJJODRSA-N 2 2 306.381 2.293 20 10 DECDLP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000158100050 646589579 /nfs/dbraw/zinc/58/95/79/646589579.db2.gz BNSZZAOJSOKVQH-UHFFFAOYSA-N 2 2 311.857 2.161 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817890397 647371295 /nfs/dbraw/zinc/37/12/95/647371295.db2.gz XJORDKSLHOQTCU-RHSMWYFYSA-N 2 2 305.491 2.470 20 10 DECDLP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817892833 647372914 /nfs/dbraw/zinc/37/29/14/647372914.db2.gz WERZZUVMYDRIFX-DAYGRLMNSA-N 2 2 303.450 2.314 20 10 DECDLP C[C@H]([NH2+]CC1C[NH2+]C1)c1cc(Br)cc(F)c1O ZINC000817965784 647395885 /nfs/dbraw/zinc/39/58/85/647395885.db2.gz VDEGKTSWSXOASB-ZETCQYMHSA-N 2 2 303.175 2.164 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000854230593 652662592 /nfs/dbraw/zinc/66/25/92/652662592.db2.gz VFDSGORCCKRRGM-HNAYVOBHSA-N 2 2 317.477 2.268 20 10 DECDLP C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)c1ccc(N2CCOCC2)cc1 ZINC000863540208 686517502 /nfs/dbraw/zinc/51/75/02/686517502.db2.gz CITGBLJWXLXWKX-CRAIPNDOSA-N 2 2 315.461 2.458 20 10 DECDLP CC[C@@H]1COCC[N@@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258242 796350040 /nfs/dbraw/zinc/35/00/40/796350040.db2.gz NLWYKTDQVYCCFT-OAHLLOKOSA-N 2 2 308.422 2.073 20 10 DECDLP CC[C@@H]1COCC[N@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258242 796350045 /nfs/dbraw/zinc/35/00/45/796350045.db2.gz NLWYKTDQVYCCFT-OAHLLOKOSA-N 2 2 308.422 2.073 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3Cc4cccnc4C3)cc2)CC1 ZINC001139404701 796371575 /nfs/dbraw/zinc/37/15/75/796371575.db2.gz WHNROQYXJWBGTF-UHFFFAOYSA-N 2 2 308.429 2.349 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3Cc4cccnc4C3)cc2)CC1 ZINC001139404701 796371581 /nfs/dbraw/zinc/37/15/81/796371581.db2.gz WHNROQYXJWBGTF-UHFFFAOYSA-N 2 2 308.429 2.349 20 10 DECDLP Cc1ccc(C[NH+]2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(O)c1 ZINC001140950021 796606578 /nfs/dbraw/zinc/60/65/78/796606578.db2.gz QYCJMZPOQUWXJB-UHFFFAOYSA-N 2 2 312.417 2.430 20 10 DECDLP [NH3+]CC1CC[NH+](Cc2c(O)cc(Br)cc2F)CC1 ZINC001205047534 800290764 /nfs/dbraw/zinc/29/07/64/800290764.db2.gz YFBCCPFUEPFEKP-UHFFFAOYSA-N 2 2 317.202 2.465 20 10 DECDLP CC[NH+]1C[C@@H]2C[NH+](Cc3cc(Cl)c(OC)cc3O)C[C@H]2C1 ZINC001232271258 801835658 /nfs/dbraw/zinc/83/56/58/801835658.db2.gz TWJWYTIYBVSOIK-CHWSQXEVSA-N 2 2 310.825 2.438 20 10 DECDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)Cc1ccc(O)c(O)c1 ZINC001586305479 1076395875 /nfs/dbraw/zinc/39/58/75/1076395875.db2.gz UIQCJIPVGDUEEE-UHFFFAOYSA-N 2 2 324.340 2.168 20 10 DECDLP C[N@H+]1C[C@@H]2C[NH+](Cc3c(O)cccc3Br)C[C@@H]2C1 ZINC000707128670 1086660630 /nfs/dbraw/zinc/66/06/30/1086660630.db2.gz ZNWPDTYGIJWDAW-PHIMTYICSA-N 2 2 311.223 2.148 20 10 DECDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3c(O)cccc3Br)C[C@@H]2C1 ZINC000707128670 1086660632 /nfs/dbraw/zinc/66/06/32/1086660632.db2.gz ZNWPDTYGIJWDAW-PHIMTYICSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3c(O)cccc3Br)C[C@@H]2C1 ZINC000707128670 1086660634 /nfs/dbraw/zinc/66/06/34/1086660634.db2.gz ZNWPDTYGIJWDAW-PHIMTYICSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@H+](Cc3c(O)cccc3Br)C[C@@H]2C1 ZINC000707128670 1086660638 /nfs/dbraw/zinc/66/06/38/1086660638.db2.gz ZNWPDTYGIJWDAW-PHIMTYICSA-N 2 2 311.223 2.148 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@@H]1F ZINC001236932505 1138460922 /nfs/dbraw/zinc/46/09/22/1138460922.db2.gz QCRNOHBLDHDMNG-DYVFJYSZSA-N 2 2 309.404 2.367 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@@H]1F ZINC001236932505 1138460928 /nfs/dbraw/zinc/46/09/28/1138460928.db2.gz QCRNOHBLDHDMNG-DYVFJYSZSA-N 2 2 309.404 2.367 20 10 DECDLP CC[C@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943054 1138461853 /nfs/dbraw/zinc/46/18/53/1138461853.db2.gz PIBRHCVRUZJEAP-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943054 1138461856 /nfs/dbraw/zinc/46/18/56/1138461856.db2.gz PIBRHCVRUZJEAP-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP CN(CCC[N@H+](C)Cc1cccc(Cl)c1O)CC[NH+](C)C ZINC000290009622 282092289 /nfs/dbraw/zinc/09/22/89/282092289.db2.gz DMTYGYZSEINMAD-UHFFFAOYSA-N 2 2 313.873 2.361 20 10 DECDLP CN(CCC[N@@H+](C)Cc1cccc(Cl)c1O)CC[NH+](C)C ZINC000290009622 282092292 /nfs/dbraw/zinc/09/22/92/282092292.db2.gz DMTYGYZSEINMAD-UHFFFAOYSA-N 2 2 313.873 2.361 20 10 DECDLP CN1CC[N@H+](C)C[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000264791405 530070337 /nfs/dbraw/zinc/07/03/37/530070337.db2.gz XFULVDKARHPDEK-IBGZPJMESA-N 2 2 316.493 2.012 20 10 DECDLP CN1CC[N@@H+](C)C[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000264791405 530070338 /nfs/dbraw/zinc/07/03/38/530070338.db2.gz XFULVDKARHPDEK-IBGZPJMESA-N 2 2 316.493 2.012 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@H]3CCC[N@@H+]3C)CC2)cc1 ZINC000179238289 402582809 /nfs/dbraw/zinc/58/28/09/402582809.db2.gz ZSAXGQCZRASVKV-MRXNPFEDSA-N 2 2 303.450 2.302 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@H]3CCC[N@H+]3C)CC2)cc1 ZINC000179238289 402582810 /nfs/dbraw/zinc/58/28/10/402582810.db2.gz ZSAXGQCZRASVKV-MRXNPFEDSA-N 2 2 303.450 2.302 20 10 DECDLP C[C@H]([NH2+]C[C@H](O)C[NH+]1CCCCC1)c1ccc(F)c(F)c1O ZINC000191215945 525405398 /nfs/dbraw/zinc/40/53/98/525405398.db2.gz HRJSESHVOSUKRJ-RYUDHWBXSA-N 2 2 314.376 2.168 20 10 DECDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925502472 625100981 /nfs/dbraw/zinc/10/09/81/625100981.db2.gz LJKJCAHAXQLMMG-QGZVFWFLSA-N 2 2 321.440 2.017 20 10 DECDLP Cc1cc(Br)c(O)c(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000781911799 642798159 /nfs/dbraw/zinc/79/81/59/642798159.db2.gz RUUHQNFQLZTFEJ-RYUDHWBXSA-N 2 2 311.223 2.114 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)OCO2 ZINC000843048072 650877152 /nfs/dbraw/zinc/87/71/52/650877152.db2.gz MHCQHANBQHHKEQ-KBPBESRZSA-N 2 2 304.390 2.227 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)OCO2 ZINC000843048072 650877153 /nfs/dbraw/zinc/87/71/53/650877153.db2.gz MHCQHANBQHHKEQ-KBPBESRZSA-N 2 2 304.390 2.227 20 10 DECDLP [NH3+]C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)CC12CCOCC2 ZINC000843124471 650901113 /nfs/dbraw/zinc/90/11/13/650901113.db2.gz BDYFFIANXRXPDW-CYBMUJFWSA-N 2 2 310.825 2.233 20 10 DECDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC12CCOCC2 ZINC000843124471 650901118 /nfs/dbraw/zinc/90/11/18/650901118.db2.gz BDYFFIANXRXPDW-CYBMUJFWSA-N 2 2 310.825 2.233 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1 ZINC000817887870 647372034 /nfs/dbraw/zinc/37/20/34/647372034.db2.gz GHHKISRPEPCCOZ-OALUTQOASA-N 2 2 317.477 2.389 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817890401 647372178 /nfs/dbraw/zinc/37/21/78/647372178.db2.gz XJORDKSLHOQTCU-YOEHRIQHSA-N 2 2 305.491 2.470 20 10 DECDLP CC[C@@H]([NH2+]CCCN1CC[NH2+]CC1)c1cccc(Cl)c1O ZINC000817934679 647386714 /nfs/dbraw/zinc/38/67/14/647386714.db2.gz AMFJRZSFHLWATI-OAHLLOKOSA-N 2 2 311.857 2.382 20 10 DECDLP C[C@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817941545 647389240 /nfs/dbraw/zinc/38/92/40/647389240.db2.gz RJADSRIUUFLAJM-ZFWWWQNUSA-N 2 2 307.413 2.065 20 10 DECDLP CC[N@H+](C)C[C@@H](O)C[NH+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765954 651350331 /nfs/dbraw/zinc/35/03/31/651350331.db2.gz GIXJOJMRCKHAPB-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP CC[N@@H+](C)C[C@@H](O)C[NH+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765954 651350333 /nfs/dbraw/zinc/35/03/33/651350333.db2.gz GIXJOJMRCKHAPB-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](C)C[C@@H](O)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765954 651350335 /nfs/dbraw/zinc/35/03/35/651350335.db2.gz GIXJOJMRCKHAPB-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](C)C[C@@H](O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765954 651350336 /nfs/dbraw/zinc/35/03/36/651350336.db2.gz GIXJOJMRCKHAPB-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP CC[N@H+](C)C[C@H](O)C[NH+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776555 651350862 /nfs/dbraw/zinc/35/08/62/651350862.db2.gz REVJTBXIDRUHBO-SFHVURJKSA-N 2 2 305.466 2.030 20 10 DECDLP CC[N@@H+](C)C[C@H](O)C[NH+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776555 651350863 /nfs/dbraw/zinc/35/08/63/651350863.db2.gz REVJTBXIDRUHBO-SFHVURJKSA-N 2 2 305.466 2.030 20 10 DECDLP CC[NH+](C)C[C@H](O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776555 651350864 /nfs/dbraw/zinc/35/08/64/651350864.db2.gz REVJTBXIDRUHBO-SFHVURJKSA-N 2 2 305.466 2.030 20 10 DECDLP CC[NH+](C)C[C@H](O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776555 651350865 /nfs/dbraw/zinc/35/08/65/651350865.db2.gz REVJTBXIDRUHBO-SFHVURJKSA-N 2 2 305.466 2.030 20 10 DECDLP COc1ccc(C[NH2+]C2CC([NH+](C)C)C2)cc1Cn1cccn1 ZINC000873134025 689166570 /nfs/dbraw/zinc/16/65/70/689166570.db2.gz MKLXPZRYVDIKCL-UHFFFAOYSA-N 2 2 314.433 2.122 20 10 DECDLP CCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877635751 690174553 /nfs/dbraw/zinc/17/45/53/690174553.db2.gz CUSRSXHWFCYYRV-QGZVFWFLSA-N 2 2 317.477 2.222 20 10 DECDLP CCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877635751 690174557 /nfs/dbraw/zinc/17/45/57/690174557.db2.gz CUSRSXHWFCYYRV-QGZVFWFLSA-N 2 2 317.477 2.222 20 10 DECDLP C[N@@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931718046 694462487 /nfs/dbraw/zinc/46/24/87/694462487.db2.gz SBOVZUKEARHINM-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[N@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931718046 694462491 /nfs/dbraw/zinc/46/24/91/694462491.db2.gz SBOVZUKEARHINM-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931718046 694462495 /nfs/dbraw/zinc/46/24/95/694462495.db2.gz SBOVZUKEARHINM-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931718046 694462496 /nfs/dbraw/zinc/46/24/96/694462496.db2.gz SBOVZUKEARHINM-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP COc1cc(C[N@H+](C(C)C)C2CC[NH+](C)CC2)c(O)cc1O ZINC001231639999 801702334 /nfs/dbraw/zinc/70/23/34/801702334.db2.gz OCJHRTTYWPPZRM-UHFFFAOYSA-N 2 2 308.422 2.411 20 10 DECDLP COc1cc(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)c(O)cc1O ZINC001231639999 801702335 /nfs/dbraw/zinc/70/23/35/801702335.db2.gz OCJHRTTYWPPZRM-UHFFFAOYSA-N 2 2 308.422 2.411 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222248288 802661193 /nfs/dbraw/zinc/66/11/93/802661193.db2.gz KKURILBDJJFVTG-GOSISDBHSA-N 2 2 303.450 2.479 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222248288 802661198 /nfs/dbraw/zinc/66/11/98/802661198.db2.gz KKURILBDJJFVTG-GOSISDBHSA-N 2 2 303.450 2.479 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000020180494 1076077062 /nfs/dbraw/zinc/07/70/62/1076077062.db2.gz XGGVBJFQPHMWQA-INIZCTEOSA-N 2 2 303.450 2.349 20 10 DECDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cccc(Cl)c1O ZINC000186595551 402446143 /nfs/dbraw/zinc/44/61/43/402446143.db2.gz HNWWDDGTBMZFTC-ZDUSSCGKSA-N 2 2 311.857 2.161 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841044920 650413642 /nfs/dbraw/zinc/41/36/42/650413642.db2.gz FYDYSLROCQONAR-INIZCTEOSA-N 2 2 303.381 2.387 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2CCCO[C@H](C[NH3+])C2)cc1F ZINC000841100944 650431311 /nfs/dbraw/zinc/43/13/11/650431311.db2.gz PMRMSAMWAUGUAD-OAHLLOKOSA-N 2 2 309.429 2.222 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2CCCO[C@H](C[NH3+])C2)cc1F ZINC000841100944 650431313 /nfs/dbraw/zinc/43/13/13/650431313.db2.gz PMRMSAMWAUGUAD-OAHLLOKOSA-N 2 2 309.429 2.222 20 10 DECDLP CC[NH+](CC)CCOCC[NH2+]Cc1cccc(Cl)c1O ZINC000757944902 639899240 /nfs/dbraw/zinc/89/92/40/639899240.db2.gz CLLDQDCJYDAZMW-UHFFFAOYSA-N 2 2 300.830 2.494 20 10 DECDLP CN(C)c1ccc([C@@H](CNc2cc[nH+]cc2F)[NH+](C)C)cc1 ZINC000897521774 640537818 /nfs/dbraw/zinc/53/78/18/640537818.db2.gz IUERCWYVLUINOB-QGZVFWFLSA-N 2 2 302.397 2.423 20 10 DECDLP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774991143 641991079 /nfs/dbraw/zinc/99/10/79/641991079.db2.gz NNIBOLDPKHKCJJ-GFCCVEGCSA-N 2 2 323.393 2.131 20 10 DECDLP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774991143 641991082 /nfs/dbraw/zinc/99/10/82/641991082.db2.gz NNIBOLDPKHKCJJ-GFCCVEGCSA-N 2 2 323.393 2.131 20 10 DECDLP CCOc1ccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)c(O)c1 ZINC000903973205 643530658 /nfs/dbraw/zinc/53/06/58/643530658.db2.gz BGERSWRQKHGXKL-HNNXBMFYSA-N 2 2 320.433 2.039 20 10 DECDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC000817938605 647388322 /nfs/dbraw/zinc/38/83/22/647388322.db2.gz OGCZGXSYPSYHSS-KDOFPFPSSA-N 3 2 304.482 2.072 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1Cl ZINC000825247192 648731181 /nfs/dbraw/zinc/73/11/81/648731181.db2.gz OEOFDJFTNWPRED-ZIAGYGMSSA-N 2 2 310.825 2.307 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc1Cl ZINC000825247192 648731184 /nfs/dbraw/zinc/73/11/84/648731184.db2.gz OEOFDJFTNWPRED-ZIAGYGMSSA-N 2 2 310.825 2.307 20 10 DECDLP COC(=O)CCC[NH+]1CCC([NH2+]Cc2cc(C)ccc2O)CC1 ZINC000862476197 686307964 /nfs/dbraw/zinc/30/79/64/686307964.db2.gz LQGIGCBZNMTPMB-UHFFFAOYSA-N 2 2 320.433 2.208 20 10 DECDLP COc1cc(C[N@@H+]2CCCCC23COC3)cc(C[NH+](C)C)c1O ZINC001139256762 796349902 /nfs/dbraw/zinc/34/99/02/796349902.db2.gz JTKPTXNXWMNZHX-UHFFFAOYSA-N 2 2 320.433 2.217 20 10 DECDLP COc1cc(C[N@H+]2CCCCC23COC3)cc(C[NH+](C)C)c1O ZINC001139256762 796349906 /nfs/dbraw/zinc/34/99/06/796349906.db2.gz JTKPTXNXWMNZHX-UHFFFAOYSA-N 2 2 320.433 2.217 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001205780888 798084654 /nfs/dbraw/zinc/08/46/54/798084654.db2.gz SXSPIWHEZSEWSV-CYBMUJFWSA-N 2 2 313.392 2.177 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001205780888 798084660 /nfs/dbraw/zinc/08/46/60/798084660.db2.gz SXSPIWHEZSEWSV-CYBMUJFWSA-N 2 2 313.392 2.177 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001203552071 800078877 /nfs/dbraw/zinc/07/88/77/800078877.db2.gz ZATXOYSUKBDMRF-ROUUACIJSA-N 2 2 309.413 2.351 20 10 DECDLP CC1([NH+]2CCCC2)CC[NH+](Cc2cc(O)c(O)cc2O)CC1 ZINC001233486930 802127252 /nfs/dbraw/zinc/12/72/52/802127252.db2.gz IRCBFQHSKGBTBW-UHFFFAOYSA-N 2 2 306.406 2.254 20 10 DECDLP CC[C@H]([NH3+])C[N@H+](C)Cc1cc(OC)c(Br)cc1O ZINC001236883472 1138447471 /nfs/dbraw/zinc/44/74/71/1138447471.db2.gz CHDHVFMXMOCKQN-JTQLQIEISA-N 2 2 317.227 2.332 20 10 DECDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1cc(OC)c(Br)cc1O ZINC001236883472 1138447479 /nfs/dbraw/zinc/44/74/79/1138447479.db2.gz CHDHVFMXMOCKQN-JTQLQIEISA-N 2 2 317.227 2.332 20 10 DECDLP Cc1cccc(O)c1C[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001237484854 1138652014 /nfs/dbraw/zinc/65/20/14/1138652014.db2.gz BJXKNJORHLDIRK-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP Cc1cccc(O)c1C[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001237484854 1138652017 /nfs/dbraw/zinc/65/20/17/1138652017.db2.gz BJXKNJORHLDIRK-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP COc1cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)c(OC)c1 ZINC001237678970 1138751458 /nfs/dbraw/zinc/75/14/58/1138751458.db2.gz RHFMQOMCUSPUMO-UHFFFAOYSA-N 2 2 317.389 2.443 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CC2CC[NH+](CC2)C1 ZINC001254833585 1143330353 /nfs/dbraw/zinc/33/03/53/1143330353.db2.gz PTOKPXYHSLEBFZ-GOSISDBHSA-N 2 2 315.461 2.097 20 10 DECDLP Cc1ncc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)o1 ZINC001326798917 1148249372 /nfs/dbraw/zinc/24/93/72/1148249372.db2.gz WVSBFWONHRUJLS-UHFFFAOYSA-N 2 2 318.396 2.164 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)c1 ZINC000273297555 130103855 /nfs/dbraw/zinc/10/38/55/130103855.db2.gz AMSLODMNUSQETB-GFCCVEGCSA-N 2 2 317.389 2.425 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCOCC2)cc1 ZINC000154506776 402215943 /nfs/dbraw/zinc/21/59/43/402215943.db2.gz IMJCFDLGXGKTCQ-CRAIPNDOSA-N 2 2 303.450 2.268 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCOCC2)cc1 ZINC000154506776 402215944 /nfs/dbraw/zinc/21/59/44/402215944.db2.gz IMJCFDLGXGKTCQ-CRAIPNDOSA-N 2 2 303.450 2.268 20 10 DECDLP COc1ccc(O)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1 ZINC000369461822 534200659 /nfs/dbraw/zinc/20/06/59/534200659.db2.gz FNAJQHGAOYJYRA-MRXNPFEDSA-N 2 2 300.358 2.449 20 10 DECDLP COc1ccc(O)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1 ZINC000369461822 534200663 /nfs/dbraw/zinc/20/06/63/534200663.db2.gz FNAJQHGAOYJYRA-MRXNPFEDSA-N 2 2 300.358 2.449 20 10 DECDLP C[N@H+](CCCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC000182668327 522802972 /nfs/dbraw/zinc/80/29/72/522802972.db2.gz WHJLLOIJKRFYDM-UHFFFAOYSA-N 2 2 314.433 2.242 20 10 DECDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC000182668327 522802984 /nfs/dbraw/zinc/80/29/84/522802984.db2.gz WHJLLOIJKRFYDM-UHFFFAOYSA-N 2 2 314.433 2.242 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000925764448 634766255 /nfs/dbraw/zinc/76/62/55/634766255.db2.gz YYUAEBVDJCJTJS-VQIMIIECSA-N 3 2 316.493 2.059 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000841042083 650411748 /nfs/dbraw/zinc/41/17/48/650411748.db2.gz HLHKQODCSIRISC-KRWDZBQOSA-N 2 2 314.389 2.450 20 10 DECDLP C[C@@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)Cn1cc[nH+]c1 ZINC000067500747 639193015 /nfs/dbraw/zinc/19/30/15/639193015.db2.gz GMWHSVJQMSHIIN-INIZCTEOSA-N 2 2 314.433 2.146 20 10 DECDLP [NH3+]CC[N@H+](CCc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000843121755 650900423 /nfs/dbraw/zinc/90/04/23/650900423.db2.gz KTKFJLGPTTWNPH-UHFFFAOYSA-N 2 2 314.385 2.124 20 10 DECDLP [NH3+]CC[N@@H+](CCc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000843121755 650900425 /nfs/dbraw/zinc/90/04/25/650900425.db2.gz KTKFJLGPTTWNPH-UHFFFAOYSA-N 2 2 314.385 2.124 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCC[NH2+]1 ZINC000817887773 647372104 /nfs/dbraw/zinc/37/21/04/647372104.db2.gz DURJUUHHWOMCJE-RHSMWYFYSA-N 2 2 321.440 2.283 20 10 DECDLP C[C@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898399 647376458 /nfs/dbraw/zinc/37/64/58/647376458.db2.gz HNBPQJZEQJMKAW-WBVHZDCISA-N 2 2 303.450 2.143 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCc3c2cnn3C)cc1 ZINC000817937998 647388298 /nfs/dbraw/zinc/38/82/98/647388298.db2.gz BBFWWASEMCIXRY-IAGOWNOFSA-N 2 2 313.449 2.153 20 10 DECDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817967490 647396054 /nfs/dbraw/zinc/39/60/54/647396054.db2.gz JMIDOYAWODKPIP-JKIFEVAISA-N 2 2 321.440 2.311 20 10 DECDLP Cn1cc[nH+]c1N1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000827892449 649100887 /nfs/dbraw/zinc/10/08/87/649100887.db2.gz YTLQUZABGCKVMA-UHFFFAOYSA-N 2 2 306.797 2.101 20 10 DECDLP Fc1cc(C[NH2+][C@@H]2CC[NH2+]C23CCC3)ccc1N1CCOCC1 ZINC000863481514 686508204 /nfs/dbraw/zinc/50/82/04/686508204.db2.gz FVJKKERWLIEJPV-QGZVFWFLSA-N 2 2 319.424 2.037 20 10 DECDLP CC[NH+](CC)C1CC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)CC1 ZINC001116437347 794956974 /nfs/dbraw/zinc/95/69/74/794956974.db2.gz ZSZPLOCTKWCSDA-KRWDZBQOSA-N 2 2 320.433 2.124 20 10 DECDLP COc1cc(C[N@@H+]2CCOC[C@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139257845 796350425 /nfs/dbraw/zinc/35/04/25/796350425.db2.gz IKYXWHQSLHEXQR-INIZCTEOSA-N 2 2 322.449 2.319 20 10 DECDLP COc1cc(C[N@H+]2CCOC[C@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139257845 796350426 /nfs/dbraw/zinc/35/04/26/796350426.db2.gz IKYXWHQSLHEXQR-INIZCTEOSA-N 2 2 322.449 2.319 20 10 DECDLP Cc1cc(N2CC[NH+](Cc3cc(F)ccc3O)CC2)nc(C)[nH+]1 ZINC001140055752 796470872 /nfs/dbraw/zinc/47/08/72/796470872.db2.gz SLHBKZMDXGRFHI-UHFFFAOYSA-N 2 2 316.380 2.260 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@H+](C)Cc3ccon3)cc2)CC1 ZINC001140306248 796504769 /nfs/dbraw/zinc/50/47/69/796504769.db2.gz QLKUCJWYTOLBRW-UHFFFAOYSA-N 2 2 314.433 2.449 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@@H+](C)Cc3ccon3)cc2)CC1 ZINC001140306248 796504772 /nfs/dbraw/zinc/50/47/72/796504772.db2.gz QLKUCJWYTOLBRW-UHFFFAOYSA-N 2 2 314.433 2.449 20 10 DECDLP CN(C)c1ccc(C[N@H+](C)C[C@@H]2C[NH2+]CCO2)c2ccccc21 ZINC001205376303 800350289 /nfs/dbraw/zinc/35/02/89/800350289.db2.gz FNJJPICMWBLAIE-INIZCTEOSA-N 2 2 313.445 2.326 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C)C[C@@H]2C[NH2+]CCO2)c2ccccc21 ZINC001205376303 800350292 /nfs/dbraw/zinc/35/02/92/800350292.db2.gz FNJJPICMWBLAIE-INIZCTEOSA-N 2 2 313.445 2.326 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001205725446 800408745 /nfs/dbraw/zinc/40/87/45/800408745.db2.gz HOWKMCXNLXLVRU-CQSZACIVSA-N 2 2 318.339 2.087 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001205725446 800408749 /nfs/dbraw/zinc/40/87/49/800408749.db2.gz HOWKMCXNLXLVRU-CQSZACIVSA-N 2 2 318.339 2.087 20 10 DECDLP CC(C)(C)c1ccc(O)c(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c1 ZINC001222507362 802698293 /nfs/dbraw/zinc/69/82/93/802698293.db2.gz UPAPVNSZAAYCOZ-IRXDYDNUSA-N 2 2 317.477 2.216 20 10 DECDLP C[C@H](CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[NH+](C)C ZINC001331549592 1149526470 /nfs/dbraw/zinc/52/64/70/1149526470.db2.gz SAGTUMKDJNWISD-OAHLLOKOSA-N 3 2 322.472 2.007 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@H](C)O1 ZINC001236931356 1138459722 /nfs/dbraw/zinc/45/97/22/1138459722.db2.gz JYQNWVRTANNIMQ-GASCZTMLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C[C@H](C)O1 ZINC001236931356 1138459725 /nfs/dbraw/zinc/45/97/25/1138459725.db2.gz JYQNWVRTANNIMQ-GASCZTMLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)CO1 ZINC001236944850 1138463344 /nfs/dbraw/zinc/46/33/44/1138463344.db2.gz GUUOKYZYJPEALK-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)CO1 ZINC001236944850 1138463348 /nfs/dbraw/zinc/46/33/48/1138463348.db2.gz GUUOKYZYJPEALK-LSDHHAIUSA-N 2 2 321.440 2.187 20 10 DECDLP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1COC1 ZINC001261256084 1144228401 /nfs/dbraw/zinc/22/84/01/1144228401.db2.gz VBPVWNCPQUBBOI-UHFFFAOYSA-N 2 2 321.440 2.187 20 10 DECDLP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1COC1 ZINC001261256084 1144228403 /nfs/dbraw/zinc/22/84/03/1144228403.db2.gz VBPVWNCPQUBBOI-UHFFFAOYSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCOCC2)cc1 ZINC000154506664 402215790 /nfs/dbraw/zinc/21/57/90/402215790.db2.gz IMJCFDLGXGKTCQ-MAUKXSAKSA-N 2 2 303.450 2.268 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCOCC2)cc1 ZINC000154506664 402215791 /nfs/dbraw/zinc/21/57/91/402215791.db2.gz IMJCFDLGXGKTCQ-MAUKXSAKSA-N 2 2 303.450 2.268 20 10 DECDLP COc1ccc(N2CCC[N@H+](CCn3cc[nH+]c3)CC2)cc1 ZINC000159768721 402330232 /nfs/dbraw/zinc/33/02/32/402330232.db2.gz BJRKPNRANXRMKG-UHFFFAOYSA-N 2 2 300.406 2.104 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000278472485 402866581 /nfs/dbraw/zinc/86/65/81/402866581.db2.gz HOOOCSJVROVMDA-OLZOCXBDSA-N 2 2 323.393 2.271 20 10 DECDLP COc1ccc(O)c(C[NH+]2CCN(C3=[NH+]C[C@H](C)S3)CC2)c1 ZINC000180448126 524742747 /nfs/dbraw/zinc/74/27/47/524742747.db2.gz DBFZAOOSFKCVHH-LBPRGKRZSA-N 2 2 321.446 2.010 20 10 DECDLP Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000180066455 526348826 /nfs/dbraw/zinc/34/88/26/526348826.db2.gz FDZZGDNHOHNVAH-AWEZNQCLSA-N 2 2 308.397 2.076 20 10 DECDLP Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000180066455 526348829 /nfs/dbraw/zinc/34/88/29/526348829.db2.gz FDZZGDNHOHNVAH-AWEZNQCLSA-N 2 2 308.397 2.076 20 10 DECDLP COc1c(O)c(C[NH2+][C@H](C[NH3+])C2CCCCC2)ccc1[N+](=O)[O-] ZINC000841039115 650412095 /nfs/dbraw/zinc/41/20/95/650412095.db2.gz AXQRIBQYUTWLPA-CYBMUJFWSA-N 2 2 323.393 2.306 20 10 DECDLP C[C@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000841076532 650424121 /nfs/dbraw/zinc/42/41/21/650424121.db2.gz HYAWRZHJZWJGHX-STQMWFEESA-N 2 2 306.410 2.410 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903969703 643529811 /nfs/dbraw/zinc/52/98/11/643529811.db2.gz JKQQKAPTCREBIR-QGZVFWFLSA-N 2 2 317.477 2.309 20 10 DECDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1cccc(Cl)c1O)CCO2 ZINC000843431557 650973995 /nfs/dbraw/zinc/97/39/95/650973995.db2.gz HPBVWVMWBPVOQY-UHFFFAOYSA-N 2 2 310.825 2.342 20 10 DECDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cccc(Cl)c1O)CCO2 ZINC000843431557 650973999 /nfs/dbraw/zinc/97/39/99/650973999.db2.gz HPBVWVMWBPVOQY-UHFFFAOYSA-N 2 2 310.825 2.342 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817890399 647371859 /nfs/dbraw/zinc/37/18/59/647371859.db2.gz XJORDKSLHOQTCU-WMLDXEAASA-N 2 2 305.491 2.470 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCC[NH2+]1 ZINC000817887774 647372084 /nfs/dbraw/zinc/37/20/84/647372084.db2.gz DURJUUHHWOMCJE-WMLDXEAASA-N 2 2 321.440 2.283 20 10 DECDLP CCn1cc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000817944197 647389949 /nfs/dbraw/zinc/38/99/49/647389949.db2.gz YAPIECQDNLGXES-GUYCJALGSA-N 2 2 301.438 2.320 20 10 DECDLP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(C(F)(F)F)cc1O ZINC000817982807 647400076 /nfs/dbraw/zinc/40/00/76/647400076.db2.gz HNAVQXLFVZVPBQ-WCQYABFASA-N 2 2 318.339 2.440 20 10 DECDLP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817984460 647400892 /nfs/dbraw/zinc/40/08/92/647400892.db2.gz TWAHGSOEIXVVFO-GOEBONIOSA-N 2 2 321.440 2.455 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)cc1Cl ZINC000827698662 649070121 /nfs/dbraw/zinc/07/01/21/649070121.db2.gz ALFODENUUNETGP-OAHLLOKOSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1Cl ZINC000827698662 649070124 /nfs/dbraw/zinc/07/01/24/649070124.db2.gz ALFODENUUNETGP-OAHLLOKOSA-N 2 2 324.852 2.385 20 10 DECDLP CCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000850394896 651919896 /nfs/dbraw/zinc/91/98/96/651919896.db2.gz HPSAXHAKKHDSGQ-GOSISDBHSA-N 3 2 316.493 2.012 20 10 DECDLP CCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000850394896 651919897 /nfs/dbraw/zinc/91/98/97/651919897.db2.gz HPSAXHAKKHDSGQ-GOSISDBHSA-N 3 2 316.493 2.012 20 10 DECDLP COC(=O)CCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000877757092 690217852 /nfs/dbraw/zinc/21/78/52/690217852.db2.gz FSZLUHZTUKKPOK-AWEZNQCLSA-N 2 2 320.433 2.460 20 10 DECDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925474397 693278875 /nfs/dbraw/zinc/27/88/75/693278875.db2.gz JEQPYOVHGBTBEW-INIZCTEOSA-N 2 2 305.491 2.470 20 10 DECDLP Oc1ccc(O)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c1 ZINC001141159219 778316959 /nfs/dbraw/zinc/31/69/59/778316959.db2.gz CKOSZLOJHWQRPP-UHFFFAOYSA-N 2 2 308.397 2.496 20 10 DECDLP [NH3+][C@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@@H]1F ZINC001206172783 793472956 /nfs/dbraw/zinc/47/29/56/793472956.db2.gz BZFAFEYKTKMEPM-RYUDHWBXSA-N 2 2 317.202 2.416 20 10 DECDLP [NH3+][C@H]1CC[N@@H+](Cc2c(O)cccc2Br)CC[C@@H]1F ZINC001206172783 793472958 /nfs/dbraw/zinc/47/29/58/793472958.db2.gz BZFAFEYKTKMEPM-RYUDHWBXSA-N 2 2 317.202 2.416 20 10 DECDLP CC(C)C[N@@H+]1CCO[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001177062012 794570648 /nfs/dbraw/zinc/57/06/48/794570648.db2.gz ZFHVRSSRQSMVSC-GOSISDBHSA-N 2 2 318.461 2.458 20 10 DECDLP CC(C)C[N@H+]1CCO[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001177062012 794570654 /nfs/dbraw/zinc/57/06/54/794570654.db2.gz ZFHVRSSRQSMVSC-GOSISDBHSA-N 2 2 318.461 2.458 20 10 DECDLP CC[N@H+](CCC[NH+](C)C)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139259150 796351214 /nfs/dbraw/zinc/35/12/14/796351214.db2.gz JVOHTUYADWELBO-UHFFFAOYSA-N 3 2 323.481 2.236 20 10 DECDLP CC[N@@H+](CCC[NH+](C)C)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139259150 796351216 /nfs/dbraw/zinc/35/12/16/796351216.db2.gz JVOHTUYADWELBO-UHFFFAOYSA-N 3 2 323.481 2.236 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3[C@@H](C)CC[C@H]3C[NH3+])cc2)CC1 ZINC001205068149 800292414 /nfs/dbraw/zinc/29/24/14/800292414.db2.gz DECCQRJMXRROCT-LPHOPBHVSA-N 3 2 316.493 2.140 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@H+]3[C@@H](C)CC[C@H]3C[NH3+])cc2)CC1 ZINC001205068149 800292417 /nfs/dbraw/zinc/29/24/17/800292417.db2.gz DECCQRJMXRROCT-LPHOPBHVSA-N 3 2 316.493 2.140 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205101303 800296082 /nfs/dbraw/zinc/29/60/82/800296082.db2.gz CYPYVUXTZQOQIO-GFCCVEGCSA-N 2 2 302.374 2.120 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205101303 800296087 /nfs/dbraw/zinc/29/60/87/800296087.db2.gz CYPYVUXTZQOQIO-GFCCVEGCSA-N 2 2 302.374 2.120 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c(Cl)c1 ZINC001206200720 800488647 /nfs/dbraw/zinc/48/86/47/800488647.db2.gz SSJRGIPQRPYPCG-OLZOCXBDSA-N 2 2 302.777 2.315 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c(Cl)c1 ZINC001206200720 800488650 /nfs/dbraw/zinc/48/86/50/800488650.db2.gz SSJRGIPQRPYPCG-OLZOCXBDSA-N 2 2 302.777 2.315 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000020180496 1076076842 /nfs/dbraw/zinc/07/68/42/1076076842.db2.gz XGGVBJFQPHMWQA-MRXNPFEDSA-N 2 2 303.450 2.349 20 10 DECDLP CC(C)c1ccc(O)c(C[N@H+](CCO)C2CC[NH+](C)CC2)c1 ZINC001658202662 1080201487 /nfs/dbraw/zinc/20/14/87/1080201487.db2.gz ZOVMCCGQMKMHCC-UHFFFAOYSA-N 2 2 306.450 2.404 20 10 DECDLP CC(C)c1ccc(O)c(C[N@@H+](CCO)C2CC[NH+](C)CC2)c1 ZINC001658202662 1080201497 /nfs/dbraw/zinc/20/14/97/1080201497.db2.gz ZOVMCCGQMKMHCC-UHFFFAOYSA-N 2 2 306.450 2.404 20 10 DECDLP [NH3+]CC1CC[NH+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000715766048 1085829659 /nfs/dbraw/zinc/82/96/59/1085829659.db2.gz MOMUNKLTOWPRCO-UHFFFAOYSA-N 2 2 317.202 2.465 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(C(F)F)C3)c(F)c2)CC1 ZINC001236946216 1138463928 /nfs/dbraw/zinc/46/39/28/1138463928.db2.gz MNTXPAHYDRHSNX-UHFFFAOYSA-N 2 2 313.367 2.274 20 10 DECDLP COc1cc(C[NH+]2CCC([NH+]3CCCC3)CC2)c(O)c(OC)c1 ZINC001237671395 1138747389 /nfs/dbraw/zinc/74/73/89/1138747389.db2.gz BLUJGZUDSGLQTP-UHFFFAOYSA-N 2 2 320.433 2.470 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000925764447 634765767 /nfs/dbraw/zinc/76/57/67/634765767.db2.gz YYUAEBVDJCJTJS-QFBILLFUSA-N 3 2 316.493 2.059 20 10 DECDLP COC(=O)C1CCC([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000841042753 650412831 /nfs/dbraw/zinc/41/28/31/650412831.db2.gz NGEVKTZSONMZTC-DQPZFDDXSA-N 2 2 319.449 2.074 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@H](O)C[NH+]2CCCC2)c2c1c(F)ccc2O ZINC000756450847 639663768 /nfs/dbraw/zinc/66/37/68/639663768.db2.gz UAXJIDWXIJQNTC-MBNYWOFBSA-N 2 2 308.397 2.126 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000817895836 647375406 /nfs/dbraw/zinc/37/54/06/647375406.db2.gz WUPHETBLBLMKDT-YJBOKZPZSA-N 2 2 303.450 2.143 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC000817938607 647387869 /nfs/dbraw/zinc/38/78/69/647387869.db2.gz OGCZGXSYPSYHSS-RDTXWAMCSA-N 3 2 304.482 2.072 20 10 DECDLP Cc1nn(C)cc1[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939002 647387976 /nfs/dbraw/zinc/38/79/76/647387976.db2.gz XIJJQCULGLNTCI-SJKOYZFVSA-N 2 2 301.438 2.145 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817982416 647399925 /nfs/dbraw/zinc/39/99/25/647399925.db2.gz DPMOYJVUTZESQP-GOEBONIOSA-N 2 2 321.440 2.455 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCN(c3[nH+]ccn3C)CC2)cc1C ZINC000827891317 649100163 /nfs/dbraw/zinc/10/01/63/649100163.db2.gz HNSNBLQBYDXWET-UHFFFAOYSA-N 2 2 300.406 2.065 20 10 DECDLP C[C@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(N2CCOCC2)c(F)c1 ZINC000854228322 652661744 /nfs/dbraw/zinc/66/17/44/652661744.db2.gz VEWKJMYCBOACOQ-VNSJNIRKSA-N 2 2 319.424 2.065 20 10 DECDLP C[NH+]1CCN(C2CC[NH+](Cc3c(O)cccc3Cl)CC2)CC1 ZINC000877747469 690214144 /nfs/dbraw/zinc/21/41/44/690214144.db2.gz MYINZOSIMJQYHA-UHFFFAOYSA-N 2 2 323.868 2.257 20 10 DECDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925479446 693279302 /nfs/dbraw/zinc/27/93/02/693279302.db2.gz ZRKWJQQJARMANA-PBHICJAKSA-N 2 2 305.491 2.470 20 10 DECDLP COc1cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)cc1O ZINC001231638342 801702494 /nfs/dbraw/zinc/70/24/94/801702494.db2.gz YCPCRZIEFKMLLG-UHFFFAOYSA-N 2 2 303.362 2.140 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c1O ZINC001233290459 802064931 /nfs/dbraw/zinc/06/49/31/802064931.db2.gz DBVJFWVLYLJCDA-MLGOLLRUSA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c1O ZINC001233290459 802064940 /nfs/dbraw/zinc/06/49/40/802064940.db2.gz DBVJFWVLYLJCDA-MLGOLLRUSA-N 2 2 310.825 2.438 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4C[C@@H]4[C@@H](F)C3)c(F)c2)CC1 ZINC001236936970 1138462029 /nfs/dbraw/zinc/46/20/29/1138462029.db2.gz WDLCYAXWFWMZGS-ZVZYQTTQSA-N 2 2 321.415 2.367 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4C[C@@H]4[C@@H](F)C3)c(F)c2)CC1 ZINC001236936970 1138462038 /nfs/dbraw/zinc/46/20/38/1138462038.db2.gz WDLCYAXWFWMZGS-ZVZYQTTQSA-N 2 2 321.415 2.367 20 10 DECDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000093664485 402018750 /nfs/dbraw/zinc/01/87/50/402018750.db2.gz HOUALGJWABUOMO-CYBMUJFWSA-N 2 2 310.825 2.200 20 10 DECDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000093664485 402018752 /nfs/dbraw/zinc/01/87/52/402018752.db2.gz HOUALGJWABUOMO-CYBMUJFWSA-N 2 2 310.825 2.200 20 10 DECDLP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N1CC[NH+](C)CC1 ZINC000170789702 402525699 /nfs/dbraw/zinc/52/56/99/402525699.db2.gz QIWOZJISAXWEAU-WMLDXEAASA-N 2 2 323.456 2.454 20 10 DECDLP Oc1c(Cl)cccc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC000179599038 402595973 /nfs/dbraw/zinc/59/59/73/402595973.db2.gz RTEJOIYLWKKKNZ-UHFFFAOYSA-N 2 2 323.868 2.259 20 10 DECDLP Cc1cccc(C[NH+](CCC[NH+](C)C)CCC[NH+](C)C)c1O ZINC000289808296 404000698 /nfs/dbraw/zinc/00/06/98/404000698.db2.gz NHIWBFKXEHBQDT-UHFFFAOYSA-N 3 2 307.482 2.406 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000365821539 404726840 /nfs/dbraw/zinc/72/68/40/404726840.db2.gz LGGTYWWYMGGKSK-QWHCGFSZSA-N 2 2 321.377 2.025 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000365821539 404726842 /nfs/dbraw/zinc/72/68/42/404726842.db2.gz LGGTYWWYMGGKSK-QWHCGFSZSA-N 2 2 321.377 2.025 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000377394608 227189497 /nfs/dbraw/zinc/18/94/97/227189497.db2.gz YDGLKRLAEBMTOG-GHMZBOCLSA-N 2 2 314.788 2.138 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000377394608 227189503 /nfs/dbraw/zinc/18/95/03/227189503.db2.gz YDGLKRLAEBMTOG-GHMZBOCLSA-N 2 2 314.788 2.138 20 10 DECDLP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000180031642 524394801 /nfs/dbraw/zinc/39/48/01/524394801.db2.gz SRPRUPUFYCDIFI-INIZCTEOSA-N 2 2 304.434 2.245 20 10 DECDLP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000180031642 524394810 /nfs/dbraw/zinc/39/48/10/524394810.db2.gz SRPRUPUFYCDIFI-INIZCTEOSA-N 2 2 304.434 2.245 20 10 DECDLP C[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCCC1)c1ccc(F)c(F)c1O ZINC000191216699 525474609 /nfs/dbraw/zinc/47/46/09/525474609.db2.gz HRJSESHVOSUKRJ-VXGBXAGGSA-N 2 2 314.376 2.168 20 10 DECDLP COc1c(O)c(C[NH2+]CC2([NH3+])CCCCCC2)ccc1[N+](=O)[O-] ZINC000841042490 650412865 /nfs/dbraw/zinc/41/28/65/650412865.db2.gz IRLGAZHVAUILQZ-UHFFFAOYSA-N 2 2 323.393 2.450 20 10 DECDLP [NH3+][C@H](C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000841050632 650414994 /nfs/dbraw/zinc/41/49/94/650414994.db2.gz JMKYJHRPGCFXMU-OAHLLOKOSA-N 2 2 318.421 2.412 20 10 DECDLP COc1ccc(N2CCC[N@H+](CCn3cc[nH+]c3C)CC2)cc1 ZINC000762377704 640421095 /nfs/dbraw/zinc/42/10/95/640421095.db2.gz MWEKDDADXFWHNT-UHFFFAOYSA-N 2 2 314.433 2.412 20 10 DECDLP COc1ccc(N2CCC[N@@H+](CCn3cc[nH+]c3C)CC2)cc1 ZINC000762377704 640421098 /nfs/dbraw/zinc/42/10/98/640421098.db2.gz MWEKDDADXFWHNT-UHFFFAOYSA-N 2 2 314.433 2.412 20 10 DECDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360082 641895744 /nfs/dbraw/zinc/89/57/44/641895744.db2.gz RGQZHFJKLNTEOC-XPTSAGLGSA-N 2 2 319.232 2.416 20 10 DECDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360082 641895752 /nfs/dbraw/zinc/89/57/52/641895752.db2.gz RGQZHFJKLNTEOC-XPTSAGLGSA-N 2 2 319.232 2.416 20 10 DECDLP Cc1cc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)no1 ZINC000775653465 642073125 /nfs/dbraw/zinc/07/31/25/642073125.db2.gz HAQWFMNYDRKHAX-UHFFFAOYSA-N 2 2 314.433 2.367 20 10 DECDLP Cc1cc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)no1 ZINC000775653465 642073130 /nfs/dbraw/zinc/07/31/30/642073130.db2.gz HAQWFMNYDRKHAX-UHFFFAOYSA-N 2 2 314.433 2.367 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000903918340 643507031 /nfs/dbraw/zinc/50/70/31/643507031.db2.gz XAUJFYIUMUZMIG-HXUWFJFHSA-N 3 2 324.472 2.188 20 10 DECDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC000817938606 647387860 /nfs/dbraw/zinc/38/78/60/647387860.db2.gz OGCZGXSYPSYHSS-KSSFIOAISA-N 3 2 304.482 2.072 20 10 DECDLP Oc1cccc2c1[C@H](Nc1ccc(N3CC[NH2+]CC3)c[nH+]1)CC2 ZINC000817951373 647391891 /nfs/dbraw/zinc/39/18/91/647391891.db2.gz DWLBVNXYLVOQNB-OAHLLOKOSA-N 2 2 310.401 2.296 20 10 DECDLP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Br)cc(F)c1O ZINC000817977848 647399034 /nfs/dbraw/zinc/39/90/34/647399034.db2.gz QOYWWTRUBYFACA-IGYIBNOWSA-N 2 2 315.186 2.162 20 10 DECDLP CC(C)(C)[N@@H+]1CC[C@H]1C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000850341741 651904141 /nfs/dbraw/zinc/90/41/41/651904141.db2.gz AEKMCVYREHZXGN-SFHVURJKSA-N 2 2 317.477 2.486 20 10 DECDLP CC(C)(C)[N@H+]1CC[C@H]1C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000850341741 651904143 /nfs/dbraw/zinc/90/41/43/651904143.db2.gz AEKMCVYREHZXGN-SFHVURJKSA-N 2 2 317.477 2.486 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+][C@H]2CC[N@H+](CC(C)(C)O)C2)cc1 ZINC000865659335 687292851 /nfs/dbraw/zinc/29/28/51/687292851.db2.gz HNTKFVFSBLNVDR-RTRPANQVSA-N 2 2 317.477 2.201 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+][C@H]2CC[N@@H+](CC(C)(C)O)C2)cc1 ZINC000865659335 687292857 /nfs/dbraw/zinc/29/28/57/687292857.db2.gz HNTKFVFSBLNVDR-RTRPANQVSA-N 2 2 317.477 2.201 20 10 DECDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876930312 689975372 /nfs/dbraw/zinc/97/53/72/689975372.db2.gz VGZICNQPEVNJBR-HNNXBMFYSA-N 2 2 314.433 2.023 20 10 DECDLP C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883165931 691445677 /nfs/dbraw/zinc/44/56/77/691445677.db2.gz PAXDIRLVHXRZRX-LBPRGKRZSA-N 2 2 315.408 2.032 20 10 DECDLP Oc1cccc2c1[C@@H]([NH2+][C@H]1C[NH2+]CC3(CCOCC3)C1)CC2 ZINC000925796122 693343855 /nfs/dbraw/zinc/34/38/55/693343855.db2.gz KSPOMKKTLAEJSC-CABCVRRESA-N 2 2 302.418 2.128 20 10 DECDLP [NH3+][C@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@H]1F ZINC001206172779 793473338 /nfs/dbraw/zinc/47/33/38/793473338.db2.gz BZFAFEYKTKMEPM-NEPJUHHUSA-N 2 2 317.202 2.416 20 10 DECDLP [NH3+][C@H]1CC[N@@H+](Cc2c(O)cccc2Br)CC[C@H]1F ZINC001206172779 793473342 /nfs/dbraw/zinc/47/33/42/793473342.db2.gz BZFAFEYKTKMEPM-NEPJUHHUSA-N 2 2 317.202 2.416 20 10 DECDLP CC(C)C[C@](C)(C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001575530763 1066335123 /nfs/dbraw/zinc/33/51/23/1066335123.db2.gz FROCGCWBFMMCGD-LJQANCHMSA-N 3 2 318.509 2.292 20 10 DECDLP CC(C)N(C)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001620761837 1069177338 /nfs/dbraw/zinc/17/73/38/1069177338.db2.gz UVDGBNWJQADDTG-UHFFFAOYSA-N 2 2 322.472 2.007 20 10 DECDLP CC(C)[N@H+](C)CCNCc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001620761837 1069177343 /nfs/dbraw/zinc/17/73/43/1069177343.db2.gz UVDGBNWJQADDTG-UHFFFAOYSA-N 2 2 322.472 2.007 20 10 DECDLP CC(C)[N@@H+](C)CCNCc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001620761837 1069177347 /nfs/dbraw/zinc/17/73/47/1069177347.db2.gz UVDGBNWJQADDTG-UHFFFAOYSA-N 2 2 322.472 2.007 20 10 DECDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275271560 1091646566 /nfs/dbraw/zinc/64/65/66/1091646566.db2.gz NZXULGIAYVFEBU-UHFFFAOYSA-N 2 2 323.868 2.115 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cc(OC)c(OC)cc1O ZINC001236753301 1138409177 /nfs/dbraw/zinc/40/91/77/1138409177.db2.gz KNOIFCPFGJQDGV-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cc(OC)c(OC)cc1O ZINC001236753301 1138409203 /nfs/dbraw/zinc/40/92/03/1138409203.db2.gz KNOIFCPFGJQDGV-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccco3)cc2F)CC1 ZINC001338750567 1142875781 /nfs/dbraw/zinc/87/57/81/1142875781.db2.gz FZLSLCZRTWNZPI-UHFFFAOYSA-N 2 2 303.381 2.460 20 10 DECDLP Oc1ccccc1C[N@H+](CCn1cc[nH+]c1)C[C@H]1CCCO1 ZINC000123510491 402131455 /nfs/dbraw/zinc/13/14/55/402131455.db2.gz DWNUEXNLURBWFZ-MRXNPFEDSA-N 2 2 301.390 2.270 20 10 DECDLP Oc1ccccc1C[N@@H+](CCn1cc[nH+]c1)C[C@H]1CCCO1 ZINC000123510491 402131456 /nfs/dbraw/zinc/13/14/56/402131456.db2.gz DWNUEXNLURBWFZ-MRXNPFEDSA-N 2 2 301.390 2.270 20 10 DECDLP COc1c(O)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1[N+](=O)[O-] ZINC000295091699 403756818 /nfs/dbraw/zinc/75/68/18/403756818.db2.gz TYAMJBOAUDEKCH-YHWZYXNKSA-N 2 2 321.377 2.024 20 10 DECDLP COc1c(O)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1[N+](=O)[O-] ZINC000295091699 403756824 /nfs/dbraw/zinc/75/68/24/403756824.db2.gz TYAMJBOAUDEKCH-YHWZYXNKSA-N 2 2 321.377 2.024 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844591 649853647 /nfs/dbraw/zinc/85/36/47/649853647.db2.gz RPXLFZVIUJSQNY-CRAIPNDOSA-N 2 2 305.466 2.250 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+]1CCCO)c1ccc(N(C)C)cc1 ZINC000834844591 649853648 /nfs/dbraw/zinc/85/36/48/649853648.db2.gz RPXLFZVIUJSQNY-CRAIPNDOSA-N 2 2 305.466 2.250 20 10 DECDLP C[NH+](C)C[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000228726549 225208834 /nfs/dbraw/zinc/20/88/34/225208834.db2.gz OKADLWPXICXZBH-CYBMUJFWSA-N 2 2 307.221 2.101 20 10 DECDLP COc1ccc(O)c(C[NH+]2CCN(C3=[NH+]C[C@@H](C)S3)CC2)c1 ZINC000180448109 524740777 /nfs/dbraw/zinc/74/07/77/524740777.db2.gz DBFZAOOSFKCVHH-GFCCVEGCSA-N 2 2 321.446 2.010 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@@H+]3CCCOCC3)CC2)cc1 ZINC000931286779 625700143 /nfs/dbraw/zinc/70/01/43/625700143.db2.gz JPOBTDBXZKQDMN-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@H+]3CCCOCC3)CC2)cc1 ZINC000931286779 625700149 /nfs/dbraw/zinc/70/01/49/625700149.db2.gz JPOBTDBXZKQDMN-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000840933987 634779989 /nfs/dbraw/zinc/77/99/89/634779989.db2.gz LJXWOJODEMQPEX-ROUUACIJSA-N 2 2 303.450 2.014 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000840933987 634779995 /nfs/dbraw/zinc/77/99/95/634779995.db2.gz LJXWOJODEMQPEX-ROUUACIJSA-N 2 2 303.450 2.014 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@@H]3C[C@@H]3C)CC2)cc1 ZINC000754131293 639392307 /nfs/dbraw/zinc/39/23/07/639392307.db2.gz VAXKKNVBLFPPTM-IRXDYDNUSA-N 2 2 317.477 2.453 20 10 DECDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000817900374 647377568 /nfs/dbraw/zinc/37/75/68/647377568.db2.gz SCHWRBDMCVWLCW-OALUTQOASA-N 2 2 315.461 2.143 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@H](O)C[N@H+](C)C2CC2)cc1F ZINC000819041056 647570435 /nfs/dbraw/zinc/57/04/35/647570435.db2.gz DQIXGIGADPKDQU-INIZCTEOSA-N 2 2 323.456 2.217 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@H](O)C[N@@H+](C)C2CC2)cc1F ZINC000819041056 647570436 /nfs/dbraw/zinc/57/04/36/647570436.db2.gz DQIXGIGADPKDQU-INIZCTEOSA-N 2 2 323.456 2.217 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2c(O)cc(O)cc2O)C1 ZINC001144515993 790944088 /nfs/dbraw/zinc/94/40/88/790944088.db2.gz MBZOOZUVUMSMDM-ZDUSSCGKSA-N 2 2 316.357 2.160 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2c(O)cc(O)cc2O)C1 ZINC001144515993 790944090 /nfs/dbraw/zinc/94/40/90/790944090.db2.gz MBZOOZUVUMSMDM-ZDUSSCGKSA-N 2 2 316.357 2.160 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH+]3CCCC3)CC2)c(OC)c1 ZINC001141031486 796621067 /nfs/dbraw/zinc/62/10/67/796621067.db2.gz GSIIWUOGHHLTSQ-UHFFFAOYSA-N 2 2 320.433 2.470 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001205725256 797953484 /nfs/dbraw/zinc/95/34/84/797953484.db2.gz FPIRKRRKEMEWMN-CQSZACIVSA-N 2 2 319.232 2.375 20 10 DECDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001205725256 797953488 /nfs/dbraw/zinc/95/34/88/797953488.db2.gz FPIRKRRKEMEWMN-CQSZACIVSA-N 2 2 319.232 2.375 20 10 DECDLP Cc1cc(N2CC[NH+](Cc3cccc(C)c3O)CC2)nc(C)[nH+]1 ZINC001231592526 801692589 /nfs/dbraw/zinc/69/25/89/801692589.db2.gz NWNONJQTMYCDQZ-UHFFFAOYSA-N 2 2 312.417 2.430 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([N@H+](C)C3CC3)CC2)cc1OC ZINC001236757581 1138411613 /nfs/dbraw/zinc/41/16/13/1138411613.db2.gz MTUYRONZVCXTBA-UHFFFAOYSA-N 2 2 320.433 2.468 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)cc1OC ZINC001236757581 1138411623 /nfs/dbraw/zinc/41/16/23/1138411623.db2.gz MTUYRONZVCXTBA-UHFFFAOYSA-N 2 2 320.433 2.468 20 10 DECDLP COc1ccc(N2CC[NH+](C3CC[NH+](C)CC3)CC2)c(C)c1 ZINC001256209942 1143836572 /nfs/dbraw/zinc/83/65/72/1143836572.db2.gz XZHXRGJLXIVQHP-UHFFFAOYSA-N 2 2 303.450 2.220 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365581 130112581 /nfs/dbraw/zinc/11/25/81/130112581.db2.gz BJFVIMUJTBWMNI-GDBMZVCRSA-N 2 2 313.445 2.442 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365581 130112583 /nfs/dbraw/zinc/11/25/83/130112583.db2.gz BJFVIMUJTBWMNI-GDBMZVCRSA-N 2 2 313.445 2.442 20 10 DECDLP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000119606776 401961203 /nfs/dbraw/zinc/96/12/03/401961203.db2.gz DTGXAKLNRPULAE-AWEZNQCLSA-N 2 2 323.868 2.257 20 10 DECDLP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000119606776 401961209 /nfs/dbraw/zinc/96/12/09/401961209.db2.gz DTGXAKLNRPULAE-AWEZNQCLSA-N 2 2 323.868 2.257 20 10 DECDLP C[NH+](C)C[C@](C)(O)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000269761584 403164198 /nfs/dbraw/zinc/16/41/98/403164198.db2.gz BOIREPSTPHQWRJ-GOSISDBHSA-N 2 2 305.466 2.079 20 10 DECDLP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285977123 288077895 /nfs/dbraw/zinc/07/78/95/288077895.db2.gz HMARHLMJRZXVTI-CJNGLKHVSA-N 2 2 309.429 2.208 20 10 DECDLP C[C@H]1C[NH+]=C(N2CC[NH+](Cc3cc(F)ccc3O)CC2)S1 ZINC000180199493 524687406 /nfs/dbraw/zinc/68/74/06/524687406.db2.gz KQBBFGPQNDFSQJ-NSHDSACASA-N 2 2 309.410 2.140 20 10 DECDLP C[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCCC1)c1ccc(F)c(F)c1O ZINC000191216681 525382042 /nfs/dbraw/zinc/38/20/42/525382042.db2.gz HRJSESHVOSUKRJ-NWDGAFQWSA-N 2 2 314.376 2.168 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000840933988 634780435 /nfs/dbraw/zinc/78/04/35/634780435.db2.gz LJXWOJODEMQPEX-ZWKOTPCHSA-N 2 2 303.450 2.014 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000840933988 634780438 /nfs/dbraw/zinc/78/04/38/634780438.db2.gz LJXWOJODEMQPEX-ZWKOTPCHSA-N 2 2 303.450 2.014 20 10 DECDLP COc1cccc(O)c1C[N@H+](CC[NH3+])CCc1ccccc1 ZINC000843121750 650900599 /nfs/dbraw/zinc/90/05/99/650900599.db2.gz KLXDJKDPUJFZNO-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP COc1cccc(O)c1C[N@@H+](CC[NH3+])CCc1ccccc1 ZINC000843121750 650900601 /nfs/dbraw/zinc/90/06/01/650900601.db2.gz KLXDJKDPUJFZNO-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000841091331 645220992 /nfs/dbraw/zinc/22/09/92/645220992.db2.gz VGHSTAUMLVGNRN-LBPRGKRZSA-N 2 2 321.377 2.073 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1 ZINC000817887871 647371988 /nfs/dbraw/zinc/37/19/88/647371988.db2.gz GHHKISRPEPCCOZ-RBUKOAKNSA-N 2 2 317.477 2.389 20 10 DECDLP C[C@@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000817898396 647375906 /nfs/dbraw/zinc/37/59/06/647375906.db2.gz HNBPQJZEQJMKAW-DOTOQJQBSA-N 2 2 303.450 2.143 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCc3c2cnn3C)cc1 ZINC000817937999 647388359 /nfs/dbraw/zinc/38/83/59/647388359.db2.gz BBFWWASEMCIXRY-IRXDYDNUSA-N 2 2 313.449 2.153 20 10 DECDLP C[C@@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154258245 647958963 /nfs/dbraw/zinc/95/89/63/647958963.db2.gz SULZHLAIXFAUJJ-ZBFHGGJFSA-N 2 2 323.456 2.389 20 10 DECDLP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1O ZINC000850554954 651952829 /nfs/dbraw/zinc/95/28/29/651952829.db2.gz FTCUWMICSSTDJI-DZGCQCFKSA-N 2 2 320.433 2.305 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC[NH2+]C23CCC3)c1 ZINC000863541236 686518391 /nfs/dbraw/zinc/51/83/91/686518391.db2.gz HPOMYOHJHQIZCN-IAQYHMDHSA-N 2 2 304.390 2.114 20 10 DECDLP CCC1([NH+](C)C)CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000872668319 689061414 /nfs/dbraw/zinc/06/14/14/689061414.db2.gz BXSFBPLYTHNGFO-UHFFFAOYSA-N 2 2 306.406 2.427 20 10 DECDLP COCCC1([NH2+]Cc2c(O)ccc(Cl)c2F)CC[NH2+]CC1 ZINC000873224441 689188126 /nfs/dbraw/zinc/18/81/26/689188126.db2.gz BOPILYFYMSUADQ-UHFFFAOYSA-N 2 2 316.804 2.433 20 10 DECDLP COc1cc(C[N@@H+]2CCCC(=O)[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253351 796348825 /nfs/dbraw/zinc/34/88/25/796348825.db2.gz RWOPHTOXMIIMAD-CYBMUJFWSA-N 2 2 320.433 2.263 20 10 DECDLP COc1cc(C[N@H+]2CCCC(=O)[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253351 796348831 /nfs/dbraw/zinc/34/88/31/796348831.db2.gz RWOPHTOXMIIMAD-CYBMUJFWSA-N 2 2 320.433 2.263 20 10 DECDLP COc1cc(C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)c(O)c(OC)c1 ZINC001222259555 802663778 /nfs/dbraw/zinc/66/37/78/802663778.db2.gz SSLKLJBLWLBPBU-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(C[N@H+]2CCC[C@@]23CCC[NH2+]C3)c(O)c(OC)c1 ZINC001222259555 802663782 /nfs/dbraw/zinc/66/37/82/802663782.db2.gz SSLKLJBLWLBPBU-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222537820 802703450 /nfs/dbraw/zinc/70/34/50/802703450.db2.gz GONZRGYSXIZBQB-UHFFFAOYSA-N 2 2 320.364 2.070 20 10 DECDLP COCCC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[NH2+]C1 ZINC001235806757 1084533188 /nfs/dbraw/zinc/53/31/88/1084533188.db2.gz LFMWDURUBQXIEA-SFHVURJKSA-N 2 2 305.466 2.343 20 10 DECDLP COCCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[NH2+]C1 ZINC001235806757 1084533198 /nfs/dbraw/zinc/53/31/98/1084533198.db2.gz LFMWDURUBQXIEA-SFHVURJKSA-N 2 2 305.466 2.343 20 10 DECDLP [NH3+][C@@]12CC[C@@H]1C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995130 1084585352 /nfs/dbraw/zinc/58/53/52/1084585352.db2.gz VGHIOWAPFZPHMH-ZWNOBZJWSA-N 2 2 302.296 2.214 20 10 DECDLP [NH3+][C@@]12CC[C@@H]1C[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995130 1084585362 /nfs/dbraw/zinc/58/53/62/1084585362.db2.gz VGHIOWAPFZPHMH-ZWNOBZJWSA-N 2 2 302.296 2.214 20 10 DECDLP COc1cc(C[NH+]2CCC([NH+]3CCC3)CC2)c(O)c(OC)c1 ZINC001237684262 1138757039 /nfs/dbraw/zinc/75/70/39/1138757039.db2.gz PNTYLJNSXQDEEN-UHFFFAOYSA-N 2 2 306.406 2.080 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC(C)(C)C3)cc2F)CC1 ZINC001253989186 1143019809 /nfs/dbraw/zinc/01/98/09/1143019809.db2.gz GPQZAJVRWJATNS-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC(C)(C)C3)cc2F)CC1 ZINC001253989186 1143019812 /nfs/dbraw/zinc/01/98/12/1143019812.db2.gz GPQZAJVRWJATNS-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[N@@H+]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001254510810 1143163875 /nfs/dbraw/zinc/16/38/75/1143163875.db2.gz YCSJIKIUHLYWQZ-KRWDZBQOSA-N 3 2 317.477 2.431 20 10 DECDLP C[N@H+]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001254510810 1143163909 /nfs/dbraw/zinc/16/39/09/1143163909.db2.gz YCSJIKIUHLYWQZ-KRWDZBQOSA-N 3 2 317.477 2.431 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)c1 ZINC000273362491 130110650 /nfs/dbraw/zinc/11/06/50/130110650.db2.gz DFAJSNYTFDHCNP-GFCCVEGCSA-N 2 2 308.422 2.417 20 10 DECDLP COc1c(O)c(C[NH+]2CCC([NH2+]C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000278153686 402860468 /nfs/dbraw/zinc/86/04/68/402860468.db2.gz COHAFDOCFGIZQD-UHFFFAOYSA-N 2 2 323.393 2.271 20 10 DECDLP COc1c(O)c(C[NH2+]CCc2cc[nH+]cc2C)ccc1[N+](=O)[O-] ZINC000278500607 402866846 /nfs/dbraw/zinc/86/68/46/402866846.db2.gz NUZCQXFKJCAJIG-UHFFFAOYSA-N 2 2 317.345 2.345 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C[C@@H]1COCC[NH2+]1 ZINC000423081112 230341874 /nfs/dbraw/zinc/34/18/74/230341874.db2.gz BEVUFYIZVBBYSF-DZGCQCFKSA-N 2 2 301.434 2.343 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH2+]C(C)C)CC2)cc1OC ZINC000179965014 522771883 /nfs/dbraw/zinc/77/18/83/522771883.db2.gz ZOOKCAPRIAGEAF-UHFFFAOYSA-N 2 2 308.422 2.372 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000841042964 650412473 /nfs/dbraw/zinc/41/24/73/650412473.db2.gz NEZROIPKSNQMLF-SFHVURJKSA-N 2 2 311.429 2.477 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000756553943 639673529 /nfs/dbraw/zinc/67/35/29/639673529.db2.gz NKRJXFKUTGVDJR-CHWSQXEVSA-N 2 2 306.406 2.171 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)c1 ZINC000756553943 639673530 /nfs/dbraw/zinc/67/35/30/639673530.db2.gz NKRJXFKUTGVDJR-CHWSQXEVSA-N 2 2 306.406 2.171 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@@H]2COCC[NH2+]2)cc1 ZINC000817890141 647371754 /nfs/dbraw/zinc/37/17/54/647371754.db2.gz XEHLZKCHVVMFKU-NVXWUHKLSA-N 2 2 305.466 2.389 20 10 DECDLP C[C@@H]([NH2+][C@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000863545159 686519055 /nfs/dbraw/zinc/51/90/55/686519055.db2.gz JQBBTHAQHFYOGM-FMKPAKJESA-N 2 2 321.440 2.453 20 10 DECDLP C[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)CN1CC[NH+](C)CC1 ZINC000886522269 692100805 /nfs/dbraw/zinc/10/08/05/692100805.db2.gz GFFSPFVFDLDVMX-KGLIPLIRSA-N 2 2 309.429 2.065 20 10 DECDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1)c1cc(F)ccc1O ZINC000925793980 693343176 /nfs/dbraw/zinc/34/31/76/693343176.db2.gz SXIWVZIECGNURJ-JSGCOSHPSA-N 2 2 308.397 2.341 20 10 DECDLP CN(C)c1ccc(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)c(O)c1 ZINC001232838947 801970064 /nfs/dbraw/zinc/97/00/64/801970064.db2.gz OJKYSQAMSWWIEB-UHFFFAOYSA-N 2 2 315.461 2.376 20 10 DECDLP CN(C)c1ccc(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)c(O)c1 ZINC001232838947 801970066 /nfs/dbraw/zinc/97/00/66/801970066.db2.gz OJKYSQAMSWWIEB-UHFFFAOYSA-N 2 2 315.461 2.376 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C[NH2+]C)cc2)CC1 ZINC001236416534 1138360167 /nfs/dbraw/zinc/36/01/67/1138360167.db2.gz FSRASLUMRMPCJO-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3C[NH2+]C)cc2)CC1 ZINC001236416534 1138360171 /nfs/dbraw/zinc/36/01/71/1138360171.db2.gz FSRASLUMRMPCJO-LJQANCHMSA-N 3 2 316.493 2.012 20 10 DECDLP CC[C@@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943056 1138462078 /nfs/dbraw/zinc/46/20/78/1138462078.db2.gz PIBRHCVRUZJEAP-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943056 1138462086 /nfs/dbraw/zinc/46/20/86/1138462086.db2.gz PIBRHCVRUZJEAP-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001337010342 1142656170 /nfs/dbraw/zinc/65/61/70/1142656170.db2.gz RLYPLRSUOZCDDV-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001337010342 1142656185 /nfs/dbraw/zinc/65/61/85/1142656185.db2.gz RLYPLRSUOZCDDV-INIZCTEOSA-N 2 2 321.440 2.188 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000273442932 130122908 /nfs/dbraw/zinc/12/29/08/130122908.db2.gz ZCLWYCVCDMGZHI-LBPRGKRZSA-N 2 2 318.417 2.456 20 10 DECDLP Oc1cccc(Cl)c1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC000119528356 401956617 /nfs/dbraw/zinc/95/66/17/401956617.db2.gz DGQUOFDNMWXWSZ-UHFFFAOYSA-N 2 2 323.868 2.259 20 10 DECDLP Cn1c[nH+]cc1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000177064755 402366206 /nfs/dbraw/zinc/36/62/06/402366206.db2.gz LGIQFLLYWXKDFA-MRXNPFEDSA-N 2 2 301.390 2.307 20 10 DECDLP Cn1c[nH+]cc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000177064755 402366207 /nfs/dbraw/zinc/36/62/07/402366207.db2.gz LGIQFLLYWXKDFA-MRXNPFEDSA-N 2 2 301.390 2.307 20 10 DECDLP CN(C)c1ccc(C[N@H+](C[C@H](O)C[NH+](C)C2CC2)C2CC2)cc1 ZINC000289718065 403995332 /nfs/dbraw/zinc/99/53/32/403995332.db2.gz GRLSRINRMWZDHM-LJQANCHMSA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C[C@H](O)C[NH+](C)C2CC2)C2CC2)cc1 ZINC000289718065 403995335 /nfs/dbraw/zinc/99/53/35/403995335.db2.gz GRLSRINRMWZDHM-LJQANCHMSA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[NH+](C[C@H](O)C[N@H+](C)C2CC2)C2CC2)cc1 ZINC000289718065 403995339 /nfs/dbraw/zinc/99/53/39/403995339.db2.gz GRLSRINRMWZDHM-LJQANCHMSA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[NH+](C[C@H](O)C[N@@H+](C)C2CC2)C2CC2)cc1 ZINC000289718065 403995344 /nfs/dbraw/zinc/99/53/44/403995344.db2.gz GRLSRINRMWZDHM-LJQANCHMSA-N 2 2 317.477 2.172 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1O ZINC000367588352 405094752 /nfs/dbraw/zinc/09/47/52/405094752.db2.gz LRJKQWFHWLRLMT-YCPHGPKFSA-N 2 2 308.397 2.435 20 10 DECDLP CC[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1O ZINC000367588352 405094758 /nfs/dbraw/zinc/09/47/58/405094758.db2.gz LRJKQWFHWLRLMT-YCPHGPKFSA-N 2 2 308.397 2.435 20 10 DECDLP CCO[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000922753048 636375953 /nfs/dbraw/zinc/37/59/53/636375953.db2.gz BSABYDLUBUCNTI-JTHGQSKGSA-N 2 2 305.466 2.322 20 10 DECDLP CCCC[C@@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841030287 650408942 /nfs/dbraw/zinc/40/89/42/650408942.db2.gz NDWOZNUQIKBOMK-KRWDZBQOSA-N 3 2 304.482 2.046 20 10 DECDLP COc1cc(Br)cc(C[NH2+]C[C@H]2CCC[NH2+]2)c1O ZINC000841036634 650410817 /nfs/dbraw/zinc/41/08/17/650410817.db2.gz UBHQEKPQWVMEDT-LLVKDONJSA-N 2 2 315.211 2.005 20 10 DECDLP COc1c(O)c(C[NH2+]CC2([NH3+])CCCCC2)ccc1[N+](=O)[O-] ZINC000841040150 650412077 /nfs/dbraw/zinc/41/20/77/650412077.db2.gz KJWVIBBVZXZFTC-UHFFFAOYSA-N 2 2 309.366 2.060 20 10 DECDLP CC(C)n1cc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841043850 650412803 /nfs/dbraw/zinc/41/28/03/650412803.db2.gz QNOOLFNLUDSFSG-KRWDZBQOSA-N 2 2 301.438 2.320 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@@H+]1C ZINC000898447178 641665136 /nfs/dbraw/zinc/66/51/36/641665136.db2.gz GJHJVUHGEAEERR-AYBZRNKSSA-N 2 2 318.509 2.428 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@H+]1C ZINC000898447178 641665138 /nfs/dbraw/zinc/66/51/38/641665138.db2.gz GJHJVUHGEAEERR-AYBZRNKSSA-N 2 2 318.509 2.428 20 10 DECDLP COc1ccc(O)c(C[NH2+]Cc2ncc(C[NH+](C)C)s2)c1 ZINC000796306864 644715666 /nfs/dbraw/zinc/71/56/66/644715666.db2.gz FSRVZZARCYKQOL-UHFFFAOYSA-N 2 2 307.419 2.209 20 10 DECDLP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817892835 647374089 /nfs/dbraw/zinc/37/40/89/647374089.db2.gz WERZZUVMYDRIFX-HDMKZQKVSA-N 2 2 303.450 2.314 20 10 DECDLP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892839 647374125 /nfs/dbraw/zinc/37/41/25/647374125.db2.gz WERZZUVMYDRIFX-MPGHIAIKSA-N 2 2 303.450 2.314 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)c1 ZINC000817983098 647399814 /nfs/dbraw/zinc/39/98/14/647399814.db2.gz YAVCWYLYSYCOMX-IAQYHMDHSA-N 2 2 306.406 2.347 20 10 DECDLP Oc1ccc(Cl)cc1C[NH+]1CCC([N@@H+]2CC[C@@H](O)C2)CC1 ZINC000827701024 649071253 /nfs/dbraw/zinc/07/12/53/649071253.db2.gz ZMKYOKGYURGEEU-OAHLLOKOSA-N 2 2 310.825 2.077 20 10 DECDLP Oc1ccc(Cl)cc1C[NH+]1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000827701024 649071256 /nfs/dbraw/zinc/07/12/56/649071256.db2.gz ZMKYOKGYURGEEU-OAHLLOKOSA-N 2 2 310.825 2.077 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1O ZINC000846225986 651316778 /nfs/dbraw/zinc/31/67/78/651316778.db2.gz STFPOTNIEWKUKZ-GUYCJALGSA-N 2 2 306.381 2.295 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1O ZINC000846225986 651316780 /nfs/dbraw/zinc/31/67/80/651316780.db2.gz STFPOTNIEWKUKZ-GUYCJALGSA-N 2 2 306.381 2.295 20 10 DECDLP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000848911584 651557946 /nfs/dbraw/zinc/55/79/46/651557946.db2.gz HGLFTBCLLFPENQ-ZFWWWQNUSA-N 2 2 320.433 2.305 20 10 DECDLP Cc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930729 651565419 /nfs/dbraw/zinc/56/54/19/651565419.db2.gz VTMDTPILDAOVPT-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930729 651565423 /nfs/dbraw/zinc/56/54/23/651565423.db2.gz VTMDTPILDAOVPT-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP CC(C)(C)[N@@H+]1CC[C@@H]1C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000850341738 651903978 /nfs/dbraw/zinc/90/39/78/651903978.db2.gz AEKMCVYREHZXGN-GOSISDBHSA-N 2 2 317.477 2.486 20 10 DECDLP CC(C)(C)[N@H+]1CC[C@@H]1C[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000850341738 651903980 /nfs/dbraw/zinc/90/39/80/651903980.db2.gz AEKMCVYREHZXGN-GOSISDBHSA-N 2 2 317.477 2.486 20 10 DECDLP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@H]3CCOC3)CC1)CC2 ZINC000850554763 651952662 /nfs/dbraw/zinc/95/26/62/651952662.db2.gz FQLJXMDBOKHDAZ-JKSUJKDBSA-N 2 2 302.418 2.222 20 10 DECDLP COc1cccc([C@@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1O ZINC000850554955 651952939 /nfs/dbraw/zinc/95/29/39/651952939.db2.gz FTCUWMICSSTDJI-HIFRSBDPSA-N 2 2 320.433 2.305 20 10 DECDLP CCN(Cc1ccccc1O)c1ccc(N2CC[NH2+]CC2)c[nH+]1 ZINC001154888981 797634248 /nfs/dbraw/zinc/63/42/48/797634248.db2.gz NBMPVDOBDOAATK-UHFFFAOYSA-N 2 2 312.417 2.223 20 10 DECDLP CN1CCOc2cc(C[N@@H+]3CCCC[C@](F)(C[NH3+])C3)ccc21 ZINC001206352054 800514952 /nfs/dbraw/zinc/51/49/52/800514952.db2.gz MWGPOXJVURDFKP-KRWDZBQOSA-N 2 2 307.413 2.168 20 10 DECDLP CN1CCOc2cc(C[N@H+]3CCCC[C@](F)(C[NH3+])C3)ccc21 ZINC001206352054 800514955 /nfs/dbraw/zinc/51/49/55/800514955.db2.gz MWGPOXJVURDFKP-KRWDZBQOSA-N 2 2 307.413 2.168 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2cc(O)c(O)cc2O)C1 ZINC001233487723 802128597 /nfs/dbraw/zinc/12/85/97/802128597.db2.gz PPZWUSCZPCNJQJ-CYBMUJFWSA-N 2 2 316.357 2.160 20 10 DECDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2cc(O)c(O)cc2O)C1 ZINC001233487723 802128601 /nfs/dbraw/zinc/12/86/01/802128601.db2.gz PPZWUSCZPCNJQJ-CYBMUJFWSA-N 2 2 316.357 2.160 20 10 DECDLP Cn1c[nH+]cc1CC[NH2+]Cc1c(O)cccc1Br ZINC000706857809 1086652604 /nfs/dbraw/zinc/65/26/04/1086652604.db2.gz GNSAIPLNQVHJGY-UHFFFAOYSA-N 2 2 310.195 2.221 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@H+](C)CCCO)CC2)cc1 ZINC000093394574 193243194 /nfs/dbraw/zinc/24/31/94/193243194.db2.gz MKWNUUZEVZXZTE-UHFFFAOYSA-N 2 2 305.466 2.031 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@@H+](C)CCCO)CC2)cc1 ZINC000093394574 193243196 /nfs/dbraw/zinc/24/31/96/193243196.db2.gz MKWNUUZEVZXZTE-UHFFFAOYSA-N 2 2 305.466 2.031 20 10 DECDLP CCCOc1ccc(C[NH+]2CCC([N@H+](C)CCO)CC2)c(O)c1 ZINC000271159264 403270841 /nfs/dbraw/zinc/27/08/41/403270841.db2.gz JGIVVFDLARSNHR-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP CCCOc1ccc(C[NH+]2CCC([N@@H+](C)CCO)CC2)c(O)c1 ZINC000271159264 403270842 /nfs/dbraw/zinc/27/08/42/403270842.db2.gz JGIVVFDLARSNHR-UHFFFAOYSA-N 2 2 322.449 2.070 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)cc1 ZINC000835037273 649869992 /nfs/dbraw/zinc/86/99/92/649869992.db2.gz IZNOSXCIMSYNCQ-QFJXVRIMSA-N 2 2 315.461 2.219 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1 ZINC000835037273 649869994 /nfs/dbraw/zinc/86/99/94/649869994.db2.gz IZNOSXCIMSYNCQ-QFJXVRIMSA-N 2 2 315.461 2.219 20 10 DECDLP CC(=O)c1cc(F)cc(C[NH2+][C@H]2CC[NH2+]C23CCCC3)c1O ZINC000903485319 643363319 /nfs/dbraw/zinc/36/33/19/643363319.db2.gz MBHMPQSBUOZITH-HNNXBMFYSA-N 2 2 306.381 2.498 20 10 DECDLP CCOc1ccc(O)c(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)c1 ZINC000903973198 643530947 /nfs/dbraw/zinc/53/09/47/643530947.db2.gz BCSMLDZVFJXXJJ-OAHLLOKOSA-N 2 2 320.433 2.039 20 10 DECDLP Cc1cc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)n(C)n1 ZINC000817942411 647388666 /nfs/dbraw/zinc/38/86/66/647388666.db2.gz ORKXIQFCNHBQTR-CZUORRHYSA-N 2 2 301.438 2.145 20 10 DECDLP CCn1cc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000817944194 647389530 /nfs/dbraw/zinc/38/95/30/647389530.db2.gz YAPIECQDNLGXES-CXAGYDPISA-N 2 2 301.438 2.320 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925479449 648221019 /nfs/dbraw/zinc/22/10/19/648221019.db2.gz ZRKWJQQJARMANA-YOEHRIQHSA-N 2 2 305.491 2.470 20 10 DECDLP COc1ccc(N2CC[NH+](CCCc3c[nH+]cn3C)CC2)cc1 ZINC000846762696 651349837 /nfs/dbraw/zinc/34/98/37/651349837.db2.gz JCQNGNUJUHLMGQ-UHFFFAOYSA-N 2 2 314.433 2.184 20 10 DECDLP Nc1cc[nH+]c2c1C[N@H+](Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000931516030 694417879 /nfs/dbraw/zinc/41/78/79/694417879.db2.gz GNJXDAGENQIBFF-UHFFFAOYSA-N 2 2 324.428 2.059 20 10 DECDLP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1c(O)cccc1F ZINC000886522270 692100711 /nfs/dbraw/zinc/10/07/11/692100711.db2.gz GFFSPFVFDLDVMX-UONOGXRCSA-N 2 2 309.429 2.065 20 10 DECDLP CC(C)C[N@@H+]1CCO[C@@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001177061740 794571712 /nfs/dbraw/zinc/57/17/12/794571712.db2.gz SYGPIUZXZBAIAQ-INIZCTEOSA-N 2 2 323.456 2.338 20 10 DECDLP CC(C)C[N@H+]1CCO[C@@H](C[NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC001177061740 794571718 /nfs/dbraw/zinc/57/17/18/794571718.db2.gz SYGPIUZXZBAIAQ-INIZCTEOSA-N 2 2 323.456 2.338 20 10 DECDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500284 796228389 /nfs/dbraw/zinc/22/83/89/796228389.db2.gz WBKJXZDQOBQYPH-PKOBYXMFSA-N 2 2 315.461 2.049 20 10 DECDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500284 796228395 /nfs/dbraw/zinc/22/83/95/796228395.db2.gz WBKJXZDQOBQYPH-PKOBYXMFSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500284 796228400 /nfs/dbraw/zinc/22/84/00/796228400.db2.gz WBKJXZDQOBQYPH-PKOBYXMFSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC001138500284 796228404 /nfs/dbraw/zinc/22/84/04/796228404.db2.gz WBKJXZDQOBQYPH-PKOBYXMFSA-N 2 2 315.461 2.049 20 10 DECDLP CC[C@H]1COCC[N@@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258241 796350513 /nfs/dbraw/zinc/35/05/13/796350513.db2.gz NLWYKTDQVYCCFT-HNNXBMFYSA-N 2 2 308.422 2.073 20 10 DECDLP CC[C@H]1COCC[N@H+]1Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139258241 796350515 /nfs/dbraw/zinc/35/05/15/796350515.db2.gz NLWYKTDQVYCCFT-HNNXBMFYSA-N 2 2 308.422 2.073 20 10 DECDLP COc1cc(C[NH+]2CC(C(F)F)C2)cc(C[NH+](C)C)c1O ZINC001139261060 796351007 /nfs/dbraw/zinc/35/10/07/796351007.db2.gz TXJSZXVFCDGWEV-UHFFFAOYSA-N 2 2 300.349 2.159 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc2c(c1)OCCN2C ZINC001141144183 796638878 /nfs/dbraw/zinc/63/88/78/796638878.db2.gz CVSWTEHPYFQTRC-UHFFFAOYSA-N 2 2 300.406 2.234 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc2c(c1)OCCN2C ZINC001141144183 796638881 /nfs/dbraw/zinc/63/88/81/796638881.db2.gz CVSWTEHPYFQTRC-UHFFFAOYSA-N 2 2 300.406 2.234 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001205725910 800407956 /nfs/dbraw/zinc/40/79/56/800407956.db2.gz NEJKJZKBWXYXMA-AWEZNQCLSA-N 2 2 319.232 2.375 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001205725910 800407963 /nfs/dbraw/zinc/40/79/63/800407963.db2.gz NEJKJZKBWXYXMA-AWEZNQCLSA-N 2 2 319.232 2.375 20 10 DECDLP CC[N@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)c(OC)cc3O)C[C@@H]2C1 ZINC001232271257 801835077 /nfs/dbraw/zinc/83/50/77/801835077.db2.gz TWJWYTIYBVSOIK-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[N@@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)c(OC)cc3O)C[C@@H]2C1 ZINC001232271257 801835086 /nfs/dbraw/zinc/83/50/86/801835086.db2.gz TWJWYTIYBVSOIK-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@@H+](Cc3cc(Cl)c(OC)cc3O)C[C@@H]2C1 ZINC001232271257 801835094 /nfs/dbraw/zinc/83/50/94/801835094.db2.gz TWJWYTIYBVSOIK-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@H+](Cc3cc(Cl)c(OC)cc3O)C[C@@H]2C1 ZINC001232271257 801835103 /nfs/dbraw/zinc/83/51/03/801835103.db2.gz TWJWYTIYBVSOIK-BETUJISGSA-N 2 2 310.825 2.438 20 10 DECDLP C[C@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001650630237 1079765421 /nfs/dbraw/zinc/76/54/21/1079765421.db2.gz IUELDFXRLPMFBQ-KRWDZBQOSA-N 3 2 316.493 2.012 20 10 DECDLP C[C@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001650630237 1079765425 /nfs/dbraw/zinc/76/54/25/1079765425.db2.gz IUELDFXRLPMFBQ-KRWDZBQOSA-N 3 2 316.493 2.012 20 10 DECDLP COc1cc(C)c(C[NH2+]Cc2cc(N(C)C)cc[nH+]2)c(O)c1 ZINC001665672658 1081060422 /nfs/dbraw/zinc/06/04/22/1081060422.db2.gz LWRZBQOIRTZCJZ-UHFFFAOYSA-N 2 2 301.390 2.460 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@@H+]3C[C@H]4CC[C@]4([NH3+])C3)ccc2O1 ZINC001235994093 1084583876 /nfs/dbraw/zinc/58/38/76/1084583876.db2.gz NHEDQGWAQXKBIL-ACJLOTCBSA-N 2 2 300.402 2.500 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@H+]3C[C@H]4CC[C@]4([NH3+])C3)ccc2O1 ZINC001235994093 1084583880 /nfs/dbraw/zinc/58/38/80/1084583880.db2.gz NHEDQGWAQXKBIL-ACJLOTCBSA-N 2 2 300.402 2.500 20 10 DECDLP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)C1 ZINC000273303907 130104975 /nfs/dbraw/zinc/10/49/75/130104975.db2.gz CGPJAMAWEINYSQ-CHWSQXEVSA-N 2 2 306.406 2.171 20 10 DECDLP C[C@H]([NH2+]CCCn1cc[nH+]c1)c1ccc(N2CCOCC2)cc1 ZINC000151107851 402016261 /nfs/dbraw/zinc/01/62/61/402016261.db2.gz JRIGXKUQRUQFNS-INIZCTEOSA-N 2 2 314.433 2.461 20 10 DECDLP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC000367718474 405134078 /nfs/dbraw/zinc/13/40/78/405134078.db2.gz HEGNJMMMRSDSQJ-OAHLLOKOSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC000367718474 405134080 /nfs/dbraw/zinc/13/40/80/405134080.db2.gz HEGNJMMMRSDSQJ-OAHLLOKOSA-N 2 2 323.868 2.257 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540515 227013163 /nfs/dbraw/zinc/01/31/63/227013163.db2.gz YKJGEMCTLSWMEL-BMGDILEWSA-N 2 2 303.450 2.266 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540515 227013168 /nfs/dbraw/zinc/01/31/68/227013168.db2.gz YKJGEMCTLSWMEL-BMGDILEWSA-N 2 2 303.450 2.266 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C[C@H]1COCC[NH2+]1 ZINC000423081113 230343143 /nfs/dbraw/zinc/34/31/43/230343143.db2.gz BEVUFYIZVBBYSF-HIFRSBDPSA-N 2 2 301.434 2.343 20 10 DECDLP COCC[N@H+](C)CCC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000191201786 523584762 /nfs/dbraw/zinc/58/47/62/523584762.db2.gz JAWRNGJODCUQIL-LLVKDONJSA-N 2 2 302.365 2.289 20 10 DECDLP COCC[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000191201786 523584767 /nfs/dbraw/zinc/58/47/67/523584767.db2.gz JAWRNGJODCUQIL-LLVKDONJSA-N 2 2 302.365 2.289 20 10 DECDLP Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000180066432 526349725 /nfs/dbraw/zinc/34/97/25/526349725.db2.gz FDZZGDNHOHNVAH-CQSZACIVSA-N 2 2 308.397 2.076 20 10 DECDLP Oc1ccc(F)cc1C[N@H+]1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000180066432 526349729 /nfs/dbraw/zinc/34/97/29/526349729.db2.gz FDZZGDNHOHNVAH-CQSZACIVSA-N 2 2 308.397 2.076 20 10 DECDLP CCCn1cc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841043373 650412614 /nfs/dbraw/zinc/41/26/14/650412614.db2.gz OEGLVTWQYGFGQI-KRWDZBQOSA-N 2 2 301.438 2.149 20 10 DECDLP COC[C@]1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CCC[NH2+]1 ZINC000841067910 650420844 /nfs/dbraw/zinc/42/08/44/650420844.db2.gz QMCBIMPSDNJPEN-MJICGBHWSA-N 2 2 303.450 2.124 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)C[NH+]2CCCC2)c2c1c(F)ccc2O ZINC000756450848 639663808 /nfs/dbraw/zinc/66/38/08/639663808.db2.gz UAXJIDWXIJQNTC-YRGRVCCFSA-N 2 2 308.397 2.126 20 10 DECDLP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3c(O)cccc3Cl)CC2)C1 ZINC000769381513 641229898 /nfs/dbraw/zinc/22/98/98/641229898.db2.gz PDZVUMQHJJHJTR-AWEZNQCLSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3c(O)cccc3Cl)CC2)C1 ZINC000769381513 641229903 /nfs/dbraw/zinc/22/99/03/641229903.db2.gz PDZVUMQHJJHJTR-AWEZNQCLSA-N 2 2 323.868 2.257 20 10 DECDLP COc1cc(Cl)cc(C[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000779194143 642471074 /nfs/dbraw/zinc/47/10/74/642471074.db2.gz WBUPJTIFCAMBHB-LBPRGKRZSA-N 2 2 307.781 2.355 20 10 DECDLP Cc1cc(O)c(C[N@@H+]2CCc3sc(C[NH3+])nc3C2)cc1C ZINC000903940718 643522021 /nfs/dbraw/zinc/52/20/21/643522021.db2.gz CLEKJPMEEJKUHU-UHFFFAOYSA-N 2 2 303.431 2.483 20 10 DECDLP Cc1cc(O)c(C[N@H+]2CCc3sc(C[NH3+])nc3C2)cc1C ZINC000903940718 643522023 /nfs/dbraw/zinc/52/20/23/643522023.db2.gz CLEKJPMEEJKUHU-UHFFFAOYSA-N 2 2 303.431 2.483 20 10 DECDLP CN(C)c1ccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c(C(F)(F)F)c1 ZINC000792842606 644159242 /nfs/dbraw/zinc/15/92/42/644159242.db2.gz UBOXITRYDADMAU-STQMWFEESA-N 2 2 313.367 2.423 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@@H]2COCC[NH2+]2)cc1 ZINC000817890139 647372098 /nfs/dbraw/zinc/37/20/98/647372098.db2.gz XEHLZKCHVVMFKU-DOTOQJQBSA-N 2 2 305.466 2.389 20 10 DECDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)C[C@H]1COCC[NH2+]1 ZINC000817934992 647387406 /nfs/dbraw/zinc/38/74/06/647387406.db2.gz SCLVUURAFUEALC-BQFCYCMXSA-N 2 2 319.493 2.349 20 10 DECDLP Oc1cccc(Cl)c1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000850397630 651920630 /nfs/dbraw/zinc/92/06/30/651920630.db2.gz ZQRDOHPMTNXJAA-CYBMUJFWSA-N 2 2 310.825 2.389 20 10 DECDLP Cc1cccc(O)c1C[N@@H+]1CCC[C@H]([NH+]2CCOCC2)CC1 ZINC000877619858 690169712 /nfs/dbraw/zinc/16/97/12/690169712.db2.gz ARRYIIPKNKXJNI-INIZCTEOSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1cccc(O)c1C[N@H+]1CCC[C@H]([NH+]2CCOCC2)CC1 ZINC000877619858 690169717 /nfs/dbraw/zinc/16/97/17/690169717.db2.gz ARRYIIPKNKXJNI-INIZCTEOSA-N 2 2 304.434 2.387 20 10 DECDLP CC[NH+](CC)CC[C@H](CO)[NH2+]Cc1c(O)cccc1Cl ZINC000883161593 691444725 /nfs/dbraw/zinc/44/47/25/691444725.db2.gz VYXAUMXDURKSJD-GFCCVEGCSA-N 2 2 300.830 2.228 20 10 DECDLP CC(C)[C@@H](C[NH2+][C@@H](C)c1c(O)cccc1F)N1CC[NH+](C)CC1 ZINC000886500213 692094574 /nfs/dbraw/zinc/09/45/74/692094574.db2.gz LHMVSWZOSYMLMN-GOEBONIOSA-N 2 2 323.456 2.454 20 10 DECDLP COc1cc(C[N@@H+]2CCOC[C@@H]2C2CC2)cc(C[NH+](C)C)c1O ZINC001139259250 796350920 /nfs/dbraw/zinc/35/09/20/796350920.db2.gz OQQYFFJBQIWUSS-MRXNPFEDSA-N 2 2 320.433 2.073 20 10 DECDLP COc1cc(C[N@H+]2CCOC[C@@H]2C2CC2)cc(C[NH+](C)C)c1O ZINC001139259250 796350925 /nfs/dbraw/zinc/35/09/25/796350925.db2.gz OQQYFFJBQIWUSS-MRXNPFEDSA-N 2 2 320.433 2.073 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(OC)c1 ZINC001141029358 796621371 /nfs/dbraw/zinc/62/13/71/796621371.db2.gz QVKACXITYRPCBG-UHFFFAOYSA-N 2 2 317.389 2.443 20 10 DECDLP COC1CC[NH+](C2CC[NH+](Cc3cc(O)ccc3O)CC2)CC1 ZINC001141162653 796643240 /nfs/dbraw/zinc/64/32/40/796643240.db2.gz YPSUFPZTCJIDCG-UHFFFAOYSA-N 2 2 320.433 2.173 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206622542 800567148 /nfs/dbraw/zinc/56/71/48/800567148.db2.gz FIBLQMCGSHCWGP-CYBMUJFWSA-N 2 2 316.401 2.368 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206622542 800567152 /nfs/dbraw/zinc/56/71/52/800567152.db2.gz FIBLQMCGSHCWGP-CYBMUJFWSA-N 2 2 316.401 2.368 20 10 DECDLP COc1cc(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)cc1O ZINC001231637581 801701668 /nfs/dbraw/zinc/70/16/68/801701668.db2.gz NIHMKYTVTSYQGO-AWEZNQCLSA-N 2 2 316.357 2.155 20 10 DECDLP COc1cc(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)cc1O ZINC001231637581 801701674 /nfs/dbraw/zinc/70/16/74/801701674.db2.gz NIHMKYTVTSYQGO-AWEZNQCLSA-N 2 2 316.357 2.155 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)c(OC)c1 ZINC001222247617 802661257 /nfs/dbraw/zinc/66/12/57/802661257.db2.gz GOUYSSIOKAIYKD-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC[C@@]23CCC[NH2+]C3)c(OC)c1 ZINC001222247617 802661260 /nfs/dbraw/zinc/66/12/60/802661260.db2.gz GOUYSSIOKAIYKD-QGZVFWFLSA-N 2 2 306.406 2.127 20 10 DECDLP [NH3+][C@]12CC[C@H]1C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995125 1084585578 /nfs/dbraw/zinc/58/55/78/1084585578.db2.gz VGHIOWAPFZPHMH-GWCFXTLKSA-N 2 2 302.296 2.214 20 10 DECDLP [NH3+][C@]12CC[C@H]1C[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995125 1084585582 /nfs/dbraw/zinc/58/55/82/1084585582.db2.gz VGHIOWAPFZPHMH-GWCFXTLKSA-N 2 2 302.296 2.214 20 10 DECDLP C[C@@H](C[NH2+]Cc1c(O)cccc1Br)C[NH+](C)C ZINC000706863861 1086653783 /nfs/dbraw/zinc/65/37/83/1086653783.db2.gz UJEVQKVXQCDEFX-JTQLQIEISA-N 2 2 301.228 2.442 20 10 DECDLP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC[NH2+]1 ZINC001246357520 1140887504 /nfs/dbraw/zinc/88/75/04/1140887504.db2.gz AHMMEYGOYZCHHD-YOEHRIQHSA-N 3 2 303.450 2.087 20 10 DECDLP CC[NH+]1CCC([NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)CC1 ZINC000273419055 285192010 /nfs/dbraw/zinc/19/20/10/285192010.db2.gz RRTUWSBURNBYRY-GFCCVEGCSA-N 2 2 306.406 2.314 20 10 DECDLP C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)CN1CC[NH+](C)CC1 ZINC000185343857 402345186 /nfs/dbraw/zinc/34/51/86/402345186.db2.gz YJCKBEWUQORPNW-ZIAGYGMSSA-N 2 2 309.429 2.065 20 10 DECDLP C[N@H+](CCCO)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000271868797 402884846 /nfs/dbraw/zinc/88/48/46/402884846.db2.gz RTPWHZXFVKZWIN-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP C[N@@H+](CCCO)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000271868797 402884850 /nfs/dbraw/zinc/88/48/50/402884850.db2.gz RTPWHZXFVKZWIN-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP CN(C)c1ccc(/C=C\C[N@H+](CCO)C2CC[NH+](C)CC2)cc1 ZINC000835024447 649867462 /nfs/dbraw/zinc/86/74/62/649867462.db2.gz APJPCMKCUPJOEH-PLNGDYQASA-N 2 2 317.477 2.154 20 10 DECDLP CN(C)c1ccc(/C=C\C[N@@H+](CCO)C2CC[NH+](C)CC2)cc1 ZINC000835024447 649867463 /nfs/dbraw/zinc/86/74/63/649867463.db2.gz APJPCMKCUPJOEH-PLNGDYQASA-N 2 2 317.477 2.154 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1 ZINC000835037260 649869923 /nfs/dbraw/zinc/86/99/23/649869923.db2.gz IZNOSXCIMSYNCQ-BWTKPXILSA-N 2 2 315.461 2.219 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc1 ZINC000835037260 649869924 /nfs/dbraw/zinc/86/99/24/649869924.db2.gz IZNOSXCIMSYNCQ-BWTKPXILSA-N 2 2 315.461 2.219 20 10 DECDLP CC(C)n1cc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841043851 650412536 /nfs/dbraw/zinc/41/25/36/650412536.db2.gz QNOOLFNLUDSFSG-QGZVFWFLSA-N 2 2 301.438 2.320 20 10 DECDLP COc1ccc(O)c(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000841045904 641470928 /nfs/dbraw/zinc/47/09/28/641470928.db2.gz SINNIRQEYMZLFD-QGZVFWFLSA-N 2 2 315.417 2.256 20 10 DECDLP CN(C)c1ccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)cc1 ZINC000903974265 643531630 /nfs/dbraw/zinc/53/16/30/643531630.db2.gz NOOAIXGKYRWRAD-INIZCTEOSA-N 2 2 303.450 2.001 20 10 DECDLP Oc1c(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)ccc2ccccc21 ZINC000816548478 647150819 /nfs/dbraw/zinc/15/08/19/647150819.db2.gz JGEQCWVDZOVVJL-IRXDYDNUSA-N 2 2 312.413 2.498 20 10 DECDLP Oc1c(C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)ccc2ccccc21 ZINC000816548478 647150822 /nfs/dbraw/zinc/15/08/22/647150822.db2.gz JGEQCWVDZOVVJL-IRXDYDNUSA-N 2 2 312.413 2.498 20 10 DECDLP C[C@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817941540 647389006 /nfs/dbraw/zinc/38/90/06/647389006.db2.gz RJADSRIUUFLAJM-DZGCQCFKSA-N 2 2 307.413 2.065 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1CCCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817945999 647390578 /nfs/dbraw/zinc/39/05/78/647390578.db2.gz PMWUBKFVRVVQLG-HOCLYGCPSA-N 2 2 321.440 2.455 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)cc1Cl ZINC000825247186 648730871 /nfs/dbraw/zinc/73/08/71/648730871.db2.gz OEOFDJFTNWPRED-KBPBESRZSA-N 2 2 310.825 2.307 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)cc1Cl ZINC000825247186 648730873 /nfs/dbraw/zinc/73/08/73/648730873.db2.gz OEOFDJFTNWPRED-KBPBESRZSA-N 2 2 310.825 2.307 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC(CO)([NH2+]CC3CC3)CC2)cc1 ZINC000844338503 651115019 /nfs/dbraw/zinc/11/50/19/651115019.db2.gz QHLPDCYUTVJOFE-UHFFFAOYSA-N 2 2 317.477 2.079 20 10 DECDLP COc1ccc(N(C)CC[N@H+](C)CCc2c[nH+]cn2C)cc1 ZINC000844400713 651123440 /nfs/dbraw/zinc/12/34/40/651123440.db2.gz DDMJPQDQNKQVFG-UHFFFAOYSA-N 2 2 302.422 2.039 20 10 DECDLP COc1ccc(N(C)CC[N@@H+](C)CCc2c[nH+]cn2C)cc1 ZINC000844400713 651123442 /nfs/dbraw/zinc/12/34/42/651123442.db2.gz DDMJPQDQNKQVFG-UHFFFAOYSA-N 2 2 302.422 2.039 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)c1O ZINC000863650894 686540802 /nfs/dbraw/zinc/54/08/02/686540802.db2.gz DQCVJZWOGSSUTB-IYBDPMFKSA-N 2 2 310.825 2.486 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)c1O ZINC000863650894 686540812 /nfs/dbraw/zinc/54/08/12/686540812.db2.gz DQCVJZWOGSSUTB-IYBDPMFKSA-N 2 2 310.825 2.486 20 10 DECDLP CNc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c[nH+]1 ZINC001167434472 777034332 /nfs/dbraw/zinc/03/43/32/777034332.db2.gz LTIUACLOSYMZFU-UHFFFAOYSA-N 2 2 311.433 2.487 20 10 DECDLP COc1ccc(N2CC[NH+](CC(C)(C)C[NH+](C)C)CC2)cc1 ZINC001207274437 777292851 /nfs/dbraw/zinc/29/28/51/777292851.db2.gz CEWFXDZTZMJBDA-UHFFFAOYSA-N 2 2 305.466 2.405 20 10 DECDLP COc1cc(C[N@@H+]2CCOCC2(C)C)cc(C[NH+](C)C)c1O ZINC001139256436 796350400 /nfs/dbraw/zinc/35/04/00/796350400.db2.gz BDEJMRCMURPRKO-UHFFFAOYSA-N 2 2 308.422 2.073 20 10 DECDLP COc1cc(C[N@H+]2CCOCC2(C)C)cc(C[NH+](C)C)c1O ZINC001139256436 796350402 /nfs/dbraw/zinc/35/04/02/796350402.db2.gz BDEJMRCMURPRKO-UHFFFAOYSA-N 2 2 308.422 2.073 20 10 DECDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1F)C1CC[NH+](C)CC1 ZINC001140662374 796552665 /nfs/dbraw/zinc/55/26/65/796552665.db2.gz RBMPJELNMCGLRS-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1F)C1CC[NH+](C)CC1 ZINC001140662374 796552668 /nfs/dbraw/zinc/55/26/68/796552668.db2.gz RBMPJELNMCGLRS-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP Cc1cccc(C[N@@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c1O ZINC001231591954 801690730 /nfs/dbraw/zinc/69/07/30/801690730.db2.gz MVVWHLSQXUHSOU-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP Cc1cccc(C[N@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c1O ZINC001231591954 801690733 /nfs/dbraw/zinc/69/07/33/801690733.db2.gz MVVWHLSQXUHSOU-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP CCC([NH3+])(CC)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001328678908 1148823208 /nfs/dbraw/zinc/82/32/08/1148823208.db2.gz ZARWNKHIHLSGGE-UHFFFAOYSA-N 3 2 322.472 2.185 20 10 DECDLP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)CCCO1 ZINC000883103868 1093698659 /nfs/dbraw/zinc/69/86/59/1093698659.db2.gz HZFVKRCZTPWJOS-GFCCVEGCSA-N 2 2 314.376 2.261 20 10 DECDLP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)CCCO1 ZINC000883103868 1093698667 /nfs/dbraw/zinc/69/86/67/1093698667.db2.gz HZFVKRCZTPWJOS-GFCCVEGCSA-N 2 2 314.376 2.261 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](C)[N@@H+](C3CC3)C2)c1 ZINC000273551181 130135309 /nfs/dbraw/zinc/13/53/09/130135309.db2.gz FZEOJMIEUUMBNJ-SGMGOOAPSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1 ZINC000273551181 130135311 /nfs/dbraw/zinc/13/53/11/130135311.db2.gz FZEOJMIEUUMBNJ-SGMGOOAPSA-N 2 2 318.417 2.455 20 10 DECDLP Cc1nc(N2CC[NH+](Cc3c(O)cccc3Cl)CC2)cc[nH+]1 ZINC000273763359 130163216 /nfs/dbraw/zinc/16/32/16/130163216.db2.gz PNRFYKXLHVDOHQ-UHFFFAOYSA-N 2 2 318.808 2.466 20 10 DECDLP C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C[C@@H]1n1cc[nH+]c1 ZINC000121707111 402049585 /nfs/dbraw/zinc/04/95/85/402049585.db2.gz QSVCFCBOYXSXPM-OCCSQVGLSA-N 2 2 315.373 2.401 20 10 DECDLP C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@@H]1n1cc[nH+]c1 ZINC000121707111 402049587 /nfs/dbraw/zinc/04/95/87/402049587.db2.gz QSVCFCBOYXSXPM-OCCSQVGLSA-N 2 2 315.373 2.401 20 10 DECDLP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC000367718473 405134114 /nfs/dbraw/zinc/13/41/14/405134114.db2.gz HEGNJMMMRSDSQJ-HNNXBMFYSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC000367718473 405134120 /nfs/dbraw/zinc/13/41/20/405134120.db2.gz HEGNJMMMRSDSQJ-HNNXBMFYSA-N 2 2 323.868 2.257 20 10 DECDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000369684811 227037305 /nfs/dbraw/zinc/03/73/05/227037305.db2.gz XQBNLFYDSYQONW-LBPRGKRZSA-N 2 2 315.373 2.234 20 10 DECDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000369684811 227037310 /nfs/dbraw/zinc/03/73/10/227037310.db2.gz XQBNLFYDSYQONW-LBPRGKRZSA-N 2 2 315.373 2.234 20 10 DECDLP Cc1ccc(O)c(C[NH+]2CCC(C)([NH+]3CCOCC3)CC2)c1 ZINC000529665491 340767164 /nfs/dbraw/zinc/76/71/64/340767164.db2.gz YZNZMUZHEUBPNR-UHFFFAOYSA-N 2 2 304.434 2.387 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH+]3CCCC3)CC2)cc1OC ZINC000160227303 522773892 /nfs/dbraw/zinc/77/38/92/522773892.db2.gz YMTJUOYKNASFLK-UHFFFAOYSA-N 2 2 320.433 2.470 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCC[N@@H+]2CCCO)cc1 ZINC000835055814 649872897 /nfs/dbraw/zinc/87/28/97/649872897.db2.gz ZMJMRGDWKJYXTA-WSGSOLELSA-N 2 2 317.477 2.202 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCC[N@H+]2CCCO)cc1 ZINC000835055814 649872900 /nfs/dbraw/zinc/87/29/00/649872900.db2.gz ZMJMRGDWKJYXTA-WSGSOLELSA-N 2 2 317.477 2.202 20 10 DECDLP COc1cc(O)c(C[NH2+]C[C@H]([NH3+])c2ccccc2)cc1OC ZINC000841038098 650410964 /nfs/dbraw/zinc/41/09/64/650410964.db2.gz UKTDIEFLHHFPQL-AWEZNQCLSA-N 2 2 302.374 2.199 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000756609948 639679006 /nfs/dbraw/zinc/67/90/06/639679006.db2.gz GOSXHKBNZHAVEA-OBJOEFQTSA-N 2 2 306.406 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000756609948 639679010 /nfs/dbraw/zinc/67/90/10/639679010.db2.gz GOSXHKBNZHAVEA-OBJOEFQTSA-N 2 2 306.406 2.312 20 10 DECDLP CC[NH+]1CCC([NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 ZINC000898449287 641660762 /nfs/dbraw/zinc/66/07/62/641660762.db2.gz AKDJANPJKYKEIP-IBGZPJMESA-N 2 2 318.509 2.429 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)OCO2 ZINC000843048073 650877182 /nfs/dbraw/zinc/87/71/82/650877182.db2.gz MHCQHANBQHHKEQ-KGLIPLIRSA-N 2 2 304.390 2.227 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)OCO2 ZINC000843048073 650877184 /nfs/dbraw/zinc/87/71/84/650877184.db2.gz MHCQHANBQHHKEQ-KGLIPLIRSA-N 2 2 304.390 2.227 20 10 DECDLP [NH3+]C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)CC12CCOCC2 ZINC000843124473 650900939 /nfs/dbraw/zinc/90/09/39/650900939.db2.gz BDYFFIANXRXPDW-ZDUSSCGKSA-N 2 2 310.825 2.233 20 10 DECDLP [NH3+]C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC12CCOCC2 ZINC000843124473 650900941 /nfs/dbraw/zinc/90/09/41/650900941.db2.gz BDYFFIANXRXPDW-ZDUSSCGKSA-N 2 2 310.825 2.233 20 10 DECDLP CCC[N@H+](Cc1nc(C(C)(C)[NH3+])no1)Cc1ccccc1O ZINC000843358209 650956297 /nfs/dbraw/zinc/95/62/97/650956297.db2.gz DBZGNCWOXPWGPW-UHFFFAOYSA-N 2 2 304.394 2.381 20 10 DECDLP CCC[N@@H+](Cc1nc(C(C)(C)[NH3+])no1)Cc1ccccc1O ZINC000843358209 650956301 /nfs/dbraw/zinc/95/63/01/650956301.db2.gz DBZGNCWOXPWGPW-UHFFFAOYSA-N 2 2 304.394 2.381 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)[C@H]1CCCC[NH2+]1 ZINC000817895834 647374796 /nfs/dbraw/zinc/37/47/96/647374796.db2.gz WUPHETBLBLMKDT-MAUKXSAKSA-N 2 2 303.450 2.143 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)c1 ZINC000817983099 647399570 /nfs/dbraw/zinc/39/95/70/647399570.db2.gz YAVCWYLYSYCOMX-NHYWBVRUSA-N 2 2 306.406 2.347 20 10 DECDLP Cc1ccc(C)n1-c1ccc(-n2c[nH+]cc2C[C@@H]([NH3+])CO)cc1 ZINC001169073222 785029274 /nfs/dbraw/zinc/02/92/74/785029274.db2.gz DFBCNQDNLIFEBB-OAHLLOKOSA-N 2 2 310.401 2.142 20 10 DECDLP COc1cc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253473 796348881 /nfs/dbraw/zinc/34/88/81/796348881.db2.gz VNLWAVCTBQIGAK-CHWSQXEVSA-N 2 2 308.422 2.072 20 10 DECDLP COc1cc(C[N@@H+]2CCOC[C@@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139257846 796350129 /nfs/dbraw/zinc/35/01/29/796350129.db2.gz IKYXWHQSLHEXQR-MRXNPFEDSA-N 2 2 322.449 2.319 20 10 DECDLP COc1cc(C[N@H+]2CCOC[C@@H]2C(C)C)cc(C[NH+](C)C)c1O ZINC001139257846 796350134 /nfs/dbraw/zinc/35/01/34/796350134.db2.gz IKYXWHQSLHEXQR-MRXNPFEDSA-N 2 2 322.449 2.319 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCCC[C@](F)(C[NH3+])C2)cc1OC ZINC001206371773 800519419 /nfs/dbraw/zinc/51/94/19/800519419.db2.gz WBDYRUIJYIOSSE-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCCC[C@](F)(C[NH3+])C2)cc1OC ZINC001206371773 800519422 /nfs/dbraw/zinc/51/94/22/800519422.db2.gz WBDYRUIJYIOSSE-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235115737 1084315215 /nfs/dbraw/zinc/31/52/15/1084315215.db2.gz KBUVRYFIUFJLNM-LJQANCHMSA-N 2 2 315.461 2.241 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235115737 1084315221 /nfs/dbraw/zinc/31/52/21/1084315221.db2.gz KBUVRYFIUFJLNM-LJQANCHMSA-N 2 2 315.461 2.241 20 10 DECDLP C[C@H](C[NH2+]Cc1c(O)cccc1Br)C[NH+](C)C ZINC000706863862 1086653798 /nfs/dbraw/zinc/65/37/98/1086653798.db2.gz UJEVQKVXQCDEFX-SNVBAGLBSA-N 2 2 301.228 2.442 20 10 DECDLP CCc1ccc(C[N@H+](CCOC)C2CC[NH+](C)CC2)c(O)c1 ZINC001236788740 1138427952 /nfs/dbraw/zinc/42/79/52/1138427952.db2.gz OCYYPWWHXQSYRC-UHFFFAOYSA-N 2 2 306.450 2.497 20 10 DECDLP CCc1ccc(C[N@@H+](CCOC)C2CC[NH+](C)CC2)c(O)c1 ZINC001236788740 1138427958 /nfs/dbraw/zinc/42/79/58/1138427958.db2.gz OCYYPWWHXQSYRC-UHFFFAOYSA-N 2 2 306.450 2.497 20 10 DECDLP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCO1 ZINC001319931996 1140804806 /nfs/dbraw/zinc/80/48/06/1140804806.db2.gz GJCSCSRNVVDJLQ-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP CC[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCO1 ZINC001319931996 1140804807 /nfs/dbraw/zinc/80/48/07/1140804807.db2.gz GJCSCSRNVVDJLQ-MRXNPFEDSA-N 2 2 321.440 2.188 20 10 DECDLP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001308234055 1147457249 /nfs/dbraw/zinc/45/72/49/1147457249.db2.gz OSEAMXOYYPNYMW-HNNXBMFYSA-N 3 2 322.472 2.007 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093016915 193194683 /nfs/dbraw/zinc/19/46/83/193194683.db2.gz RLHLGLZAAXHXJO-GOSISDBHSA-N 2 2 317.477 2.297 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093016915 193194685 /nfs/dbraw/zinc/19/46/85/193194685.db2.gz RLHLGLZAAXHXJO-GOSISDBHSA-N 2 2 317.477 2.297 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[N@@H+](C3CC3)C[C@@H]2C)c1 ZINC000273555668 130136942 /nfs/dbraw/zinc/13/69/42/130136942.db2.gz GWZIPLLPMYMSDY-MKBNYLNASA-N 2 2 318.417 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1 ZINC000273555668 130136944 /nfs/dbraw/zinc/13/69/44/130136944.db2.gz GWZIPLLPMYMSDY-MKBNYLNASA-N 2 2 318.417 2.312 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000154643299 402223588 /nfs/dbraw/zinc/22/35/88/402223588.db2.gz JYCZFOBUSNSOLH-GDBMZVCRSA-N 2 2 321.440 2.407 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000154643299 402223591 /nfs/dbraw/zinc/22/35/91/402223591.db2.gz JYCZFOBUSNSOLH-GDBMZVCRSA-N 2 2 321.440 2.407 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365585 402998414 /nfs/dbraw/zinc/99/84/14/402998414.db2.gz BJFVIMUJTBWMNI-HOCLYGCPSA-N 2 2 313.445 2.442 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365585 402998416 /nfs/dbraw/zinc/99/84/16/402998416.db2.gz BJFVIMUJTBWMNI-HOCLYGCPSA-N 2 2 313.445 2.442 20 10 DECDLP COCC[NH+]1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293814624 403570160 /nfs/dbraw/zinc/57/01/60/403570160.db2.gz CTCVUFNDOAUEDX-UHFFFAOYSA-N 2 2 316.804 2.385 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C[C@@H]1COCC[NH2+]1 ZINC000423081114 230343180 /nfs/dbraw/zinc/34/31/80/230343180.db2.gz BEVUFYIZVBBYSF-UKRRQHHQSA-N 2 2 301.434 2.343 20 10 DECDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000131006100 526362734 /nfs/dbraw/zinc/36/27/34/526362734.db2.gz OFCYOCKTVUODGB-ZDUSSCGKSA-N 2 2 310.825 2.200 20 10 DECDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000131006100 526362738 /nfs/dbraw/zinc/36/27/38/526362738.db2.gz OFCYOCKTVUODGB-ZDUSSCGKSA-N 2 2 310.825 2.200 20 10 DECDLP COc1cc(O)c(C[NH2+]C[C@@H]([NH3+])c2ccccc2)cc1OC ZINC000841038099 650411019 /nfs/dbraw/zinc/41/10/19/650411019.db2.gz UKTDIEFLHHFPQL-CQSZACIVSA-N 2 2 302.374 2.199 20 10 DECDLP CCCN(CCC)c1ccc(C[NH2+]C[C@H]2C[NH2+]CCO2)cc1 ZINC000841099630 650430763 /nfs/dbraw/zinc/43/07/63/650430763.db2.gz UISRJXMBFXRYMX-GOSISDBHSA-N 2 2 305.466 2.391 20 10 DECDLP CCn1nc(C)c(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000841043682 641451572 /nfs/dbraw/zinc/45/15/72/641451572.db2.gz QAINFLPTKNAPNC-SFHVURJKSA-N 2 2 315.465 2.375 20 10 DECDLP CN(C)c1ccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)cc1F ZINC000903973418 643530988 /nfs/dbraw/zinc/53/09/88/643530988.db2.gz CQBCVOJMJRRBQJ-OAHLLOKOSA-N 2 2 321.440 2.140 20 10 DECDLP COc1ccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)cc1C ZINC000903974240 643531966 /nfs/dbraw/zinc/53/19/66/643531966.db2.gz MXFMNVNHYRSQQN-INIZCTEOSA-N 2 2 304.434 2.252 20 10 DECDLP Cc1cnc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000789558777 643749495 /nfs/dbraw/zinc/74/94/95/643749495.db2.gz BRQLAESZJQZLGR-UHFFFAOYSA-N 2 2 300.406 2.025 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]CC3(F)CC3)CC2)cc1 ZINC000792892438 644165470 /nfs/dbraw/zinc/16/54/70/644165470.db2.gz DGJYPCXJHCAJEJ-UHFFFAOYSA-N 2 2 321.440 2.299 20 10 DECDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)C[C@H]1COCC[NH2+]1 ZINC000817934996 647386861 /nfs/dbraw/zinc/38/68/61/647386861.db2.gz SCLVUURAFUEALC-JZXOWHBKSA-N 2 2 319.493 2.349 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817952011 647391532 /nfs/dbraw/zinc/39/15/32/647391532.db2.gz MTSRSXHHDWOCAZ-HIFRSBDPSA-N 2 2 307.413 2.065 20 10 DECDLP C[C@@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154258439 647959058 /nfs/dbraw/zinc/95/90/58/647959058.db2.gz SULZHLAIXFAUJJ-GDBMZVCRSA-N 2 2 323.456 2.389 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCN(c3[nH+]ccn3C)CC2)c(Cl)c1 ZINC000827884436 649098982 /nfs/dbraw/zinc/09/89/82/649098982.db2.gz BODLYMBZBJESJL-UHFFFAOYSA-N 2 2 320.824 2.410 20 10 DECDLP CC[N@H+](C)C[C@@H](O)C[NH+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776554 651350940 /nfs/dbraw/zinc/35/09/40/651350940.db2.gz REVJTBXIDRUHBO-GOSISDBHSA-N 2 2 305.466 2.030 20 10 DECDLP CC[N@@H+](C)C[C@@H](O)C[NH+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776554 651350942 /nfs/dbraw/zinc/35/09/42/651350942.db2.gz REVJTBXIDRUHBO-GOSISDBHSA-N 2 2 305.466 2.030 20 10 DECDLP CC[NH+](C)C[C@@H](O)C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776554 651350944 /nfs/dbraw/zinc/35/09/44/651350944.db2.gz REVJTBXIDRUHBO-GOSISDBHSA-N 2 2 305.466 2.030 20 10 DECDLP CC[NH+](C)C[C@@H](O)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000846776554 651350945 /nfs/dbraw/zinc/35/09/45/651350945.db2.gz REVJTBXIDRUHBO-GOSISDBHSA-N 2 2 305.466 2.030 20 10 DECDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929820 651565871 /nfs/dbraw/zinc/56/58/71/651565871.db2.gz JKSYKEAGHJMXCM-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1ccc(O)c(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929820 651565873 /nfs/dbraw/zinc/56/58/73/651565873.db2.gz JKSYKEAGHJMXCM-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925501494 693284582 /nfs/dbraw/zinc/28/45/82/693284582.db2.gz ISZYFTXJZMUHOK-CXAGYDPISA-N 2 2 321.440 2.017 20 10 DECDLP C[N@H+](C1CCOCC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278595 795362010 /nfs/dbraw/zinc/36/20/10/795362010.db2.gz GGJCYTUGFOALMQ-UHFFFAOYSA-N 2 2 320.433 2.173 20 10 DECDLP C[N@@H+](C1CCOCC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278595 795362013 /nfs/dbraw/zinc/36/20/13/795362013.db2.gz GGJCYTUGFOALMQ-UHFFFAOYSA-N 2 2 320.433 2.173 20 10 DECDLP C[N@@H+]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001560611006 1075143150 /nfs/dbraw/zinc/14/31/50/1075143150.db2.gz LSRRCXSJHJEFHY-GOSISDBHSA-N 2 2 317.477 2.222 20 10 DECDLP C[N@H+]1CCCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC001560611006 1075143155 /nfs/dbraw/zinc/14/31/55/1075143155.db2.gz LSRRCXSJHJEFHY-GOSISDBHSA-N 2 2 317.477 2.222 20 10 DECDLP [NH3+]C[C@H]1CCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001236251278 1138343843 /nfs/dbraw/zinc/34/38/43/1138343843.db2.gz RRLFQEOPDREYSA-LLVKDONJSA-N 2 2 304.312 2.256 20 10 DECDLP [NH3+]C[C@H]1CCC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001236251278 1138343846 /nfs/dbraw/zinc/34/38/46/1138343846.db2.gz RRLFQEOPDREYSA-LLVKDONJSA-N 2 2 304.312 2.256 20 10 DECDLP CC[NH+]1C[C@@H]2C[NH+](Cc3c(O)cc(OC)cc3Cl)C[C@H]2C1 ZINC001236806545 1138434035 /nfs/dbraw/zinc/43/40/35/1138434035.db2.gz YCCJTXMBTQZERQ-VXGBXAGGSA-N 2 2 310.825 2.438 20 10 DECDLP COCCC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H]1CC[NH2+]C1 ZINC001236945150 1138463740 /nfs/dbraw/zinc/46/37/40/1138463740.db2.gz FNDBOCMWKCWANB-QGZVFWFLSA-N 2 2 305.466 2.261 20 10 DECDLP COCCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H]1CC[NH2+]C1 ZINC001236945150 1138463745 /nfs/dbraw/zinc/46/37/45/1138463745.db2.gz FNDBOCMWKCWANB-QGZVFWFLSA-N 2 2 305.466 2.261 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC[NH2+]1 ZINC001246357515 1140887621 /nfs/dbraw/zinc/88/76/21/1140887621.db2.gz AHMMEYGOYZCHHD-PBHICJAKSA-N 3 2 303.450 2.087 20 10 DECDLP CCOc1ccc(N2CC[NH+](CCn3cc[nH+]c3C)CC2)cc1 ZINC001341422722 1143599450 /nfs/dbraw/zinc/59/94/50/1143599450.db2.gz CZOBOUJRCASODC-UHFFFAOYSA-N 2 2 314.433 2.412 20 10 DECDLP Oc1cc2c(cc1O)C[N@@H+](C1CC[NH+](C3CC3)CC1)CCC2 ZINC001256080989 1143828815 /nfs/dbraw/zinc/82/88/15/1143828815.db2.gz KNEHVOFHDMQFLM-UHFFFAOYSA-N 2 2 302.418 2.473 20 10 DECDLP Oc1cc2c(cc1O)C[N@H+](C1CC[NH+](C3CC3)CC1)CCC2 ZINC001256080989 1143828816 /nfs/dbraw/zinc/82/88/16/1143828816.db2.gz KNEHVOFHDMQFLM-UHFFFAOYSA-N 2 2 302.418 2.473 20 10 DECDLP CC[N@H+](CCC[NH+](C)C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000289393022 131383065 /nfs/dbraw/zinc/38/30/65/131383065.db2.gz FHVUXDLXPFMXLZ-UHFFFAOYSA-N 2 2 311.382 2.083 20 10 DECDLP CC[N@@H+](CCC[NH+](C)C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000289393022 131383066 /nfs/dbraw/zinc/38/30/66/131383066.db2.gz FHVUXDLXPFMXLZ-UHFFFAOYSA-N 2 2 311.382 2.083 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093016917 402010799 /nfs/dbraw/zinc/01/07/99/402010799.db2.gz RLHLGLZAAXHXJO-SFHVURJKSA-N 2 2 317.477 2.297 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093016917 402010802 /nfs/dbraw/zinc/01/08/02/402010802.db2.gz RLHLGLZAAXHXJO-SFHVURJKSA-N 2 2 317.477 2.297 20 10 DECDLP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278332500 402863083 /nfs/dbraw/zinc/86/30/83/402863083.db2.gz ZIYOWBOWGGOASO-LBPRGKRZSA-N 2 2 323.393 2.083 20 10 DECDLP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278332500 402863084 /nfs/dbraw/zinc/86/30/84/402863084.db2.gz ZIYOWBOWGGOASO-LBPRGKRZSA-N 2 2 323.393 2.083 20 10 DECDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[N@H+](C)CCN2C)cc1 ZINC000268908224 403121169 /nfs/dbraw/zinc/12/11/69/403121169.db2.gz MJCZUCVQHVATSJ-QAPCUYQASA-N 2 2 304.482 2.039 20 10 DECDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2C[N@@H+](C)CCN2C)cc1 ZINC000268908224 403121170 /nfs/dbraw/zinc/12/11/70/403121170.db2.gz MJCZUCVQHVATSJ-QAPCUYQASA-N 2 2 304.482 2.039 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000296617067 404311148 /nfs/dbraw/zinc/31/11/48/404311148.db2.gz WPOIMWVHOQMRSD-JZIBPQBNSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000296617067 404311152 /nfs/dbraw/zinc/31/11/52/404311152.db2.gz WPOIMWVHOQMRSD-JZIBPQBNSA-N 2 2 318.417 2.455 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000365821535 404726756 /nfs/dbraw/zinc/72/67/56/404726756.db2.gz LGGTYWWYMGGKSK-CHWSQXEVSA-N 2 2 321.377 2.025 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000365821535 404726757 /nfs/dbraw/zinc/72/67/57/404726757.db2.gz LGGTYWWYMGGKSK-CHWSQXEVSA-N 2 2 321.377 2.025 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1OC ZINC000160240066 522771790 /nfs/dbraw/zinc/77/17/90/522771790.db2.gz IIHLKVPTRAMJRE-UHFFFAOYSA-N 2 2 317.389 2.443 20 10 DECDLP C[C@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000155668737 525375940 /nfs/dbraw/zinc/37/59/40/525375940.db2.gz VPLPPFVAIORTBQ-AWEZNQCLSA-N 2 2 318.396 2.210 20 10 DECDLP C[NH+]1CCN(c2ccc(CNc3nccn4c[nH+]cc34)cc2)CC1 ZINC000895145702 637663397 /nfs/dbraw/zinc/66/33/97/637663397.db2.gz YGAMRQODNHSXFX-UHFFFAOYSA-N 2 2 322.416 2.093 20 10 DECDLP CCO[C@@H](C[NH2+]Cc1cc(Cl)cc(OC)c1O)C[NH+](C)C ZINC000896879535 638753551 /nfs/dbraw/zinc/75/35/51/638753551.db2.gz CXIRTIDHTYECOA-ZDUSSCGKSA-N 2 2 316.829 2.111 20 10 DECDLP COc1ccc(N2CCC([NH2+]CC[NH+]3CCCC3)CC2)cc1 ZINC000764618434 640664568 /nfs/dbraw/zinc/66/45/68/640664568.db2.gz MNRQQDLLEQKLDQ-UHFFFAOYSA-N 2 2 303.450 2.349 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3C[NH+](C)C[C@]3(C)C2)c1O ZINC000897621421 640871201 /nfs/dbraw/zinc/87/12/01/640871201.db2.gz AHIJCZNGNAXKMH-BLLLJJGKSA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2C[C@@H]3C[NH+](C)C[C@]3(C)C2)c1O ZINC000897621421 640871205 /nfs/dbraw/zinc/87/12/05/640871205.db2.gz AHIJCZNGNAXKMH-BLLLJJGKSA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[NH+]2C[C@@H]3C[N@H+](C)C[C@]3(C)C2)c1O ZINC000897621421 640871208 /nfs/dbraw/zinc/87/12/08/640871208.db2.gz AHIJCZNGNAXKMH-BLLLJJGKSA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[NH+]2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1O ZINC000897621421 640871212 /nfs/dbraw/zinc/87/12/12/640871212.db2.gz AHIJCZNGNAXKMH-BLLLJJGKSA-N 2 2 310.825 2.438 20 10 DECDLP Oc1cc2c(cc1C[NH+]1CCC([NH2+]CC3CC3)CC1)OCO2 ZINC000843054003 650878603 /nfs/dbraw/zinc/87/86/03/650878603.db2.gz ASFHIXJJUWCTED-UHFFFAOYSA-N 2 2 304.390 2.085 20 10 DECDLP COc1cc(O)c(C[NH2+][C@H]2CC[NH2+]C23CCCC3)cc1OC ZINC000843129129 650902460 /nfs/dbraw/zinc/90/24/60/650902460.db2.gz RTAKZQVIPRJCRH-INIZCTEOSA-N 2 2 306.406 2.174 20 10 DECDLP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(N2CCOCC2)cc1Cl ZINC000817977846 647398937 /nfs/dbraw/zinc/39/89/37/647398937.db2.gz QNLDXAQIQFQPEK-LCSDZXHASA-N 2 2 321.852 2.045 20 10 DECDLP COc1cc[nH+]c(N2CC[NH+](Cc3ccc(C)cc3O)CC2)c1 ZINC000876688974 689903820 /nfs/dbraw/zinc/90/38/20/689903820.db2.gz RBNKXSFQQHWWOQ-UHFFFAOYSA-N 2 2 313.401 2.426 20 10 DECDLP CC[NH+](CC)CC[C@H](CO)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000883161574 691445054 /nfs/dbraw/zinc/44/50/54/691445054.db2.gz VLGAWAHPHSODSK-OAHLLOKOSA-N 2 2 311.445 2.074 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ncco1 ZINC000886274745 692042414 /nfs/dbraw/zinc/04/24/14/692042414.db2.gz ZWXAAWFEKHCAFJ-AWEZNQCLSA-N 2 2 300.406 2.277 20 10 DECDLP CN(C)c1ccc(C[N@H+](C)CCN2CC[NH+](C)CC2)c(Cl)c1 ZINC001140924341 796598869 /nfs/dbraw/zinc/59/88/69/796598869.db2.gz FXOVSMNRCOLFBZ-UHFFFAOYSA-N 2 2 324.900 2.085 20 10 DECDLP CN(C)c1ccc(C[N@H+](C)C[C@H]2C[NH2+]CCO2)c2ccccc21 ZINC001205376305 800349664 /nfs/dbraw/zinc/34/96/64/800349664.db2.gz FNJJPICMWBLAIE-MRXNPFEDSA-N 2 2 313.445 2.326 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C)C[C@H]2C[NH2+]CCO2)c2ccccc21 ZINC001205376305 800349667 /nfs/dbraw/zinc/34/96/67/800349667.db2.gz FNJJPICMWBLAIE-MRXNPFEDSA-N 2 2 313.445 2.326 20 10 DECDLP COCC[N@H+](Cc1ccc(N(C)C)cc1O)C1CC[NH+](C)CC1 ZINC001232839709 801968962 /nfs/dbraw/zinc/96/89/62/801968962.db2.gz ULAVDYLAKNEPEZ-UHFFFAOYSA-N 2 2 321.465 2.001 20 10 DECDLP COCC[N@@H+](Cc1ccc(N(C)C)cc1O)C1CC[NH+](C)CC1 ZINC001232839709 801968963 /nfs/dbraw/zinc/96/89/63/801968963.db2.gz ULAVDYLAKNEPEZ-UHFFFAOYSA-N 2 2 321.465 2.001 20 10 DECDLP Oc1cc(O)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1O ZINC001233485561 802127798 /nfs/dbraw/zinc/12/77/98/802127798.db2.gz AXGNJLZDUJYWFV-UHFFFAOYSA-N 2 2 324.396 2.202 20 10 DECDLP C[C@H]([NH2+]Cc1ccc2ccccc2c1O)[C@H]1C[N@H+](C)CCN1C ZINC001660047333 1080260913 /nfs/dbraw/zinc/26/09/13/1080260913.db2.gz IVJOGPATGPGGIX-KBXCAEBGSA-N 2 2 313.445 2.269 20 10 DECDLP C[C@H]([NH2+]Cc1ccc2ccccc2c1O)[C@H]1C[N@@H+](C)CCN1C ZINC001660047333 1080260922 /nfs/dbraw/zinc/26/09/22/1080260922.db2.gz IVJOGPATGPGGIX-KBXCAEBGSA-N 2 2 313.445 2.269 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOCC3(C)C)c(F)c2)CC1 ZINC001236940331 1138462271 /nfs/dbraw/zinc/46/22/71/1138462271.db2.gz ZTFRZAYRDVUIJC-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCOCC3(C)C)c(F)c2)CC1 ZINC001236940331 1138462276 /nfs/dbraw/zinc/46/22/76/1138462276.db2.gz ZTFRZAYRDVUIJC-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[C@@H]1OCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H]1C ZINC001254010942 1143025746 /nfs/dbraw/zinc/02/57/46/1143025746.db2.gz QLFGCCOAZUKSKZ-GJZGRUSLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1OCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@H]1C ZINC001254010942 1143025759 /nfs/dbraw/zinc/02/57/59/1143025759.db2.gz QLFGCCOAZUKSKZ-GJZGRUSLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(F)cc1O ZINC000185352960 402346462 /nfs/dbraw/zinc/34/64/62/402346462.db2.gz KXVPWRPHYKJUNN-AWEZNQCLSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1ccc(F)cc1O ZINC000185352960 402346465 /nfs/dbraw/zinc/34/64/65/402346465.db2.gz KXVPWRPHYKJUNN-AWEZNQCLSA-N 2 2 323.456 2.456 20 10 DECDLP C[NH2+]C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000923431305 637176389 /nfs/dbraw/zinc/17/63/89/637176389.db2.gz OJONQCFRLNHHKP-SFHVURJKSA-N 2 2 303.450 2.097 20 10 DECDLP C[NH2+]C[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000923431305 637176392 /nfs/dbraw/zinc/17/63/92/637176392.db2.gz OJONQCFRLNHHKP-SFHVURJKSA-N 2 2 303.450 2.097 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000756359290 639654049 /nfs/dbraw/zinc/65/40/49/639654049.db2.gz DCHWPXUCNNSRTD-CYBMUJFWSA-N 2 2 306.406 2.315 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000756553948 639673957 /nfs/dbraw/zinc/67/39/57/639673957.db2.gz NKRJXFKUTGVDJR-OLZOCXBDSA-N 2 2 306.406 2.171 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000756553948 639673959 /nfs/dbraw/zinc/67/39/59/639673959.db2.gz NKRJXFKUTGVDJR-OLZOCXBDSA-N 2 2 306.406 2.171 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@@H+]1C ZINC000898447180 641665225 /nfs/dbraw/zinc/66/52/25/641665225.db2.gz GJHJVUHGEAEERR-SUMDDJOVSA-N 2 2 318.509 2.428 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@H+]1C ZINC000898447180 641665229 /nfs/dbraw/zinc/66/52/29/641665229.db2.gz GJHJVUHGEAEERR-SUMDDJOVSA-N 2 2 318.509 2.428 20 10 DECDLP [NH3+]C[C@@H]1CC2(CO1)CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC000904392467 643652654 /nfs/dbraw/zinc/65/26/54/643652654.db2.gz RJHORHNFXFKPJP-ZDUSSCGKSA-N 2 2 310.825 2.375 20 10 DECDLP COc1cccc(C[NH2+]Cc2ncc(C[NH+](C)C)s2)c1O ZINC000809741781 646273896 /nfs/dbraw/zinc/27/38/96/646273896.db2.gz WGPJAEGJGIBQQR-UHFFFAOYSA-N 2 2 307.419 2.209 20 10 DECDLP Cc1nn(C)cc1[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939001 647387774 /nfs/dbraw/zinc/38/77/74/647387774.db2.gz XIJJQCULGLNTCI-SJCJKPOMSA-N 2 2 301.438 2.145 20 10 DECDLP CC(C)[C@@H](Cn1cccn1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940259 647387806 /nfs/dbraw/zinc/38/78/06/647387806.db2.gz FBSIKVMKYSNZNP-ZWKOTPCHSA-N 2 2 315.465 2.263 20 10 DECDLP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817952010 647391561 /nfs/dbraw/zinc/39/15/61/647391561.db2.gz MTSRSXHHDWOCAZ-DZGCQCFKSA-N 2 2 307.413 2.065 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)cc1 ZINC000817984480 647400446 /nfs/dbraw/zinc/40/04/46/647400446.db2.gz YMAUAOLEAVTZNP-QAPCUYQASA-N 2 2 303.450 2.316 20 10 DECDLP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817984462 647400725 /nfs/dbraw/zinc/40/07/25/647400725.db2.gz TWAHGSOEIXVVFO-HOCLYGCPSA-N 2 2 321.440 2.455 20 10 DECDLP CCC1([NH+]2CCOCC2)CC[NH+](Cc2ccccc2O)CC1 ZINC000862534808 686316563 /nfs/dbraw/zinc/31/65/63/686316563.db2.gz HRMIZMXVFIIEOO-UHFFFAOYSA-N 2 2 304.434 2.469 20 10 DECDLP Oc1ccccc1C[N@H+](C[C@H]1CCCO1)CC12CC(C1)C[NH2+]2 ZINC000873209790 689184708 /nfs/dbraw/zinc/18/47/08/689184708.db2.gz RPHGXTOZCQPINB-BFHRDPOASA-N 2 2 302.418 2.125 20 10 DECDLP Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)CC12CC(C1)C[NH2+]2 ZINC000873209790 689184712 /nfs/dbraw/zinc/18/47/12/689184712.db2.gz RPHGXTOZCQPINB-BFHRDPOASA-N 2 2 302.418 2.125 20 10 DECDLP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000925764352 693337319 /nfs/dbraw/zinc/33/73/19/693337319.db2.gz YSINMGLEOCXBIQ-MOPGFXCFSA-N 3 2 316.493 2.059 20 10 DECDLP COc1cc(C[N@@H+]2CCC[C@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139260718 796351441 /nfs/dbraw/zinc/35/14/41/796351441.db2.gz WOZJHIKCAPRVBQ-HNNXBMFYSA-N 2 2 306.406 2.016 20 10 DECDLP COc1cc(C[N@H+]2CCC[C@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139260718 796351443 /nfs/dbraw/zinc/35/14/43/796351443.db2.gz WOZJHIKCAPRVBQ-HNNXBMFYSA-N 2 2 306.406 2.016 20 10 DECDLP CN(C)C1=[NH+]OC2(C1)CC[NH+](Cc1cc(F)ccc1O)CC2 ZINC001140053955 796471548 /nfs/dbraw/zinc/47/15/48/796471548.db2.gz GEUDGMASDSVMPG-UHFFFAOYSA-N 2 2 307.369 2.161 20 10 DECDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCCO4)cc2)CC1 ZINC001140302648 796503266 /nfs/dbraw/zinc/50/32/66/796503266.db2.gz WVQIEECJINQWHI-UHFFFAOYSA-N 2 2 315.461 2.193 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001205725445 800408678 /nfs/dbraw/zinc/40/86/78/800408678.db2.gz HOWKMCXNLXLVRU-AWEZNQCLSA-N 2 2 318.339 2.087 20 10 DECDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001205725445 800408682 /nfs/dbraw/zinc/40/86/82/800408682.db2.gz HOWKMCXNLXLVRU-AWEZNQCLSA-N 2 2 318.339 2.087 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(Cl)c1 ZINC001205789335 800421302 /nfs/dbraw/zinc/42/13/02/800421302.db2.gz YFNJVDKLTMVOJO-VIFPVBQESA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(Cl)c1 ZINC001205789335 800421304 /nfs/dbraw/zinc/42/13/04/800421304.db2.gz YFNJVDKLTMVOJO-VIFPVBQESA-N 2 2 320.767 2.470 20 10 DECDLP Oc1c(Cl)cccc1C[NH2+][C@@H]1CCOC2(CC[NH2+]CC2)C1 ZINC001580885491 1076014228 /nfs/dbraw/zinc/01/42/28/1076014228.db2.gz AHUZJVODNVPHDB-CYBMUJFWSA-N 2 2 310.825 2.436 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@H+](C)CCN2C)cc1Cl ZINC001660047242 1080260253 /nfs/dbraw/zinc/26/02/53/1080260253.db2.gz HMOWUXZTAPESSE-DOMZBBRYSA-N 2 2 311.857 2.078 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1Cl ZINC001660047242 1080260259 /nfs/dbraw/zinc/26/02/59/1080260259.db2.gz HMOWUXZTAPESSE-DOMZBBRYSA-N 2 2 311.857 2.078 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC(C)(C)C3)c(F)c2)CC1 ZINC001236930688 1138459924 /nfs/dbraw/zinc/45/99/24/1138459924.db2.gz FDFGHIQRXVRDRR-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC(C)(C)C3)c(F)c2)CC1 ZINC001236930688 1138459927 /nfs/dbraw/zinc/45/99/27/1138459927.db2.gz FDFGHIQRXVRDRR-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cn2cc[nH+]c2)c1 ZINC000273413958 130118794 /nfs/dbraw/zinc/11/87/94/130118794.db2.gz QJPZTVFBWVQVQD-VXGBXAGGSA-N 2 2 303.362 2.115 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)c1 ZINC000273555674 130136286 /nfs/dbraw/zinc/13/62/86/130136286.db2.gz GWZIPLLPMYMSDY-MQIPJXDCSA-N 2 2 318.417 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1 ZINC000273555674 130136289 /nfs/dbraw/zinc/13/62/89/130136289.db2.gz GWZIPLLPMYMSDY-MQIPJXDCSA-N 2 2 318.417 2.312 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CC[C@@H](Oc3cc[nH+]cc3)C1)OCO2 ZINC000121201540 402019813 /nfs/dbraw/zinc/01/98/13/402019813.db2.gz GBNDLMVFYWNWAD-CQSZACIVSA-N 2 2 314.341 2.169 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CC[C@@H](Oc3cc[nH+]cc3)C1)OCO2 ZINC000121201540 402019815 /nfs/dbraw/zinc/01/98/15/402019815.db2.gz GBNDLMVFYWNWAD-CQSZACIVSA-N 2 2 314.341 2.169 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)cc1F ZINC000130994384 522181696 /nfs/dbraw/zinc/18/16/96/522181696.db2.gz PTDCINNTSAPPHH-MRXNPFEDSA-N 2 2 321.440 2.046 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)cc1F ZINC000130994384 522181706 /nfs/dbraw/zinc/18/17/06/522181706.db2.gz PTDCINNTSAPPHH-MRXNPFEDSA-N 2 2 321.440 2.046 20 10 DECDLP CN(C)c1ccc([C@H](CNc2cc[nH+]cc2F)[NH+](C)C)cc1 ZINC000897521773 640537823 /nfs/dbraw/zinc/53/78/23/640537823.db2.gz IUERCWYVLUINOB-KRWDZBQOSA-N 2 2 302.397 2.423 20 10 DECDLP Cc1cc(Br)cc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1O ZINC000775747729 642088816 /nfs/dbraw/zinc/08/88/16/642088816.db2.gz MYWSAKOMPSUEKQ-TXEJJXNPSA-N 2 2 311.223 2.114 20 10 DECDLP Cc1cc(Br)cc(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1O ZINC000775747729 642088820 /nfs/dbraw/zinc/08/88/20/642088820.db2.gz MYWSAKOMPSUEKQ-TXEJJXNPSA-N 2 2 311.223 2.114 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCC[NH2+]1 ZINC000817887772 647372193 /nfs/dbraw/zinc/37/21/93/647372193.db2.gz DURJUUHHWOMCJE-PBHICJAKSA-N 2 2 321.440 2.283 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000817895835 647374880 /nfs/dbraw/zinc/37/48/80/647374880.db2.gz WUPHETBLBLMKDT-QAPCUYQASA-N 2 2 303.450 2.143 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000817941442 647388919 /nfs/dbraw/zinc/38/89/19/647388919.db2.gz JTEWUBQWKXUBLY-DLBZAZTESA-N 2 2 303.450 2.301 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817982415 647399444 /nfs/dbraw/zinc/39/94/44/647399444.db2.gz DPMOYJVUTZESQP-GDBMZVCRSA-N 2 2 321.440 2.455 20 10 DECDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827698903 649071399 /nfs/dbraw/zinc/07/13/99/649071399.db2.gz CRTMGQQKEGBGTP-MRXNPFEDSA-N 2 2 324.852 2.385 20 10 DECDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827698903 649071401 /nfs/dbraw/zinc/07/14/01/649071401.db2.gz CRTMGQQKEGBGTP-MRXNPFEDSA-N 2 2 324.852 2.385 20 10 DECDLP COc1cccc(O)c1C[N@@H+]1CCC[C@@H]([NH+]2CCOCC2)CC1 ZINC000848930617 651565592 /nfs/dbraw/zinc/56/55/92/651565592.db2.gz UCGGAUKAKPJJLV-OAHLLOKOSA-N 2 2 320.433 2.088 20 10 DECDLP COc1cccc(O)c1C[N@H+]1CCC[C@@H]([NH+]2CCOCC2)CC1 ZINC000848930617 651565595 /nfs/dbraw/zinc/56/55/95/651565595.db2.gz UCGGAUKAKPJJLV-OAHLLOKOSA-N 2 2 320.433 2.088 20 10 DECDLP CCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000389261137 685433420 /nfs/dbraw/zinc/43/34/20/685433420.db2.gz ORROLKOLHLZSEZ-KRWDZBQOSA-N 2 2 303.450 2.097 20 10 DECDLP CCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000389261137 685433423 /nfs/dbraw/zinc/43/34/23/685433423.db2.gz ORROLKOLHLZSEZ-KRWDZBQOSA-N 2 2 303.450 2.097 20 10 DECDLP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000863545160 686519205 /nfs/dbraw/zinc/51/92/05/686519205.db2.gz JQBBTHAQHFYOGM-IIAWOOMASA-N 2 2 321.440 2.453 20 10 DECDLP Cc1cc(C)c(O)c(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c1 ZINC000872637879 689054127 /nfs/dbraw/zinc/05/41/27/689054127.db2.gz SNOVUCGUGTUDFO-QZTJIDSGSA-N 3 2 319.493 2.180 20 10 DECDLP COc1cccc(O)c1C[NH+]1CCC([NH2+]C2CCOCC2)CC1 ZINC001332724173 1149884728 /nfs/dbraw/zinc/88/47/28/1149884728.db2.gz KKBSCYFJLGJHCQ-UHFFFAOYSA-N 2 2 320.433 2.134 20 10 DECDLP COc1cc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253352 796349538 /nfs/dbraw/zinc/34/95/38/796349538.db2.gz RWOPHTOXMIIMAD-ZDUSSCGKSA-N 2 2 320.433 2.263 20 10 DECDLP COc1cc(C[N@H+]2CCCC(=O)[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253352 796349543 /nfs/dbraw/zinc/34/95/43/796349543.db2.gz RWOPHTOXMIIMAD-ZDUSSCGKSA-N 2 2 320.433 2.263 20 10 DECDLP COc1cc(O)c(C[N@H+](C)CCC[NH+]2CCCC2)c(OC)c1 ZINC001141028525 796620078 /nfs/dbraw/zinc/62/00/78/796620078.db2.gz SHGMLJIHMRDGFT-UHFFFAOYSA-N 2 2 308.422 2.327 20 10 DECDLP COc1cc(O)c(C[N@@H+](C)CCC[NH+]2CCCC2)c(OC)c1 ZINC001141028525 796620083 /nfs/dbraw/zinc/62/00/83/796620083.db2.gz SHGMLJIHMRDGFT-UHFFFAOYSA-N 2 2 308.422 2.327 20 10 DECDLP CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@@H]([NH3+])[C@H](O)C2)cc1Cl ZINC001205981970 799402042 /nfs/dbraw/zinc/40/20/42/799402042.db2.gz KFUIYAXMEUKCTJ-UKRRQHHQSA-N 2 2 312.841 2.237 20 10 DECDLP CC(C)(C)c1cc(O)c(C[N@H+]2CC[C@@H]([NH3+])[C@H](O)C2)cc1Cl ZINC001205981970 799402046 /nfs/dbraw/zinc/40/20/46/799402046.db2.gz KFUIYAXMEUKCTJ-UKRRQHHQSA-N 2 2 312.841 2.237 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203883739 800139571 /nfs/dbraw/zinc/13/95/71/800139571.db2.gz NGCODHAAPZYNBX-AWEZNQCLSA-N 2 2 300.358 2.455 20 10 DECDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2ccc(O)c(O)c2)C1 ZINC001203883739 800139575 /nfs/dbraw/zinc/13/95/75/800139575.db2.gz NGCODHAAPZYNBX-AWEZNQCLSA-N 2 2 300.358 2.455 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c(Cl)c1 ZINC001206200729 800488192 /nfs/dbraw/zinc/48/81/92/800488192.db2.gz SSJRGIPQRPYPCG-QWHCGFSZSA-N 2 2 302.777 2.315 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c(Cl)c1 ZINC001206200729 800488200 /nfs/dbraw/zinc/48/82/00/800488200.db2.gz SSJRGIPQRPYPCG-QWHCGFSZSA-N 2 2 302.777 2.315 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC[N@@H+]3C)cc2)CC1 ZINC001474289291 1060842702 /nfs/dbraw/zinc/84/27/02/1060842702.db2.gz ULDYUDIRGDZKCC-IBGZPJMESA-N 3 2 316.493 2.012 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC[N@H+]3C)cc2)CC1 ZINC001474289291 1060842710 /nfs/dbraw/zinc/84/27/10/1060842710.db2.gz ULDYUDIRGDZKCC-IBGZPJMESA-N 3 2 316.493 2.012 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235170552 1084334116 /nfs/dbraw/zinc/33/41/16/1084334116.db2.gz BIDZMUZBUFJQPV-SMDDNHRTSA-N 2 2 316.323 2.256 20 10 DECDLP [NH3+][C@@]12C[C@@H]1CC[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235170552 1084334149 /nfs/dbraw/zinc/33/41/49/1084334149.db2.gz BIDZMUZBUFJQPV-SMDDNHRTSA-N 2 2 316.323 2.256 20 10 DECDLP CC[N@H+](C)C1CC[NH+](Cc2cc(OC)c(OC)cc2O)CC1 ZINC001236755152 1138410737 /nfs/dbraw/zinc/41/07/37/1138410737.db2.gz ZOHLZZJDGXIHDS-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](C)C1CC[NH+](Cc2cc(OC)c(OC)cc2O)CC1 ZINC001236755152 1138410749 /nfs/dbraw/zinc/41/07/49/1138410749.db2.gz ZOHLZZJDGXIHDS-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP C[N@H+]1C[C@@H]2C[NH+](Cc3c(O)cccc3OC(F)(F)F)C[C@@H]2C1 ZINC001237122433 1138507611 /nfs/dbraw/zinc/50/76/11/1138507611.db2.gz ITCLOHUXXQQDTG-PHIMTYICSA-N 2 2 316.323 2.284 20 10 DECDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3c(O)cccc3OC(F)(F)F)C[C@@H]2C1 ZINC001237122433 1138507615 /nfs/dbraw/zinc/50/76/15/1138507615.db2.gz ITCLOHUXXQQDTG-PHIMTYICSA-N 2 2 316.323 2.284 20 10 DECDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3c(O)cccc3OC(F)(F)F)C[C@@H]2C1 ZINC001237122433 1138507619 /nfs/dbraw/zinc/50/76/19/1138507619.db2.gz ITCLOHUXXQQDTG-PHIMTYICSA-N 2 2 316.323 2.284 20 10 DECDLP C[NH+]1C[C@@H]2C[N@H+](Cc3c(O)cccc3OC(F)(F)F)C[C@@H]2C1 ZINC001237122433 1138507624 /nfs/dbraw/zinc/50/76/24/1138507624.db2.gz ITCLOHUXXQQDTG-PHIMTYICSA-N 2 2 316.323 2.284 20 10 DECDLP C[NH2+]CCC[NH+]1CCN(c2ccc(OC(F)(F)F)cc2)CC1 ZINC001237206177 1138533302 /nfs/dbraw/zinc/53/33/02/1138533302.db2.gz SZXFVTFLAXGPKB-UHFFFAOYSA-N 2 2 317.355 2.317 20 10 DECDLP CCOc1ccc(N2CC[NH+](C3CC[NH+](C)CC3)CC2)cc1 ZINC001256209661 1143836594 /nfs/dbraw/zinc/83/65/94/1143836594.db2.gz RKOIVOLIVFFSIQ-UHFFFAOYSA-N 2 2 303.450 2.302 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cn2cc[nH+]c2)c1 ZINC000273413955 130119667 /nfs/dbraw/zinc/11/96/67/130119667.db2.gz QJPZTVFBWVQVQD-RYUDHWBXSA-N 2 2 303.362 2.115 20 10 DECDLP Cn1c[nH+]cc1C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000177064735 402366402 /nfs/dbraw/zinc/36/64/02/402366402.db2.gz LGIQFLLYWXKDFA-INIZCTEOSA-N 2 2 301.390 2.307 20 10 DECDLP Cn1c[nH+]cc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000177064735 402366405 /nfs/dbraw/zinc/36/64/05/402366405.db2.gz LGIQFLLYWXKDFA-INIZCTEOSA-N 2 2 301.390 2.307 20 10 DECDLP COc1ccc(N2CC[NH+](CCCn3cc[nH+]c3)CC2)cc1 ZINC000182664530 524422584 /nfs/dbraw/zinc/42/25/84/524422584.db2.gz AAURVCOMGXXZOF-UHFFFAOYSA-N 2 2 300.406 2.104 20 10 DECDLP C[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCCC1)c1ccc(F)c(F)c1O ZINC000191216664 525496496 /nfs/dbraw/zinc/49/64/96/525496496.db2.gz HRJSESHVOSUKRJ-NEPJUHHUSA-N 2 2 314.376 2.168 20 10 DECDLP COC(=O)C1CCC([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000841042754 650412664 /nfs/dbraw/zinc/41/26/64/650412664.db2.gz NGEVKTZSONMZTC-VMBOVVBDSA-N 2 2 319.449 2.074 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@H](C)[NH3+] ZINC000841076531 650423889 /nfs/dbraw/zinc/42/38/89/650423889.db2.gz HYAWRZHJZWJGHX-QWHCGFSZSA-N 2 2 306.410 2.410 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@@H+]1C1CCOCC1 ZINC000897229847 639262675 /nfs/dbraw/zinc/26/26/75/639262675.db2.gz XMCREDLHZAOPFH-IBGZPJMESA-N 2 2 317.477 2.404 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000897229847 639262680 /nfs/dbraw/zinc/26/26/80/639262680.db2.gz XMCREDLHZAOPFH-IBGZPJMESA-N 2 2 317.477 2.404 20 10 DECDLP CC[NH+]1CCC([NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 ZINC000898449288 641660660 /nfs/dbraw/zinc/66/06/60/641660660.db2.gz AKDJANPJKYKEIP-LJQANCHMSA-N 2 2 318.509 2.429 20 10 DECDLP CCC[NH+]1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000775051953 641999639 /nfs/dbraw/zinc/99/96/39/641999639.db2.gz RIVOJRUURCAZCH-UHFFFAOYSA-N 2 2 323.393 2.273 20 10 DECDLP Oc1ccc(Cl)cc1C[NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903973741 643531584 /nfs/dbraw/zinc/53/15/84/643531584.db2.gz HEXJDUVOSFQALQ-AWEZNQCLSA-N 2 2 310.825 2.294 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C2CCC3(CC2)OCCO3)cc1 ZINC000817940762 647388367 /nfs/dbraw/zinc/38/83/67/647388367.db2.gz HSEDJVJESAFDOI-QGZVFWFLSA-N 2 2 319.449 2.028 20 10 DECDLP CCn1cc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000817944198 647390062 /nfs/dbraw/zinc/39/00/62/647390062.db2.gz YAPIECQDNLGXES-SUMWQHHRSA-N 2 2 301.438 2.320 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1CCCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817945997 647390733 /nfs/dbraw/zinc/39/07/33/647390733.db2.gz PMWUBKFVRVVQLG-GDBMZVCRSA-N 2 2 321.440 2.455 20 10 DECDLP COc1ccc(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929103 651564320 /nfs/dbraw/zinc/56/43/20/651564320.db2.gz ANHOCLXTQLJACA-MRXNPFEDSA-N 2 2 320.433 2.088 20 10 DECDLP COc1ccc(O)c(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929103 651564323 /nfs/dbraw/zinc/56/43/23/651564323.db2.gz ANHOCLXTQLJACA-MRXNPFEDSA-N 2 2 320.433 2.088 20 10 DECDLP COCC[N@H+](C)CCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858096705 652253567 /nfs/dbraw/zinc/25/35/67/652253567.db2.gz MISKBGRVASWLOL-UHFFFAOYSA-N 2 2 315.408 2.089 20 10 DECDLP COCC[N@@H+](C)CCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858096705 652253570 /nfs/dbraw/zinc/25/35/70/652253570.db2.gz MISKBGRVASWLOL-UHFFFAOYSA-N 2 2 315.408 2.089 20 10 DECDLP Cc1cc(Br)c(O)c(C[NH2+]CC23CC(C2)C[NH2+]3)c1 ZINC000853246595 652529189 /nfs/dbraw/zinc/52/91/89/652529189.db2.gz NDLSCOUCPWOUDT-UHFFFAOYSA-N 2 2 311.223 2.305 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925501501 693284396 /nfs/dbraw/zinc/28/43/96/693284396.db2.gz ISZYFTXJZMUHOK-GUYCJALGSA-N 2 2 321.440 2.017 20 10 DECDLP CC[NH+]1CCC([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001169238864 785107340 /nfs/dbraw/zinc/10/73/40/785107340.db2.gz MZTGAWSTVODQEP-UHFFFAOYSA-N 3 2 317.477 2.431 20 10 DECDLP CC[NH+](CC)CCCN1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC001138128410 799594263 /nfs/dbraw/zinc/59/42/63/799594263.db2.gz IDGDDTWOLKSKOO-UHFFFAOYSA-N 2 2 323.456 2.381 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@@H]2C1 ZINC001203551864 800078420 /nfs/dbraw/zinc/07/84/20/800078420.db2.gz RCIRBXYEFKTNLG-IRXDYDNUSA-N 2 2 309.413 2.351 20 10 DECDLP COc1ccc(C[NH+]2CCC3(CC(N(C)C)=[NH+]O3)CC2)c(O)c1 ZINC001203623903 800093247 /nfs/dbraw/zinc/09/32/47/800093247.db2.gz XYYYEFGOSASTEM-UHFFFAOYSA-N 2 2 319.405 2.031 20 10 DECDLP COc1cc(C[NH+]2CCC([N@H+](C)C3CC3)CC2)c(O)cc1O ZINC001231639690 801702424 /nfs/dbraw/zinc/70/24/24/801702424.db2.gz ZLYPATWYCYDZBH-UHFFFAOYSA-N 2 2 306.406 2.165 20 10 DECDLP COc1cc(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)c(O)cc1O ZINC001231639690 801702428 /nfs/dbraw/zinc/70/24/28/801702428.db2.gz ZLYPATWYCYDZBH-UHFFFAOYSA-N 2 2 306.406 2.165 20 10 DECDLP COc1cc(C[N@@H+]2CCC[C@]23CCC[NH2+]C3)c(O)c(OC)c1 ZINC001222259554 802662874 /nfs/dbraw/zinc/66/28/74/802662874.db2.gz SSLKLJBLWLBPBU-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP COc1cc(C[N@H+]2CCC[C@]23CCC[NH2+]C3)c(O)c(OC)c1 ZINC001222259554 802662876 /nfs/dbraw/zinc/66/28/76/802662876.db2.gz SSLKLJBLWLBPBU-KRWDZBQOSA-N 2 2 306.406 2.127 20 10 DECDLP Oc1cc(Cl)ccc1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC001474637413 1060909235 /nfs/dbraw/zinc/90/92/35/1060909235.db2.gz ZQWJNURDWOWBTQ-OAHLLOKOSA-N 2 2 310.825 2.389 20 10 DECDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC001648780004 1075009471 /nfs/dbraw/zinc/00/94/71/1075009471.db2.gz RNKNYRDZPRSBCI-AWEZNQCLSA-N 2 2 318.396 2.037 20 10 DECDLP C[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C[C@@H]1CCC[NH2+]1 ZINC001236119488 1084616078 /nfs/dbraw/zinc/61/60/78/1084616078.db2.gz VGKPJOCGYLSQNA-INIZCTEOSA-N 2 2 315.461 2.275 20 10 DECDLP C[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C[C@@H]1CCC[NH2+]1 ZINC001236119488 1084616084 /nfs/dbraw/zinc/61/60/84/1084616084.db2.gz VGKPJOCGYLSQNA-INIZCTEOSA-N 2 2 315.461 2.275 20 10 DECDLP C[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789840 1141061919 /nfs/dbraw/zinc/06/19/19/1141061919.db2.gz KFKZNZFKCYUKSJ-MAUKXSAKSA-N 2 2 303.450 2.096 20 10 DECDLP C[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789840 1141061929 /nfs/dbraw/zinc/06/19/29/1141061929.db2.gz KFKZNZFKCYUKSJ-MAUKXSAKSA-N 2 2 303.450 2.096 20 10 DECDLP C[N@@H+]1CCC[C@@H](NC2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475700 1143652975 /nfs/dbraw/zinc/65/29/75/1143652975.db2.gz TYKFVLSZUAADBX-QGZVFWFLSA-N 2 2 303.450 2.040 20 10 DECDLP CN1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475700 1143652978 /nfs/dbraw/zinc/65/29/78/1143652978.db2.gz TYKFVLSZUAADBX-QGZVFWFLSA-N 2 2 303.450 2.040 20 10 DECDLP COc1ccc(N2CCC[N@H+](CCCn3cc[nH+]c3)CC2)cc1 ZINC000183164982 402743776 /nfs/dbraw/zinc/74/37/76/402743776.db2.gz REMRCUABJZFREP-UHFFFAOYSA-N 2 2 314.433 2.494 20 10 DECDLP COc1ccc(N2CCC[N@@H+](CCCn3cc[nH+]c3)CC2)cc1 ZINC000183164982 402743780 /nfs/dbraw/zinc/74/37/80/402743780.db2.gz REMRCUABJZFREP-UHFFFAOYSA-N 2 2 314.433 2.494 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000377394611 227189227 /nfs/dbraw/zinc/18/92/27/227189227.db2.gz YDGLKRLAEBMTOG-WDEREUQCSA-N 2 2 314.788 2.138 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000377394611 227189235 /nfs/dbraw/zinc/18/92/35/227189235.db2.gz YDGLKRLAEBMTOG-WDEREUQCSA-N 2 2 314.788 2.138 20 10 DECDLP COc1ccc(N2CCC([NH2+]C[C@H]3CCC[N@@H+]3C)CC2)cc1 ZINC000154572909 524403724 /nfs/dbraw/zinc/40/37/24/524403724.db2.gz YRZXXUDYMSJDIA-QGZVFWFLSA-N 2 2 303.450 2.348 20 10 DECDLP COc1ccc(N2CCC([NH2+]C[C@H]3CCC[N@H+]3C)CC2)cc1 ZINC000154572909 524403731 /nfs/dbraw/zinc/40/37/31/524403731.db2.gz YRZXXUDYMSJDIA-QGZVFWFLSA-N 2 2 303.450 2.348 20 10 DECDLP Oc1c(Br)cccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000841080072 650424740 /nfs/dbraw/zinc/42/47/40/650424740.db2.gz QCQVOUKCCKWWBZ-LBPRGKRZSA-N 2 2 311.223 2.386 20 10 DECDLP COc1c(O)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)ccc1[N+](=O)[O-] ZINC000843046791 650876254 /nfs/dbraw/zinc/87/62/54/650876254.db2.gz CKVHFALAWSKUEA-FUNVUKJBSA-N 2 2 321.377 2.024 20 10 DECDLP COc1c(O)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)ccc1[N+](=O)[O-] ZINC000843046791 650876255 /nfs/dbraw/zinc/87/62/55/650876255.db2.gz CKVHFALAWSKUEA-FUNVUKJBSA-N 2 2 321.377 2.024 20 10 DECDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616376 647035704 /nfs/dbraw/zinc/03/57/04/647035704.db2.gz NEZYHXGQMRTEJH-IINYFYTJSA-N 2 2 318.339 2.128 20 10 DECDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616376 647035707 /nfs/dbraw/zinc/03/57/07/647035707.db2.gz NEZYHXGQMRTEJH-IINYFYTJSA-N 2 2 318.339 2.128 20 10 DECDLP CC[C@H]([NH2+]CCCN1CC[NH2+]CC1)c1cccc(Cl)c1O ZINC000817934676 647386905 /nfs/dbraw/zinc/38/69/05/647386905.db2.gz AMFJRZSFHLWATI-HNNXBMFYSA-N 2 2 311.857 2.382 20 10 DECDLP CCn1cc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000817944196 647389802 /nfs/dbraw/zinc/38/98/02/647389802.db2.gz YAPIECQDNLGXES-DYVFJYSZSA-N 2 2 301.438 2.320 20 10 DECDLP Cc1cc(O)c(C[N@@H+](CCO)C2CC[NH+](C)CC2)cc1Cl ZINC000824473510 648594491 /nfs/dbraw/zinc/59/44/91/648594491.db2.gz BLGBMABLAXPDSL-UHFFFAOYSA-N 2 2 312.841 2.243 20 10 DECDLP Cc1cc(O)c(C[N@H+](CCO)C2CC[NH+](C)CC2)cc1Cl ZINC000824473510 648594494 /nfs/dbraw/zinc/59/44/94/648594494.db2.gz BLGBMABLAXPDSL-UHFFFAOYSA-N 2 2 312.841 2.243 20 10 DECDLP COCCC[NH+]1CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882960787 691397623 /nfs/dbraw/zinc/39/76/23/691397623.db2.gz WCEWSIQFQPHYON-UHFFFAOYSA-N 2 2 314.376 2.261 20 10 DECDLP CCOC1C[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140302086 796503808 /nfs/dbraw/zinc/50/38/08/796503808.db2.gz JNVTUHSMQFYHGN-UHFFFAOYSA-N 2 2 303.450 2.049 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c(Cl)c1 ZINC001206200730 800488363 /nfs/dbraw/zinc/48/83/63/800488363.db2.gz SSJRGIPQRPYPCG-STQMWFEESA-N 2 2 302.777 2.315 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c(Cl)c1 ZINC001206200730 800488367 /nfs/dbraw/zinc/48/83/67/800488367.db2.gz SSJRGIPQRPYPCG-STQMWFEESA-N 2 2 302.777 2.315 20 10 DECDLP CC[NH+]1C[C@H]2C[NH+](Cc3cc(Cl)cc(OC)c3O)C[C@@H]2C1 ZINC001233291404 802066574 /nfs/dbraw/zinc/06/65/74/802066574.db2.gz ZRLXQPLCQYPJJC-STQMWFEESA-N 2 2 310.825 2.438 20 10 DECDLP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccc(Cl)c1O ZINC001276380315 1083746222 /nfs/dbraw/zinc/74/62/22/1083746222.db2.gz OVGULGPXZDGRMN-HOTGVXAUSA-N 2 2 323.868 2.256 20 10 DECDLP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccc(Cl)c1O ZINC001276380315 1083746226 /nfs/dbraw/zinc/74/62/26/1083746226.db2.gz OVGULGPXZDGRMN-HOTGVXAUSA-N 2 2 323.868 2.256 20 10 DECDLP CCN(CC)c1ccc(C[NH+]2CC3(C2)CC[N@H+](C)C3)c(O)c1 ZINC001276133322 1091584881 /nfs/dbraw/zinc/58/48/81/1091584881.db2.gz SPVDSLAHQMGAKD-UHFFFAOYSA-N 2 2 303.450 2.376 20 10 DECDLP CCN(CC)c1ccc(C[NH+]2CC3(C2)CC[N@@H+](C)C3)c(O)c1 ZINC001276133322 1091584887 /nfs/dbraw/zinc/58/48/87/1091584887.db2.gz SPVDSLAHQMGAKD-UHFFFAOYSA-N 2 2 303.450 2.376 20 10 DECDLP COc1cc(C[NH+]2CCC([N@H+](C)C3CC3)CC2)c(O)c(OC)c1 ZINC001237679884 1138756527 /nfs/dbraw/zinc/75/65/27/1138756527.db2.gz GCRYOEVNEIORNO-UHFFFAOYSA-N 2 2 320.433 2.468 20 10 DECDLP COc1cc(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)c(O)c(OC)c1 ZINC001237679884 1138756538 /nfs/dbraw/zinc/75/65/38/1138756538.db2.gz GCRYOEVNEIORNO-UHFFFAOYSA-N 2 2 320.433 2.468 20 10 DECDLP CCOc1ccc(N2CC[NH+](CCc3c[nH+]cn3C)CC2)cc1 ZINC001325501845 1147928997 /nfs/dbraw/zinc/92/89/97/1147928997.db2.gz LCVHSRAIBNEYSI-UHFFFAOYSA-N 2 2 314.433 2.184 20 10 DECDLP COc1c(O)c(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000278390089 402863724 /nfs/dbraw/zinc/86/37/24/402863724.db2.gz MRJXVUAQUVAFFA-ZDUSSCGKSA-N 2 2 323.393 2.225 20 10 DECDLP COc1c(O)c(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000278390089 402863726 /nfs/dbraw/zinc/86/37/26/402863726.db2.gz MRJXVUAQUVAFFA-ZDUSSCGKSA-N 2 2 323.393 2.225 20 10 DECDLP CN(C)c1ccc(C[N@H+](C[C@@H](O)C[NH+](C)C2CC2)C2CC2)cc1 ZINC000289718062 403994956 /nfs/dbraw/zinc/99/49/56/403994956.db2.gz GRLSRINRMWZDHM-IBGZPJMESA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[N@@H+](C[C@@H](O)C[NH+](C)C2CC2)C2CC2)cc1 ZINC000289718062 403994959 /nfs/dbraw/zinc/99/49/59/403994959.db2.gz GRLSRINRMWZDHM-IBGZPJMESA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[NH+](C[C@@H](O)C[N@H+](C)C2CC2)C2CC2)cc1 ZINC000289718062 403994961 /nfs/dbraw/zinc/99/49/61/403994961.db2.gz GRLSRINRMWZDHM-IBGZPJMESA-N 2 2 317.477 2.172 20 10 DECDLP CN(C)c1ccc(C[NH+](C[C@@H](O)C[N@@H+](C)C2CC2)C2CC2)cc1 ZINC000289718062 403994963 /nfs/dbraw/zinc/99/49/63/403994963.db2.gz GRLSRINRMWZDHM-IBGZPJMESA-N 2 2 317.477 2.172 20 10 DECDLP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000296164558 404124856 /nfs/dbraw/zinc/12/48/56/404124856.db2.gz XKJMEBRMVJWYEF-LZWOXQAQSA-N 2 2 304.434 2.468 20 10 DECDLP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000296164558 404124868 /nfs/dbraw/zinc/12/48/68/404124868.db2.gz XKJMEBRMVJWYEF-LZWOXQAQSA-N 2 2 304.434 2.468 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000296617073 404311562 /nfs/dbraw/zinc/31/15/62/404311562.db2.gz WPOIMWVHOQMRSD-PRTUASRFSA-N 2 2 318.417 2.455 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000296617073 404311567 /nfs/dbraw/zinc/31/15/67/404311567.db2.gz WPOIMWVHOQMRSD-PRTUASRFSA-N 2 2 318.417 2.455 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000377394610 227190164 /nfs/dbraw/zinc/19/01/64/227190164.db2.gz YDGLKRLAEBMTOG-QWRGUYRKSA-N 2 2 314.788 2.138 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000377394610 227190171 /nfs/dbraw/zinc/19/01/71/227190171.db2.gz YDGLKRLAEBMTOG-QWRGUYRKSA-N 2 2 314.788 2.138 20 10 DECDLP CC(C)C[C@H]([NH3+])C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000841004412 650404734 /nfs/dbraw/zinc/40/47/34/650404734.db2.gz QMLMIYMGHDDLDV-KRWDZBQOSA-N 2 2 305.466 2.328 20 10 DECDLP CC(C)C[C@H]([NH3+])C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000841004412 650404735 /nfs/dbraw/zinc/40/47/35/650404735.db2.gz QMLMIYMGHDDLDV-KRWDZBQOSA-N 2 2 305.466 2.328 20 10 DECDLP CCCC[C@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841030288 650408801 /nfs/dbraw/zinc/40/88/01/650408801.db2.gz NDWOZNUQIKBOMK-QGZVFWFLSA-N 3 2 304.482 2.046 20 10 DECDLP Oc1ccc(Cl)cc1C[NH2+]C1CCC(N2CC[NH2+]CC2)CC1 ZINC000841086638 650427036 /nfs/dbraw/zinc/42/70/36/650427036.db2.gz BQWBTGAKYHYLRT-UHFFFAOYSA-N 2 2 323.868 2.352 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000756609943 639678917 /nfs/dbraw/zinc/67/89/17/639678917.db2.gz GOSXHKBNZHAVEA-DYEKYZERSA-N 2 2 306.406 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000756609943 639678920 /nfs/dbraw/zinc/67/89/20/639678920.db2.gz GOSXHKBNZHAVEA-DYEKYZERSA-N 2 2 306.406 2.312 20 10 DECDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000817889346 647371268 /nfs/dbraw/zinc/37/12/68/647371268.db2.gz SSUCJHQKFNHMKM-RHSMWYFYSA-N 2 2 305.491 2.327 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCC[NH2+]1 ZINC000817893085 647373934 /nfs/dbraw/zinc/37/39/34/647373934.db2.gz DNICTRBYGNIUFI-SUMWQHHRSA-N 2 2 321.440 2.017 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2([NH3+])CCCCC2)c1 ZINC000817938857 647388096 /nfs/dbraw/zinc/38/80/96/647388096.db2.gz UOZHICWUJHKPMV-GFCCVEGCSA-N 2 2 306.406 2.491 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1cccc(C(F)(F)F)c1O ZINC000817983192 647400622 /nfs/dbraw/zinc/40/06/22/647400622.db2.gz ZCRCKQQNZOWFLU-MNOVXSKESA-N 2 2 318.339 2.440 20 10 DECDLP COc1c(O)c(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000862481940 686307913 /nfs/dbraw/zinc/30/79/13/686307913.db2.gz BIKYFUZVAZSDAC-GFCCVEGCSA-N 2 2 323.393 2.131 20 10 DECDLP COc1c(O)c(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000862481940 686307915 /nfs/dbraw/zinc/30/79/15/686307915.db2.gz BIKYFUZVAZSDAC-GFCCVEGCSA-N 2 2 323.393 2.131 20 10 DECDLP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+]2C)cc1Cn1cccn1 ZINC000873023690 689143554 /nfs/dbraw/zinc/14/35/54/689143554.db2.gz SCRUEJCSGRIVRW-QGZVFWFLSA-N 2 2 314.433 2.124 20 10 DECDLP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+]2C)cc1Cn1cccn1 ZINC000873023690 689143558 /nfs/dbraw/zinc/14/35/58/689143558.db2.gz SCRUEJCSGRIVRW-QGZVFWFLSA-N 2 2 314.433 2.124 20 10 DECDLP Fc1cc(C[NH2+][C@]23CCC[C@@H]2[NH2+]CC3)ccc1N1CCOCC1 ZINC000873229844 689190075 /nfs/dbraw/zinc/19/00/75/689190075.db2.gz HIQFMCYAOODYDL-ROUUACIJSA-N 2 2 319.424 2.037 20 10 DECDLP C[NH+]1CCN(C2CC[NH+](Cc3cc(Cl)ccc3O)CC2)CC1 ZINC000877747368 690213686 /nfs/dbraw/zinc/21/36/86/690213686.db2.gz IIXKFOLROFSSHI-UHFFFAOYSA-N 2 2 323.868 2.257 20 10 DECDLP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1c(O)cccc1F ZINC000886502765 692094844 /nfs/dbraw/zinc/09/48/44/692094844.db2.gz MWTNQARWUSVAEB-AWEZNQCLSA-N 2 2 309.429 2.210 20 10 DECDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925507081 693285698 /nfs/dbraw/zinc/28/56/98/693285698.db2.gz YFCDOVRRERZPPX-BEFAXECRSA-N 2 2 317.477 2.125 20 10 DECDLP CCCOC1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139408884 796373151 /nfs/dbraw/zinc/37/31/51/796373151.db2.gz GURUQTHCQITEEG-UHFFFAOYSA-N 2 2 303.450 2.049 20 10 DECDLP C[NH+]1CCN(C2C[NH+](Cc3cccc(C(C)(C)C)c3O)C2)CC1 ZINC001143116486 796803555 /nfs/dbraw/zinc/80/35/55/796803555.db2.gz DLCROLIVEVWZLC-UHFFFAOYSA-N 2 2 317.477 2.121 20 10 DECDLP [NH3+]C[C@@H]1C[N@H+](Cc2cc(Cl)c(O)cc2O)CCC1(F)F ZINC001205779061 800418619 /nfs/dbraw/zinc/41/86/19/800418619.db2.gz JAORHRZIHZYNGK-SECBINFHSA-N 2 2 306.740 2.167 20 10 DECDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cc(Cl)c(O)cc2O)CCC1(F)F ZINC001205779061 800418621 /nfs/dbraw/zinc/41/86/21/800418621.db2.gz JAORHRZIHZYNGK-SECBINFHSA-N 2 2 306.740 2.167 20 10 DECDLP [NH3+][C@]12CC[C@@H]1C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992596 1084584520 /nfs/dbraw/zinc/58/45/20/1084584520.db2.gz PTUAILVZNVKXLE-RISCZKNCSA-N 2 2 316.323 2.256 20 10 DECDLP [NH3+][C@]12CC[C@@H]1C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992596 1084584525 /nfs/dbraw/zinc/58/45/25/1084584525.db2.gz PTUAILVZNVKXLE-RISCZKNCSA-N 2 2 316.323 2.256 20 10 DECDLP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(O)cccc1F ZINC001276360403 1089510890 /nfs/dbraw/zinc/51/08/90/1089510890.db2.gz SZIYKLRFSGEGTN-GOOCMWNKSA-N 2 2 321.440 2.178 20 10 DECDLP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(O)cccc1F ZINC001276360403 1089510906 /nfs/dbraw/zinc/51/09/06/1089510906.db2.gz SZIYKLRFSGEGTN-GOOCMWNKSA-N 2 2 321.440 2.178 20 10 DECDLP CCc1ccc(C[NH+]2C[C@@H]3C[N@H+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001236790316 1138428218 /nfs/dbraw/zinc/42/82/18/1138428218.db2.gz VWXOVLAYXIMVMV-FUHWJXTLSA-N 2 2 304.434 2.107 20 10 DECDLP CCc1ccc(C[NH+]2C[C@@H]3C[N@@H+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001236790316 1138428220 /nfs/dbraw/zinc/42/82/20/1138428220.db2.gz VWXOVLAYXIMVMV-FUHWJXTLSA-N 2 2 304.434 2.107 20 10 DECDLP CCc1ccc(C[N@@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001236790316 1138428223 /nfs/dbraw/zinc/42/82/23/1138428223.db2.gz VWXOVLAYXIMVMV-FUHWJXTLSA-N 2 2 304.434 2.107 20 10 DECDLP CCc1ccc(C[N@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001236790316 1138428226 /nfs/dbraw/zinc/42/82/26/1138428226.db2.gz VWXOVLAYXIMVMV-FUHWJXTLSA-N 2 2 304.434 2.107 20 10 DECDLP OCCC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001324379094 1142066009 /nfs/dbraw/zinc/06/60/09/1142066009.db2.gz SNDAQZDFRKXBAZ-IBGZPJMESA-N 2 2 317.477 2.223 20 10 DECDLP OCCC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001324379094 1142066012 /nfs/dbraw/zinc/06/60/12/1142066012.db2.gz SNDAQZDFRKXBAZ-IBGZPJMESA-N 2 2 317.477 2.223 20 10 DECDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000093018006 193195253 /nfs/dbraw/zinc/19/52/53/193195253.db2.gz BCZVDSRCUKDRCR-MRXNPFEDSA-N 2 2 304.434 2.245 20 10 DECDLP Cc1ccc(O)c(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000093018006 193195255 /nfs/dbraw/zinc/19/52/55/193195255.db2.gz BCZVDSRCUKDRCR-MRXNPFEDSA-N 2 2 304.434 2.245 20 10 DECDLP Cc1nc(N2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)cc[nH+]1 ZINC000184765984 402298233 /nfs/dbraw/zinc/29/82/33/402298233.db2.gz HKEXRDOERWDLTM-UHFFFAOYSA-N 2 2 311.433 2.173 20 10 DECDLP C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)CN1CC[NH+](C)CC1 ZINC000185343824 402345460 /nfs/dbraw/zinc/34/54/60/402345460.db2.gz YJCKBEWUQORPNW-KGLIPLIRSA-N 2 2 309.429 2.065 20 10 DECDLP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278332496 402862858 /nfs/dbraw/zinc/86/28/58/402862858.db2.gz ZIYOWBOWGGOASO-GFCCVEGCSA-N 2 2 323.393 2.083 20 10 DECDLP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278332496 402862859 /nfs/dbraw/zinc/86/28/59/402862859.db2.gz ZIYOWBOWGGOASO-GFCCVEGCSA-N 2 2 323.393 2.083 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365583 402998223 /nfs/dbraw/zinc/99/82/23/402998223.db2.gz BJFVIMUJTBWMNI-GOEBONIOSA-N 2 2 313.445 2.442 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1ccc2ccccc2c1O ZINC000273365583 402998225 /nfs/dbraw/zinc/99/82/25/402998225.db2.gz BJFVIMUJTBWMNI-GOEBONIOSA-N 2 2 313.445 2.442 20 10 DECDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](C)CCN2C)cc1 ZINC000268908222 403121379 /nfs/dbraw/zinc/12/13/79/403121379.db2.gz MJCZUCVQHVATSJ-CRAIPNDOSA-N 2 2 304.482 2.039 20 10 DECDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@@H+](C)CCN2C)cc1 ZINC000268908222 403121381 /nfs/dbraw/zinc/12/13/81/403121381.db2.gz MJCZUCVQHVATSJ-CRAIPNDOSA-N 2 2 304.482 2.039 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(F)cc1O ZINC000367588253 405095368 /nfs/dbraw/zinc/09/53/68/405095368.db2.gz LRJKQWFHWLRLMT-LZWOXQAQSA-N 2 2 308.397 2.435 20 10 DECDLP CC[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(F)cc1O ZINC000367588253 405095371 /nfs/dbraw/zinc/09/53/71/405095371.db2.gz LRJKQWFHWLRLMT-LZWOXQAQSA-N 2 2 308.397 2.435 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540517 227013373 /nfs/dbraw/zinc/01/33/73/227013373.db2.gz YKJGEMCTLSWMEL-QGTPRVQTSA-N 2 2 303.450 2.266 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540517 227013378 /nfs/dbraw/zinc/01/33/78/227013378.db2.gz YKJGEMCTLSWMEL-QGTPRVQTSA-N 2 2 303.450 2.266 20 10 DECDLP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000286323380 288042898 /nfs/dbraw/zinc/04/28/98/288042898.db2.gz XQRXDSDKSRMYDR-PBHICJAKSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCOCC2)cc1 ZINC000155628325 525375587 /nfs/dbraw/zinc/37/55/87/525375587.db2.gz XBSRWRGSWUMDRG-HNNXBMFYSA-N 2 2 300.406 2.071 20 10 DECDLP COc1cccc(O)c1C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044002 650412688 /nfs/dbraw/zinc/41/26/88/650412688.db2.gz SPHHQWJSFATYLG-MRXNPFEDSA-N 2 2 315.417 2.256 20 10 DECDLP COC[C@@]1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CCC[NH2+]1 ZINC000841067908 650421030 /nfs/dbraw/zinc/42/10/30/650421030.db2.gz QMCBIMPSDNJPEN-JXTAAOLFSA-N 2 2 303.450 2.124 20 10 DECDLP COCC1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC[NH2+]CC1 ZINC000841067956 650421102 /nfs/dbraw/zinc/42/11/02/650421102.db2.gz IAKHAIZWBUCSNI-UHFFFAOYSA-N 2 2 316.804 2.291 20 10 DECDLP CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2C[NH2+]CCO2)cc1 ZINC000841099631 650430666 /nfs/dbraw/zinc/43/06/66/650430666.db2.gz UISRJXMBFXRYMX-SFHVURJKSA-N 2 2 305.466 2.391 20 10 DECDLP COc1c(O)c(C[NH2+]CCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000774958385 641987081 /nfs/dbraw/zinc/98/70/81/641987081.db2.gz XSDMVHISTSINOR-UHFFFAOYSA-N 2 2 323.393 2.275 20 10 DECDLP [NH3+][C@@H]1C[N@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1c1ccccc1 ZINC000843113800 650898170 /nfs/dbraw/zinc/89/81/70/650898170.db2.gz DOTNODDWRLKVDC-LSDHHAIUSA-N 2 2 312.369 2.048 20 10 DECDLP [NH3+][C@@H]1C[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1c1ccccc1 ZINC000843113800 650898171 /nfs/dbraw/zinc/89/81/71/650898171.db2.gz DOTNODDWRLKVDC-LSDHHAIUSA-N 2 2 312.369 2.048 20 10 DECDLP COc1ccc(C[NH2+]Cc2ncc(C[NH+](C)C)s2)c(O)c1 ZINC000809658011 646259711 /nfs/dbraw/zinc/25/97/11/646259711.db2.gz ALCSRSPYYSTQHK-UHFFFAOYSA-N 2 2 307.419 2.209 20 10 DECDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616378 647035944 /nfs/dbraw/zinc/03/59/44/647035944.db2.gz NEZYHXGQMRTEJH-YGRLFVJLSA-N 2 2 318.339 2.128 20 10 DECDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616378 647035949 /nfs/dbraw/zinc/03/59/49/647035949.db2.gz NEZYHXGQMRTEJH-YGRLFVJLSA-N 2 2 318.339 2.128 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1 ZINC000817887869 647371566 /nfs/dbraw/zinc/37/15/66/647371566.db2.gz GHHKISRPEPCCOZ-MOPGFXCFSA-N 2 2 317.477 2.389 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817895829 647375353 /nfs/dbraw/zinc/37/53/53/647375353.db2.gz WTUVTEMEOXWDNJ-BEFAXECRSA-N 2 2 317.477 2.125 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCc3c2cnn3C)cc1 ZINC000817938000 647387770 /nfs/dbraw/zinc/38/77/70/647387770.db2.gz BBFWWASEMCIXRY-SJORKVTESA-N 2 2 313.449 2.153 20 10 DECDLP C[C@@H](C[NH2+][C@@H](C)c1c(O)cccc1F)CN1CC[NH+](C)CC1 ZINC000886522268 692100785 /nfs/dbraw/zinc/10/07/85/692100785.db2.gz GFFSPFVFDLDVMX-KBPBESRZSA-N 2 2 309.429 2.065 20 10 DECDLP CC[N@H+](C)C1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001138500015 796228421 /nfs/dbraw/zinc/22/84/21/796228421.db2.gz RIAUOJYBFYYTBQ-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP CC[N@@H+](C)C1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001138500015 796228424 /nfs/dbraw/zinc/22/84/24/796228424.db2.gz RIAUOJYBFYYTBQ-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP [NH3+][C@]12CC[C@H]1C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992592 1084583529 /nfs/dbraw/zinc/58/35/29/1084583529.db2.gz PTUAILVZNVKXLE-FZMZJTMJSA-N 2 2 316.323 2.256 20 10 DECDLP [NH3+][C@]12CC[C@H]1C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001235992592 1084583533 /nfs/dbraw/zinc/58/35/33/1084583533.db2.gz PTUAILVZNVKXLE-FZMZJTMJSA-N 2 2 316.323 2.256 20 10 DECDLP CC[NH+]1C[C@H]2C[NH+](Cc3c(O)cc(OC)cc3Cl)C[C@@H]2C1 ZINC001236806540 1138432703 /nfs/dbraw/zinc/43/27/03/1138432703.db2.gz YCCJTXMBTQZERQ-RYUDHWBXSA-N 2 2 310.825 2.438 20 10 DECDLP C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1n1cc[nH+]c1 ZINC000246676678 402540382 /nfs/dbraw/zinc/54/03/82/402540382.db2.gz QSVCFCBOYXSXPM-TZMCWYRMSA-N 2 2 315.373 2.401 20 10 DECDLP C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1n1cc[nH+]c1 ZINC000246676678 402540386 /nfs/dbraw/zinc/54/03/86/402540386.db2.gz QSVCFCBOYXSXPM-TZMCWYRMSA-N 2 2 315.373 2.401 20 10 DECDLP COc1c(O)c(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000278323691 402862934 /nfs/dbraw/zinc/86/29/34/402862934.db2.gz YNNGFMAIZSUWLX-GFCCVEGCSA-N 2 2 323.393 2.083 20 10 DECDLP COc1c(O)c(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000278323691 402862937 /nfs/dbraw/zinc/86/29/37/402862937.db2.gz YNNGFMAIZSUWLX-GFCCVEGCSA-N 2 2 323.393 2.083 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903969702 643530125 /nfs/dbraw/zinc/53/01/25/643530125.db2.gz JKQQKAPTCREBIR-KRWDZBQOSA-N 2 2 317.477 2.309 20 10 DECDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046163 650876469 /nfs/dbraw/zinc/87/64/69/650876469.db2.gz PAKCEBLVVXIDPJ-APWZRJJASA-N 3 2 316.493 2.140 20 10 DECDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046163 650876470 /nfs/dbraw/zinc/87/64/70/650876470.db2.gz PAKCEBLVVXIDPJ-APWZRJJASA-N 3 2 316.493 2.140 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1O ZINC000843368644 650959445 /nfs/dbraw/zinc/95/94/45/650959445.db2.gz PYLSNTYRUFAZQL-XZJROXQQSA-N 2 2 306.381 2.293 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1O ZINC000843368644 650959447 /nfs/dbraw/zinc/95/94/47/650959447.db2.gz PYLSNTYRUFAZQL-XZJROXQQSA-N 2 2 306.381 2.293 20 10 DECDLP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](O)C[NH+]2CCCC2)c1O ZINC000808680183 646126958 /nfs/dbraw/zinc/12/69/58/646126958.db2.gz JBKKPOMTHHTESQ-GXTWGEPZSA-N 2 2 312.841 2.461 20 10 DECDLP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](O)C[NH+]2CCCC2)c1O ZINC000808680186 646127354 /nfs/dbraw/zinc/12/73/54/646127354.db2.gz JBKKPOMTHHTESQ-JSGCOSHPSA-N 2 2 312.841 2.461 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@@H](C)C[C@H]2COCC[NH2+]2)cc1 ZINC000817890143 647371724 /nfs/dbraw/zinc/37/17/24/647371724.db2.gz XEHLZKCHVVMFKU-RDJZCZTQSA-N 2 2 305.466 2.389 20 10 DECDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000925474400 648194809 /nfs/dbraw/zinc/19/48/09/648194809.db2.gz JEQPYOVHGBTBEW-MRXNPFEDSA-N 2 2 305.491 2.470 20 10 DECDLP Oc1ccc(Cl)cc1C[NH+]1CCC([N@@H+]2CC[C@H](O)C2)CC1 ZINC000827701023 649071035 /nfs/dbraw/zinc/07/10/35/649071035.db2.gz ZMKYOKGYURGEEU-HNNXBMFYSA-N 2 2 310.825 2.077 20 10 DECDLP Oc1ccc(Cl)cc1C[NH+]1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000827701023 649071041 /nfs/dbraw/zinc/07/10/41/649071041.db2.gz ZMKYOKGYURGEEU-HNNXBMFYSA-N 2 2 310.825 2.077 20 10 DECDLP CC(C)[NH2+]C1(CO)CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000846935513 651362914 /nfs/dbraw/zinc/36/29/14/651362914.db2.gz GGJHFEJLXIKGHV-UHFFFAOYSA-N 2 2 305.466 2.078 20 10 DECDLP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1cc(F)ccc1O ZINC000850558047 651953047 /nfs/dbraw/zinc/95/30/47/651953047.db2.gz SGTBBLOEAVXDCA-DOMZBBRYSA-N 2 2 308.397 2.435 20 10 DECDLP CN(C)c1cc(F)c(C[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)cc1F ZINC000858165859 652270614 /nfs/dbraw/zinc/27/06/14/652270614.db2.gz PESILCDQRISUQU-NSHDSACASA-N 2 2 306.360 2.401 20 10 DECDLP Fc1cc(C[NH2+][C@@]23CCC[C@@H]2[NH2+]CC3)ccc1N1CCOCC1 ZINC000873229845 689190275 /nfs/dbraw/zinc/19/02/75/689190275.db2.gz HIQFMCYAOODYDL-ZWKOTPCHSA-N 2 2 319.424 2.037 20 10 DECDLP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1c(O)cccc1F ZINC000886502766 692095124 /nfs/dbraw/zinc/09/51/24/692095124.db2.gz MWTNQARWUSVAEB-CQSZACIVSA-N 2 2 309.429 2.210 20 10 DECDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925505146 693285255 /nfs/dbraw/zinc/28/52/55/693285255.db2.gz REELQWUOMUFPCL-GOSISDBHSA-N 2 2 317.477 2.125 20 10 DECDLP CCOc1ccc(N2CC[NH+](CCCn3cc[nH+]c3)CC2)cc1 ZINC001116474764 794958633 /nfs/dbraw/zinc/95/86/33/794958633.db2.gz JJXHBBDCEREXMP-UHFFFAOYSA-N 2 2 314.433 2.494 20 10 DECDLP COc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc(C[NH+](C)C)c1O ZINC001139253982 796349945 /nfs/dbraw/zinc/34/99/45/796349945.db2.gz ADUJYHNBKWZCTJ-AEGPPILISA-N 2 2 308.397 2.252 20 10 DECDLP COc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc(C[NH+](C)C)c1O ZINC001139253982 796349951 /nfs/dbraw/zinc/34/99/51/796349951.db2.gz ADUJYHNBKWZCTJ-AEGPPILISA-N 2 2 308.397 2.252 20 10 DECDLP C[NH+]1CCN(C2CC[NH+](Cc3ccc(Cl)cc3O)CC2)CC1 ZINC001140465547 796525429 /nfs/dbraw/zinc/52/54/29/796525429.db2.gz PWJQXHCTCOCZPN-UHFFFAOYSA-N 2 2 323.868 2.257 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001231857477 801738338 /nfs/dbraw/zinc/73/83/38/801738338.db2.gz KPBAIPUXAWFOCI-CRAIPNDOSA-N 2 2 303.450 2.145 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001231857477 801738339 /nfs/dbraw/zinc/73/83/39/801738339.db2.gz KPBAIPUXAWFOCI-CRAIPNDOSA-N 2 2 303.450 2.145 20 10 DECDLP Oc1ccc(F)c(F)c1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001233332028 802078423 /nfs/dbraw/zinc/07/84/23/802078423.db2.gz VFPZYLPJAXWASA-UHFFFAOYSA-N 2 2 305.328 2.388 20 10 DECDLP COCCC[N@H+](Cc1cc(F)cc(C)c1O)[C@H]1CCC[NH2+]C1 ZINC001235808520 1084535281 /nfs/dbraw/zinc/53/52/81/1084535281.db2.gz DPECTVLSNNYZAH-INIZCTEOSA-N 2 2 310.413 2.430 20 10 DECDLP COCCC[N@@H+](Cc1cc(F)cc(C)c1O)[C@H]1CCC[NH2+]C1 ZINC001235808520 1084535289 /nfs/dbraw/zinc/53/52/89/1084535289.db2.gz DPECTVLSNNYZAH-INIZCTEOSA-N 2 2 310.413 2.430 20 10 DECDLP COc1c(O)c(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510724 286186711 /nfs/dbraw/zinc/18/67/11/286186711.db2.gz POEOHDFYNMTHIU-WCQYABFASA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510724 286186712 /nfs/dbraw/zinc/18/67/12/286186712.db2.gz POEOHDFYNMTHIU-WCQYABFASA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510724 286186713 /nfs/dbraw/zinc/18/67/13/286186713.db2.gz POEOHDFYNMTHIU-WCQYABFASA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000290510724 286186714 /nfs/dbraw/zinc/18/67/14/286186714.db2.gz POEOHDFYNMTHIU-WCQYABFASA-N 2 2 323.393 2.081 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@H+](C)CCCO)CC2)cc1F ZINC000126318123 402275075 /nfs/dbraw/zinc/27/50/75/402275075.db2.gz WHXOTXBTYMJYAZ-UHFFFAOYSA-N 2 2 323.456 2.170 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC([N@@H+](C)CCCO)CC2)cc1F ZINC000126318123 402275080 /nfs/dbraw/zinc/27/50/80/402275080.db2.gz WHXOTXBTYMJYAZ-UHFFFAOYSA-N 2 2 323.456 2.170 20 10 DECDLP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905398 403120627 /nfs/dbraw/zinc/12/06/27/403120627.db2.gz LSMMOVHZADFFMH-QZTJIDSGSA-N 2 2 304.482 2.039 20 10 DECDLP CC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905398 403120629 /nfs/dbraw/zinc/12/06/29/403120629.db2.gz LSMMOVHZADFFMH-QZTJIDSGSA-N 2 2 304.482 2.039 20 10 DECDLP COCC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921667289 634317408 /nfs/dbraw/zinc/31/74/08/634317408.db2.gz OHSGHYMJOQUQMQ-KRWDZBQOSA-N 2 2 304.434 2.212 20 10 DECDLP COCC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921667289 634317411 /nfs/dbraw/zinc/31/74/11/634317411.db2.gz OHSGHYMJOQUQMQ-KRWDZBQOSA-N 2 2 304.434 2.212 20 10 DECDLP CCN(C)c1ccc(C[NH+]2CCC([N@H+](C)CCCO)CC2)cc1 ZINC000773756014 641819677 /nfs/dbraw/zinc/81/96/77/641819677.db2.gz WIVZQHNUZKAFEN-UHFFFAOYSA-N 2 2 319.493 2.421 20 10 DECDLP CCN(C)c1ccc(C[NH+]2CCC([N@@H+](C)CCCO)CC2)cc1 ZINC000773756014 641819682 /nfs/dbraw/zinc/81/96/82/641819682.db2.gz WIVZQHNUZKAFEN-UHFFFAOYSA-N 2 2 319.493 2.421 20 10 DECDLP COc1cccc(O)c1C[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000789767983 643771942 /nfs/dbraw/zinc/77/19/42/643771942.db2.gz DRMMXZKJURXORC-CQSZACIVSA-N 2 2 300.358 2.449 20 10 DECDLP COc1cccc(O)c1C[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000789767983 643771951 /nfs/dbraw/zinc/77/19/51/643771951.db2.gz DRMMXZKJURXORC-CQSZACIVSA-N 2 2 300.358 2.449 20 10 DECDLP CC[C@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810216214 646340085 /nfs/dbraw/zinc/34/00/85/646340085.db2.gz FUHSPPDKVNRHJM-YPMHNXCESA-N 2 2 320.355 2.374 20 10 DECDLP CC(C)[C@H](Cn1cccn1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940256 647387714 /nfs/dbraw/zinc/38/77/14/647387714.db2.gz FBSIKVMKYSNZNP-MSOLQXFVSA-N 2 2 315.465 2.263 20 10 DECDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817967492 647395470 /nfs/dbraw/zinc/39/54/70/647395470.db2.gz JMIDOYAWODKPIP-KEYYUXOJSA-N 2 2 321.440 2.311 20 10 DECDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817967493 647396147 /nfs/dbraw/zinc/39/61/47/647396147.db2.gz JMIDOYAWODKPIP-ZQIUZPCESA-N 2 2 321.440 2.311 20 10 DECDLP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Br)c(F)cc1O ZINC000817977662 647398571 /nfs/dbraw/zinc/39/85/71/647398571.db2.gz NNBMZCYHXSDSOW-WRNXMPKJSA-N 2 2 315.186 2.162 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1cccc(C(F)(F)F)c1O ZINC000817983193 647400770 /nfs/dbraw/zinc/40/07/70/647400770.db2.gz ZCRCKQQNZOWFLU-QWRGUYRKSA-N 2 2 318.339 2.440 20 10 DECDLP COCC[NH2+]C1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000844900517 651180698 /nfs/dbraw/zinc/18/06/98/651180698.db2.gz QCRDHTNWDRNZGX-PLNGDYQASA-N 2 2 317.477 2.466 20 10 DECDLP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1cc(F)ccc1O ZINC000850558051 651952431 /nfs/dbraw/zinc/95/24/31/651952431.db2.gz SGTBBLOEAVXDCA-IUODEOHRSA-N 2 2 308.397 2.435 20 10 DECDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1cc(F)ccc1O ZINC000850558054 651952748 /nfs/dbraw/zinc/95/27/48/651952748.db2.gz SGTBBLOEAVXDCA-SWLSCSKDSA-N 2 2 308.397 2.435 20 10 DECDLP CC[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cccc(Cl)c1O ZINC000854231224 652662446 /nfs/dbraw/zinc/66/24/46/652662446.db2.gz CQLQYCYNCDERMA-LBPRGKRZSA-N 2 2 322.796 2.241 20 10 DECDLP [NH3+][C@@H]1CCCCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000873215639 689186102 /nfs/dbraw/zinc/18/61/02/689186102.db2.gz JSZUSWMSHJANPN-MRXNPFEDSA-N 2 2 321.440 2.366 20 10 DECDLP [NH3+][C@@H]1CCCCC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000873215639 689186104 /nfs/dbraw/zinc/18/61/04/689186104.db2.gz JSZUSWMSHJANPN-MRXNPFEDSA-N 2 2 321.440 2.366 20 10 DECDLP OC1CCN(c2ccc(C[NH2+]CCCn3cc[nH+]c3)cc2)CC1 ZINC000876886000 689964576 /nfs/dbraw/zinc/96/45/76/689964576.db2.gz QICKGSBUGWVJSB-UHFFFAOYSA-N 2 2 314.433 2.024 20 10 DECDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876930314 689975459 /nfs/dbraw/zinc/97/54/59/689975459.db2.gz VGZICNQPEVNJBR-OAHLLOKOSA-N 2 2 314.433 2.023 20 10 DECDLP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c(O)c1 ZINC000877619877 690169597 /nfs/dbraw/zinc/16/95/97/690169597.db2.gz BADLINYDZBZNLW-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c(O)c1 ZINC000877619877 690169601 /nfs/dbraw/zinc/16/96/01/690169601.db2.gz BADLINYDZBZNLW-QGZVFWFLSA-N 2 2 304.434 2.387 20 10 DECDLP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c(O)c1Cl ZINC001206201586 793733864 /nfs/dbraw/zinc/73/38/64/793733864.db2.gz XXOHHHZBHMNSPE-GHMZBOCLSA-N 2 2 302.777 2.315 20 10 DECDLP COc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c(O)c1Cl ZINC001206201586 793733868 /nfs/dbraw/zinc/73/38/68/793733868.db2.gz XXOHHHZBHMNSPE-GHMZBOCLSA-N 2 2 302.777 2.315 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC001138499823 796228637 /nfs/dbraw/zinc/22/86/37/796228637.db2.gz KKLFZBBMOCWERT-UHFFFAOYSA-N 2 2 314.433 2.242 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC001138499823 796228640 /nfs/dbraw/zinc/22/86/40/796228640.db2.gz KKLFZBBMOCWERT-UHFFFAOYSA-N 2 2 314.433 2.242 20 10 DECDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500282 796228774 /nfs/dbraw/zinc/22/87/74/796228774.db2.gz WBKJXZDQOBQYPH-MJGOQNOKSA-N 2 2 315.461 2.049 20 10 DECDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500282 796228776 /nfs/dbraw/zinc/22/87/76/796228776.db2.gz WBKJXZDQOBQYPH-MJGOQNOKSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500282 796228781 /nfs/dbraw/zinc/22/87/81/796228781.db2.gz WBKJXZDQOBQYPH-MJGOQNOKSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500282 796228783 /nfs/dbraw/zinc/22/87/83/796228783.db2.gz WBKJXZDQOBQYPH-MJGOQNOKSA-N 2 2 315.461 2.049 20 10 DECDLP [NH3+][C@H]1CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205123427 800299657 /nfs/dbraw/zinc/29/96/57/800299657.db2.gz AWRJQISTIYNTAU-JTQLQIEISA-N 2 2 315.211 2.174 20 10 DECDLP [NH3+][C@H]1CCC[N@@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205123427 800299664 /nfs/dbraw/zinc/29/96/64/800299664.db2.gz AWRJQISTIYNTAU-JTQLQIEISA-N 2 2 315.211 2.174 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@](F)(C[NH3+])C1 ZINC001206361231 800517644 /nfs/dbraw/zinc/51/76/44/800517644.db2.gz GUCJIMZMDPXLGT-KRWDZBQOSA-N 2 2 309.429 2.414 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCCC[C@](F)(C[NH3+])C1 ZINC001206361231 800517645 /nfs/dbraw/zinc/51/76/45/800517645.db2.gz GUCJIMZMDPXLGT-KRWDZBQOSA-N 2 2 309.429 2.414 20 10 DECDLP CCCC[NH+]1CCC([N@H+](C)Cc2cc(O)c(O)c(O)c2)CC1 ZINC001233014954 802003469 /nfs/dbraw/zinc/00/34/69/802003469.db2.gz CFEWSHJZLLHANH-UHFFFAOYSA-N 2 2 308.422 2.500 20 10 DECDLP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(O)c(O)c(O)c2)CC1 ZINC001233014954 802003477 /nfs/dbraw/zinc/00/34/77/802003477.db2.gz CFEWSHJZLLHANH-UHFFFAOYSA-N 2 2 308.422 2.500 20 10 DECDLP CN1CCOc2cc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)ccc21 ZINC001222247675 802661215 /nfs/dbraw/zinc/66/12/15/802661215.db2.gz HVZMMGVLABKTGC-SFHVURJKSA-N 2 2 301.434 2.233 20 10 DECDLP CN1CCOc2cc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)ccc21 ZINC001222247675 802661219 /nfs/dbraw/zinc/66/12/19/802661219.db2.gz HVZMMGVLABKTGC-SFHVURJKSA-N 2 2 301.434 2.233 20 10 DECDLP C[C@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001474030689 1060799337 /nfs/dbraw/zinc/79/93/37/1060799337.db2.gz LWYNXCVXJBTYRP-INIZCTEOSA-N 2 2 303.450 2.097 20 10 DECDLP C[C@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC001474030689 1060799352 /nfs/dbraw/zinc/79/93/52/1060799352.db2.gz LWYNXCVXJBTYRP-INIZCTEOSA-N 2 2 303.450 2.097 20 10 DECDLP C[N@@H+]1CCc2ncnc(N3C[C@@H](CC[NH3+])c4ccccc43)c2C1 ZINC001168544458 1083818870 /nfs/dbraw/zinc/81/88/70/1083818870.db2.gz PGRJDAHZFKJJNK-CYBMUJFWSA-N 2 2 309.417 2.049 20 10 DECDLP C[N@H+]1CCc2ncnc(N3C[C@@H](CC[NH3+])c4ccccc43)c2C1 ZINC001168544458 1083818879 /nfs/dbraw/zinc/81/88/79/1083818879.db2.gz PGRJDAHZFKJJNK-CYBMUJFWSA-N 2 2 309.417 2.049 20 10 DECDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275277031 1091651230 /nfs/dbraw/zinc/65/12/30/1091651230.db2.gz RTZRHWAIBWHYOL-UHFFFAOYSA-N 2 2 323.868 2.115 20 10 DECDLP CC(C)[N@H+](Cc1ccc2c(c1)OCCN2C)[C@@H]1CCC[NH2+]C1 ZINC001236467818 1138366561 /nfs/dbraw/zinc/36/65/61/1138366561.db2.gz KEQZZOJFISKJJT-MRXNPFEDSA-N 2 2 303.450 2.478 20 10 DECDLP CC(C)[N@@H+](Cc1ccc2c(c1)OCCN2C)[C@@H]1CCC[NH2+]C1 ZINC001236467818 1138366565 /nfs/dbraw/zinc/36/65/65/1138366565.db2.gz KEQZZOJFISKJJT-MRXNPFEDSA-N 2 2 303.450 2.478 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@H]3CCC[N@@H+]3C)CC2)cc1F ZINC000125177100 402217597 /nfs/dbraw/zinc/21/75/97/402217597.db2.gz GJXFQOVYUHLAQO-OAHLLOKOSA-N 2 2 321.440 2.441 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@H]3CCC[N@H+]3C)CC2)cc1F ZINC000125177100 402217601 /nfs/dbraw/zinc/21/76/01/402217601.db2.gz GJXFQOVYUHLAQO-OAHLLOKOSA-N 2 2 321.440 2.441 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000423083696 230344243 /nfs/dbraw/zinc/34/42/43/230344243.db2.gz GISHGMGDTBUDET-RTBURBONSA-N 2 2 313.445 2.343 20 10 DECDLP CC[C@H]([NH3+])C[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000841072949 650422138 /nfs/dbraw/zinc/42/21/38/650422138.db2.gz SUYHMWAMPGVJRD-AWEZNQCLSA-N 2 2 306.410 2.412 20 10 DECDLP COc1cc(Cl)cc(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000779194142 642471173 /nfs/dbraw/zinc/47/11/73/642471173.db2.gz WBUPJTIFCAMBHB-GFCCVEGCSA-N 2 2 307.781 2.355 20 10 DECDLP COc1c(O)c(C[N@H+](C2CC2)C2CC[NH2+]CC2)ccc1[N+](=O)[O-] ZINC000843044079 650875670 /nfs/dbraw/zinc/87/56/70/650875670.db2.gz SFNDFBGIYVADKX-UHFFFAOYSA-N 2 2 321.377 2.025 20 10 DECDLP COc1c(O)c(C[N@@H+](C2CC2)C2CC[NH2+]CC2)ccc1[N+](=O)[O-] ZINC000843044079 650875672 /nfs/dbraw/zinc/87/56/72/650875672.db2.gz SFNDFBGIYVADKX-UHFFFAOYSA-N 2 2 321.377 2.025 20 10 DECDLP C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892846 647374024 /nfs/dbraw/zinc/37/40/24/647374024.db2.gz WERZZUVMYDRIFX-RVKKMQEKSA-N 2 2 303.450 2.314 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817895832 647375064 /nfs/dbraw/zinc/37/50/64/647375064.db2.gz WTUVTEMEOXWDNJ-KXBFYZLASA-N 2 2 317.477 2.125 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCc3c2cnn3C)cc1 ZINC000817937997 647388017 /nfs/dbraw/zinc/38/80/17/647388017.db2.gz BBFWWASEMCIXRY-DLBZAZTESA-N 2 2 313.449 2.153 20 10 DECDLP C[C@@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817941543 647388929 /nfs/dbraw/zinc/38/89/29/647388929.db2.gz RJADSRIUUFLAJM-UKRRQHHQSA-N 2 2 307.413 2.065 20 10 DECDLP C[C@@H]([NH2+][C@H]1CCCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817984464 647400786 /nfs/dbraw/zinc/40/07/86/647400786.db2.gz TWAHGSOEIXVVFO-ZBFHGGJFSA-N 2 2 321.440 2.455 20 10 DECDLP Cn1cc[nH+]c1N1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000827891360 649099765 /nfs/dbraw/zinc/09/97/65/649099765.db2.gz IUEWMVCGEPPVCL-UHFFFAOYSA-N 2 2 306.797 2.101 20 10 DECDLP COc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930207 651565314 /nfs/dbraw/zinc/56/53/14/651565314.db2.gz OFUYMGGEOJEILA-INIZCTEOSA-N 2 2 320.433 2.088 20 10 DECDLP COc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930207 651565320 /nfs/dbraw/zinc/56/53/20/651565320.db2.gz OFUYMGGEOJEILA-INIZCTEOSA-N 2 2 320.433 2.088 20 10 DECDLP COc1cc(Br)cc(C[NH2+][C@@H]2CC[NH2+][C@H]2C)c1O ZINC000863487121 686508603 /nfs/dbraw/zinc/50/86/03/686508603.db2.gz JUYVQOGQLGGCQD-GZMMTYOYSA-N 2 2 315.211 2.003 20 10 DECDLP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1c(O)cccc1F ZINC000886522919 692100587 /nfs/dbraw/zinc/10/05/87/692100587.db2.gz TUJBVAJYTWAMIJ-CQSZACIVSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1c(O)cccc1F ZINC000886522919 692100589 /nfs/dbraw/zinc/10/05/89/692100589.db2.gz TUJBVAJYTWAMIJ-CQSZACIVSA-N 2 2 323.456 2.456 20 10 DECDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925507082 693285634 /nfs/dbraw/zinc/28/56/34/693285634.db2.gz YFCDOVRRERZPPX-DNVCBOLYSA-N 2 2 317.477 2.125 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1c(O)cc(OC)cc1OC ZINC001141030644 796621138 /nfs/dbraw/zinc/62/11/38/796621138.db2.gz FFFOIQXJHRUBHG-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1c(O)cc(OC)cc1OC ZINC001141030644 796621140 /nfs/dbraw/zinc/62/11/40/796621140.db2.gz FFFOIQXJHRUBHG-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@@H]2C1 ZINC001203552070 800078742 /nfs/dbraw/zinc/07/87/42/800078742.db2.gz ZATXOYSUKBDMRF-QZTJIDSGSA-N 2 2 309.413 2.351 20 10 DECDLP COCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC001203932789 800147861 /nfs/dbraw/zinc/14/78/61/800147861.db2.gz CSFLYNJPQNSCKK-UHFFFAOYSA-N 2 2 305.466 2.295 20 10 DECDLP COCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC001203932789 800147865 /nfs/dbraw/zinc/14/78/65/800147865.db2.gz CSFLYNJPQNSCKK-UHFFFAOYSA-N 2 2 305.466 2.295 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@H+](C)CCN2C)c1 ZINC001462598853 1058858345 /nfs/dbraw/zinc/85/83/45/1058858345.db2.gz YOJWYIAANBFLCW-WMLDXEAASA-N 2 2 305.466 2.240 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c1 ZINC001462598853 1058858366 /nfs/dbraw/zinc/85/83/66/1058858366.db2.gz YOJWYIAANBFLCW-WMLDXEAASA-N 2 2 305.466 2.240 20 10 DECDLP COCC[C@@H]([NH3+])C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001579000092 1067217517 /nfs/dbraw/zinc/21/75/17/1067217517.db2.gz OFEGIMKVXDEJHC-QGZVFWFLSA-N 2 2 305.466 2.473 20 10 DECDLP COCC[C@@H]([NH3+])C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001579000092 1067217523 /nfs/dbraw/zinc/21/75/23/1067217523.db2.gz OFEGIMKVXDEJHC-QGZVFWFLSA-N 2 2 305.466 2.473 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@H](C)[C@H]2C[N@H+](C)CCN2C)cc1Cl ZINC001660047243 1080260579 /nfs/dbraw/zinc/26/05/79/1080260579.db2.gz HMOWUXZTAPESSE-IUODEOHRSA-N 2 2 311.857 2.078 20 10 DECDLP Cc1cc(O)c(C[NH2+][C@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1Cl ZINC001660047243 1080260582 /nfs/dbraw/zinc/26/05/82/1080260582.db2.gz HMOWUXZTAPESSE-IUODEOHRSA-N 2 2 311.857 2.078 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000840933986 634780014 /nfs/dbraw/zinc/78/00/14/634780014.db2.gz LJXWOJODEMQPEX-QZTJIDSGSA-N 2 2 303.450 2.014 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000840933986 634780017 /nfs/dbraw/zinc/78/00/17/634780017.db2.gz LJXWOJODEMQPEX-QZTJIDSGSA-N 2 2 303.450 2.014 20 10 DECDLP CCO[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)C[NH+](C)C ZINC000922753047 636375676 /nfs/dbraw/zinc/37/56/76/636375676.db2.gz BSABYDLUBUCNTI-DVBCCOPCSA-N 2 2 305.466 2.322 20 10 DECDLP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774991146 641990913 /nfs/dbraw/zinc/99/09/13/641990913.db2.gz NNIBOLDPKHKCJJ-LBPRGKRZSA-N 2 2 323.393 2.131 20 10 DECDLP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774991146 641990916 /nfs/dbraw/zinc/99/09/16/641990916.db2.gz NNIBOLDPKHKCJJ-LBPRGKRZSA-N 2 2 323.393 2.131 20 10 DECDLP C[C@H]([NH2+]CC1([NH3+])CC1)c1cc(Br)c(F)cc1O ZINC000902405589 643021311 /nfs/dbraw/zinc/02/13/11/643021311.db2.gz JBAJXJOQDLQSJJ-ZETCQYMHSA-N 2 2 303.175 2.436 20 10 DECDLP CC(=O)c1cc(F)cc(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)c1O ZINC000903485321 643364126 /nfs/dbraw/zinc/36/41/26/643364126.db2.gz MBHMPQSBUOZITH-OAHLLOKOSA-N 2 2 306.381 2.498 20 10 DECDLP CC[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817888761 647371919 /nfs/dbraw/zinc/37/19/19/647371919.db2.gz OCWKVLXRYMVXID-IRXDYDNUSA-N 2 2 321.440 2.283 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817895831 647374673 /nfs/dbraw/zinc/37/46/73/647374673.db2.gz WTUVTEMEOXWDNJ-HNAYVOBHSA-N 2 2 317.477 2.125 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCc3nn(C)cc32)cc1 ZINC000817943562 647389868 /nfs/dbraw/zinc/38/98/68/647389868.db2.gz VLQTUABSEQJFGU-SJORKVTESA-N 2 2 313.449 2.153 20 10 DECDLP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Br)c(F)cc1O ZINC000817977661 647398831 /nfs/dbraw/zinc/39/88/31/647398831.db2.gz NNBMZCYHXSDSOW-HEXRFXHZSA-N 2 2 315.186 2.162 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)c1 ZINC000817983100 647400804 /nfs/dbraw/zinc/40/08/04/647400804.db2.gz YAVCWYLYSYCOMX-XHDPSFHLSA-N 2 2 306.406 2.347 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH+]1CCN(c2[nH+]ccn2C)CC1 ZINC000827885372 649099300 /nfs/dbraw/zinc/09/93/00/649099300.db2.gz ZBWXYRBFQZKFKB-UHFFFAOYSA-N 2 2 313.449 2.117 20 10 DECDLP C[NH+](C)CCOC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876721484 689914405 /nfs/dbraw/zinc/91/44/05/689914405.db2.gz PPNCNXOUGXYTBP-UHFFFAOYSA-N 2 2 314.376 2.213 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000925507085 693285950 /nfs/dbraw/zinc/28/59/50/693285950.db2.gz YFCDOVRRERZPPX-KXBFYZLASA-N 2 2 317.477 2.125 20 10 DECDLP C[NH+](C)CCC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715779521 792511084 /nfs/dbraw/zinc/51/10/84/792511084.db2.gz QEUQPOWHUYCJPC-UHFFFAOYSA-N 2 2 305.191 2.335 20 10 DECDLP COc1cc(C[N@@H+]2CCCC[C@](F)(C[NH3+])C2)c(O)c(OC)c1 ZINC001206371816 795075278 /nfs/dbraw/zinc/07/52/78/795075278.db2.gz WOLAYMXABWZDSD-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP COc1cc(C[N@H+]2CCCC[C@](F)(C[NH3+])C2)c(O)c(OC)c1 ZINC001206371816 795075288 /nfs/dbraw/zinc/07/52/88/795075288.db2.gz WOLAYMXABWZDSD-INIZCTEOSA-N 2 2 312.385 2.062 20 10 DECDLP [NH3+]C[C@H]1C[N@H+](Cc2cc(Cl)c(O)cc2O)CCC1(F)F ZINC001205779062 800419254 /nfs/dbraw/zinc/41/92/54/800419254.db2.gz JAORHRZIHZYNGK-VIFPVBQESA-N 2 2 306.740 2.167 20 10 DECDLP [NH3+]C[C@H]1C[N@@H+](Cc2cc(Cl)c(O)cc2O)CCC1(F)F ZINC001205779062 800419260 /nfs/dbraw/zinc/41/92/60/800419260.db2.gz JAORHRZIHZYNGK-VIFPVBQESA-N 2 2 306.740 2.167 20 10 DECDLP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(Cl)c1O ZINC001276379873 1083741821 /nfs/dbraw/zinc/74/18/21/1083741821.db2.gz ABLJXBRPDPFSBB-GASCZTMLSA-N 2 2 323.868 2.256 20 10 DECDLP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(Cl)c1O ZINC001276379873 1083741828 /nfs/dbraw/zinc/74/18/28/1083741828.db2.gz ABLJXBRPDPFSBB-GASCZTMLSA-N 2 2 323.868 2.256 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@@H+]3CC[C@H]4C[C@@]4([NH3+])C3)ccc2O1 ZINC001235170296 1084333820 /nfs/dbraw/zinc/33/38/20/1084333820.db2.gz DTOYVBNEIHKBCG-SCLBCKFNSA-N 2 2 300.402 2.500 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@H+]3CC[C@H]4C[C@@]4([NH3+])C3)ccc2O1 ZINC001235170296 1084333832 /nfs/dbraw/zinc/33/38/32/1084333832.db2.gz DTOYVBNEIHKBCG-SCLBCKFNSA-N 2 2 300.402 2.500 20 10 DECDLP CC[N@H+](CC[NH2+]C)Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001236145433 1084621208 /nfs/dbraw/zinc/62/12/08/1084621208.db2.gz YGBCUUJYESWNFT-UHFFFAOYSA-N 2 2 303.450 2.132 20 10 DECDLP CC[N@@H+](CC[NH2+]C)Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001236145433 1084621216 /nfs/dbraw/zinc/62/12/16/1084621216.db2.gz YGBCUUJYESWNFT-UHFFFAOYSA-N 2 2 303.450 2.132 20 10 DECDLP C[NH2+]C[C@H]1CCC[N@@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001236417442 1138360262 /nfs/dbraw/zinc/36/02/62/1138360262.db2.gz OXNTXYONOUEPJU-MRXNPFEDSA-N 2 2 315.461 2.275 20 10 DECDLP C[NH2+]C[C@H]1CCC[N@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001236417442 1138360267 /nfs/dbraw/zinc/36/02/67/1138360267.db2.gz OXNTXYONOUEPJU-MRXNPFEDSA-N 2 2 315.461 2.275 20 10 DECDLP C[C@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1n1cc[nH+]c1 ZINC000246676660 402540279 /nfs/dbraw/zinc/54/02/79/402540279.db2.gz QSVCFCBOYXSXPM-GXTWGEPZSA-N 2 2 315.373 2.401 20 10 DECDLP C[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C[C@H]1n1cc[nH+]c1 ZINC000246676660 402540280 /nfs/dbraw/zinc/54/02/80/402540280.db2.gz QSVCFCBOYXSXPM-GXTWGEPZSA-N 2 2 315.373 2.401 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)Cn2cc[nH+]c2)c1 ZINC000273413949 274003456 /nfs/dbraw/zinc/00/34/56/274003456.db2.gz QJPZTVFBWVQVQD-NEPJUHHUSA-N 2 2 303.362 2.115 20 10 DECDLP CN(C)c1ccc(/C=C/C[N@H+](CCO)C2CC[NH+](C)CC2)cc1 ZINC000835024448 649867575 /nfs/dbraw/zinc/86/75/75/649867575.db2.gz APJPCMKCUPJOEH-SNAWJCMRSA-N 2 2 317.477 2.154 20 10 DECDLP CN(C)c1ccc(/C=C/C[N@@H+](CCO)C2CC[NH+](C)CC2)cc1 ZINC000835024448 649867577 /nfs/dbraw/zinc/86/75/77/649867577.db2.gz APJPCMKCUPJOEH-SNAWJCMRSA-N 2 2 317.477 2.154 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000756553958 639673748 /nfs/dbraw/zinc/67/37/48/639673748.db2.gz NKRJXFKUTGVDJR-STQMWFEESA-N 2 2 306.406 2.171 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000756553958 639673754 /nfs/dbraw/zinc/67/37/54/639673754.db2.gz NKRJXFKUTGVDJR-STQMWFEESA-N 2 2 306.406 2.171 20 10 DECDLP CCN(C)c1ccc(C[NH+]2CCN(c3[nH+]ccn3C)CC2)cc1 ZINC000773805228 641825186 /nfs/dbraw/zinc/82/51/86/641825186.db2.gz GWNOXDIRXYNOSD-UHFFFAOYSA-N 2 2 313.449 2.198 20 10 DECDLP Cc1cc(Br)c(O)c(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000781911803 642798249 /nfs/dbraw/zinc/79/82/49/642798249.db2.gz RUUHQNFQLZTFEJ-VXGBXAGGSA-N 2 2 311.223 2.114 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCCC[NH2+]2)c1 ZINC000902482108 643057109 /nfs/dbraw/zinc/05/71/09/643057109.db2.gz JFNCQIAJKAWRSL-OCCSQVGLSA-N 2 2 306.406 2.362 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@H](C)C[C@H]2COCC[NH2+]2)cc1 ZINC000817890144 647372054 /nfs/dbraw/zinc/37/20/54/647372054.db2.gz XEHLZKCHVVMFKU-WBVHZDCISA-N 2 2 305.466 2.389 20 10 DECDLP Cc1cc(O)c(C[NH2+]C2(CCO)CC[NH+](C)CC2)cc1Cl ZINC000825519999 648774715 /nfs/dbraw/zinc/77/47/15/648774715.db2.gz QSWMTJWQIAEHIX-UHFFFAOYSA-N 2 2 312.841 2.290 20 10 DECDLP COc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930208 651565345 /nfs/dbraw/zinc/56/53/45/651565345.db2.gz OFUYMGGEOJEILA-MRXNPFEDSA-N 2 2 320.433 2.088 20 10 DECDLP COc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)c1O ZINC000848930208 651565350 /nfs/dbraw/zinc/56/53/50/651565350.db2.gz OFUYMGGEOJEILA-MRXNPFEDSA-N 2 2 320.433 2.088 20 10 DECDLP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000125503476 684146219 /nfs/dbraw/zinc/14/62/19/684146219.db2.gz VYQCTEXWTLPXOT-MRXNPFEDSA-N 2 2 321.440 2.046 20 10 DECDLP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000125503476 684146220 /nfs/dbraw/zinc/14/62/20/684146220.db2.gz VYQCTEXWTLPXOT-MRXNPFEDSA-N 2 2 321.440 2.046 20 10 DECDLP C[C@H]([NH2+][C@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000863545162 686519456 /nfs/dbraw/zinc/51/94/56/686519456.db2.gz JQBBTHAQHFYOGM-YCPHGPKFSA-N 2 2 321.440 2.453 20 10 DECDLP C[N@@H+]1CCC[C@H]2[C@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621995 694441958 /nfs/dbraw/zinc/44/19/58/694441958.db2.gz MVPNFDLYKXGNIG-MOPGFXCFSA-N 2 2 315.461 2.192 20 10 DECDLP C[N@H+]1CCC[C@H]2[C@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621995 694441959 /nfs/dbraw/zinc/44/19/59/694441959.db2.gz MVPNFDLYKXGNIG-MOPGFXCFSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@H]2[C@H]1CC[N@@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621995 694441962 /nfs/dbraw/zinc/44/19/62/694441962.db2.gz MVPNFDLYKXGNIG-MOPGFXCFSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@H]2[C@H]1CC[N@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621995 694441965 /nfs/dbraw/zinc/44/19/65/694441965.db2.gz MVPNFDLYKXGNIG-MOPGFXCFSA-N 2 2 315.461 2.192 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)cc1Cl ZINC001205777125 800417802 /nfs/dbraw/zinc/41/78/02/800417802.db2.gz AJNZBPNKVQNQBZ-SNVBAGLBSA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)cc1Cl ZINC001205777125 800417806 /nfs/dbraw/zinc/41/78/06/800417806.db2.gz AJNZBPNKVQNQBZ-SNVBAGLBSA-N 2 2 320.767 2.470 20 10 DECDLP CC[N@H+]1C[C@@H]2C[NH+](Cc3c(O)cc(OC)cc3Cl)C[C@@H]2C1 ZINC001236806543 1138433212 /nfs/dbraw/zinc/43/32/12/1138433212.db2.gz YCCJTXMBTQZERQ-TXEJJXNPSA-N 2 2 310.825 2.438 20 10 DECDLP CC[N@@H+]1C[C@@H]2C[NH+](Cc3c(O)cc(OC)cc3Cl)C[C@@H]2C1 ZINC001236806543 1138433215 /nfs/dbraw/zinc/43/32/15/1138433215.db2.gz YCCJTXMBTQZERQ-TXEJJXNPSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@@H+](Cc3c(O)cc(OC)cc3Cl)C[C@@H]2C1 ZINC001236806543 1138433226 /nfs/dbraw/zinc/43/32/26/1138433226.db2.gz YCCJTXMBTQZERQ-TXEJJXNPSA-N 2 2 310.825 2.438 20 10 DECDLP CC[NH+]1C[C@@H]2C[N@H+](Cc3c(O)cc(OC)cc3Cl)C[C@@H]2C1 ZINC001236806543 1138433231 /nfs/dbraw/zinc/43/32/31/1138433231.db2.gz YCCJTXMBTQZERQ-TXEJJXNPSA-N 2 2 310.825 2.438 20 10 DECDLP COc1ccc(N2CC[NH+](C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC001256073337 1143827380 /nfs/dbraw/zinc/82/73/80/1143827380.db2.gz RRHKZAHCWKACLR-UHFFFAOYSA-N 2 2 315.461 2.444 20 10 DECDLP C[NH+]1CCC([N@H+](CCO)Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294790090 530049555 /nfs/dbraw/zinc/04/95/55/530049555.db2.gz CJVFYKOIOJOMSE-UHFFFAOYSA-N 2 2 316.804 2.073 20 10 DECDLP C[NH+]1CCC([N@@H+](CCO)Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294790090 530049556 /nfs/dbraw/zinc/04/95/56/530049556.db2.gz CJVFYKOIOJOMSE-UHFFFAOYSA-N 2 2 316.804 2.073 20 10 DECDLP CC[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(F)cc1O ZINC000286193244 131224113 /nfs/dbraw/zinc/22/41/13/131224113.db2.gz RJSYDJLDOKKQSY-INIZCTEOSA-N 2 2 310.413 2.419 20 10 DECDLP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1cccc(Cl)c1O ZINC000289550752 131395346 /nfs/dbraw/zinc/39/53/46/131395346.db2.gz XPDUBPQYQHVWNC-UHFFFAOYSA-N 2 2 311.857 2.115 20 10 DECDLP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cccc(Cl)c1O ZINC000289550752 131395347 /nfs/dbraw/zinc/39/53/47/131395347.db2.gz XPDUBPQYQHVWNC-UHFFFAOYSA-N 2 2 311.857 2.115 20 10 DECDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc2c(cc1O)OCO2 ZINC000091892913 401998321 /nfs/dbraw/zinc/99/83/21/401998321.db2.gz AMHSKTRHONYDBJ-KGLIPLIRSA-N 2 2 304.390 2.180 20 10 DECDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc2c(cc1O)OCO2 ZINC000091892913 401998323 /nfs/dbraw/zinc/99/83/23/401998323.db2.gz AMHSKTRHONYDBJ-KGLIPLIRSA-N 2 2 304.390 2.180 20 10 DECDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc2c(cc1O)OCO2 ZINC000091892913 401998327 /nfs/dbraw/zinc/99/83/27/401998327.db2.gz AMHSKTRHONYDBJ-KGLIPLIRSA-N 2 2 304.390 2.180 20 10 DECDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2c(cc1O)OCO2 ZINC000091892913 401998329 /nfs/dbraw/zinc/99/83/29/401998329.db2.gz AMHSKTRHONYDBJ-KGLIPLIRSA-N 2 2 304.390 2.180 20 10 DECDLP COc1c(O)c(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510718 286186622 /nfs/dbraw/zinc/18/66/22/286186622.db2.gz POEOHDFYNMTHIU-DGCLKSJQSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510718 286186625 /nfs/dbraw/zinc/18/66/25/286186625.db2.gz POEOHDFYNMTHIU-DGCLKSJQSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510718 286186626 /nfs/dbraw/zinc/18/66/26/286186626.db2.gz POEOHDFYNMTHIU-DGCLKSJQSA-N 2 2 323.393 2.081 20 10 DECDLP COc1c(O)c(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000290510718 286186628 /nfs/dbraw/zinc/18/66/28/286186628.db2.gz POEOHDFYNMTHIU-DGCLKSJQSA-N 2 2 323.393 2.081 20 10 DECDLP COc1ccc(N2CC[NH+](CCn3cc[nH+]c3C)CC2)cc1 ZINC000270875105 403234365 /nfs/dbraw/zinc/23/43/65/403234365.db2.gz UXRGCMYLYFYCQH-UHFFFAOYSA-N 2 2 300.406 2.022 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540518 405243456 /nfs/dbraw/zinc/24/34/56/405243456.db2.gz YKJGEMCTLSWMEL-WBAXXEDZSA-N 2 2 303.450 2.266 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(N(C)C)cc1 ZINC000368540518 405243459 /nfs/dbraw/zinc/24/34/59/405243459.db2.gz YKJGEMCTLSWMEL-WBAXXEDZSA-N 2 2 303.450 2.266 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCC[N@@H+]2CCCO)cc1 ZINC000835055811 649873057 /nfs/dbraw/zinc/87/30/57/649873057.db2.gz ZMJMRGDWKJYXTA-MTGFJVSHSA-N 2 2 317.477 2.202 20 10 DECDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCC[N@H+]2CCCO)cc1 ZINC000835055811 649873058 /nfs/dbraw/zinc/87/30/58/649873058.db2.gz ZMJMRGDWKJYXTA-MTGFJVSHSA-N 2 2 317.477 2.202 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1csnn1 ZINC000840970714 650396921 /nfs/dbraw/zinc/39/69/21/650396921.db2.gz VVKBRAUTZKRZGG-CYBMUJFWSA-N 2 2 317.462 2.141 20 10 DECDLP CCC[NH2+]CC[NH2+]Cc1cc(Br)cc(OC)c1O ZINC000841047071 650413412 /nfs/dbraw/zinc/41/34/12/650413412.db2.gz UNBICZINAXFPCR-UHFFFAOYSA-N 2 2 317.227 2.253 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000841091330 650428821 /nfs/dbraw/zinc/42/88/21/650428821.db2.gz VGHSTAUMLVGNRN-GFCCVEGCSA-N 2 2 321.377 2.073 20 10 DECDLP Oc1ccc(Br)cc1C[NH2+][C@@H]1CCn2cc[nH+]c2C1 ZINC000778187689 642350158 /nfs/dbraw/zinc/35/01/58/642350158.db2.gz DFGAKUJYEDOSFY-GFCCVEGCSA-N 2 2 322.206 2.456 20 10 DECDLP C[C@@H]([NH2+]CC1([NH3+])CC1)c1cc(Br)c(F)cc1O ZINC000902405588 643021166 /nfs/dbraw/zinc/02/11/66/643021166.db2.gz JBAJXJOQDLQSJJ-SSDOTTSWSA-N 2 2 303.175 2.436 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCCC[NH2+]2)c1 ZINC000902482106 643057074 /nfs/dbraw/zinc/05/70/74/643057074.db2.gz JFNCQIAJKAWRSL-GXTWGEPZSA-N 2 2 306.406 2.362 20 10 DECDLP Oc1ccc(Cl)cc1C[NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903973743 643531977 /nfs/dbraw/zinc/53/19/77/643531977.db2.gz HEXJDUVOSFQALQ-CQSZACIVSA-N 2 2 310.825 2.294 20 10 DECDLP C[C@H]([NH2+]CC1C[NH2+]C1)c1cc(Br)c(F)cc1O ZINC000817964971 647395613 /nfs/dbraw/zinc/39/56/13/647395613.db2.gz LKINGQPVTMRIMP-ZETCQYMHSA-N 2 2 303.175 2.164 20 10 DECDLP Oc1ccc(Cl)cc1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000848919575 651560806 /nfs/dbraw/zinc/56/08/06/651560806.db2.gz NRJWENHWVAWFOI-OAHLLOKOSA-N 2 2 310.825 2.389 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCCC[C@H]([NH3+])C3)cc2)CC1 ZINC000873216349 689186153 /nfs/dbraw/zinc/18/61/53/689186153.db2.gz QRXCDFIMHRGPMF-SFHVURJKSA-N 3 2 316.493 2.142 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCCC[C@H]([NH3+])C3)cc2)CC1 ZINC000873216349 689186155 /nfs/dbraw/zinc/18/61/55/689186155.db2.gz QRXCDFIMHRGPMF-SFHVURJKSA-N 3 2 316.493 2.142 20 10 DECDLP C[N@@H+]1CCC[C@@H]2[C@@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621998 694441675 /nfs/dbraw/zinc/44/16/75/694441675.db2.gz MVPNFDLYKXGNIG-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[N@H+]1CCC[C@@H]2[C@@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621998 694441677 /nfs/dbraw/zinc/44/16/77/694441677.db2.gz MVPNFDLYKXGNIG-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@@H]2[C@@H]1CC[N@@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621998 694441679 /nfs/dbraw/zinc/44/16/79/694441679.db2.gz MVPNFDLYKXGNIG-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@@H]2[C@@H]1CC[N@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621998 694441681 /nfs/dbraw/zinc/44/16/81/694441681.db2.gz MVPNFDLYKXGNIG-RBUKOAKNSA-N 2 2 315.461 2.192 20 10 DECDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000925501505 693284342 /nfs/dbraw/zinc/28/43/42/693284342.db2.gz ISZYFTXJZMUHOK-SUMWQHHRSA-N 2 2 321.440 2.017 20 10 DECDLP COc1ccc(N2CC[C@H]([NH2+][C@@H]3CC[NH2+]C34CCC4)C2)cc1 ZINC000925710045 693327836 /nfs/dbraw/zinc/32/78/36/693327836.db2.gz BGXVUYDFVBGTJG-WMLDXEAASA-N 2 2 301.434 2.148 20 10 DECDLP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c(O)c1Cl ZINC001206201588 793734051 /nfs/dbraw/zinc/73/40/51/793734051.db2.gz XXOHHHZBHMNSPE-QWRGUYRKSA-N 2 2 302.777 2.315 20 10 DECDLP COc1ccc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c(O)c1Cl ZINC001206201588 793734057 /nfs/dbraw/zinc/73/40/57/793734057.db2.gz XXOHHHZBHMNSPE-QWRGUYRKSA-N 2 2 302.777 2.315 20 10 DECDLP CC[N@H+](C)C1CC[NH+](Cc2ccc3c(c2)OCCN3C)CC1 ZINC001141146099 796639745 /nfs/dbraw/zinc/63/97/45/796639745.db2.gz KMWNGNYGFASLEQ-UHFFFAOYSA-N 2 2 303.450 2.431 20 10 DECDLP CC[N@@H+](C)C1CC[NH+](Cc2ccc3c(c2)OCCN3C)CC1 ZINC001141146099 796639747 /nfs/dbraw/zinc/63/97/47/796639747.db2.gz KMWNGNYGFASLEQ-UHFFFAOYSA-N 2 2 303.450 2.431 20 10 DECDLP C[N@H+](C1CCOCC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141161746 796643267 /nfs/dbraw/zinc/64/32/67/796643267.db2.gz WRLRCYVPKKOABR-UHFFFAOYSA-N 2 2 320.433 2.173 20 10 DECDLP C[N@@H+](C1CCOCC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141161746 796643268 /nfs/dbraw/zinc/64/32/68/796643268.db2.gz WRLRCYVPKKOABR-UHFFFAOYSA-N 2 2 320.433 2.173 20 10 DECDLP Oc1ccccc1C[N@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001203552069 800077801 /nfs/dbraw/zinc/07/78/01/800077801.db2.gz ZATXOYSUKBDMRF-HDICACEKSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[N@@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001203552069 800077809 /nfs/dbraw/zinc/07/78/09/800077809.db2.gz ZATXOYSUKBDMRF-HDICACEKSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2C1 ZINC001203552069 800077815 /nfs/dbraw/zinc/07/78/15/800077815.db2.gz ZATXOYSUKBDMRF-HDICACEKSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@H]2C[N@H+](Cc3cccnc3)C[C@H]2C1 ZINC001203552069 800077822 /nfs/dbraw/zinc/07/78/22/800077822.db2.gz ZATXOYSUKBDMRF-HDICACEKSA-N 2 2 309.413 2.351 20 10 DECDLP Oc1ccccc1C[NH+]1C[C@@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001203551863 800079745 /nfs/dbraw/zinc/07/97/45/800079745.db2.gz RCIRBXYEFKTNLG-IAGOWNOFSA-N 2 2 309.413 2.351 20 10 DECDLP C[N@H+](CCN1CC[NH2+]CC1)Cc1c(O)ccc(Cl)c1Cl ZINC001236081607 1079084514 /nfs/dbraw/zinc/08/45/14/1079084514.db2.gz QZPCBKTVHSAQLK-UHFFFAOYSA-N 2 2 318.248 2.036 20 10 DECDLP C[N@@H+](CCN1CC[NH2+]CC1)Cc1c(O)ccc(Cl)c1Cl ZINC001236081607 1079084519 /nfs/dbraw/zinc/08/45/19/1079084519.db2.gz QZPCBKTVHSAQLK-UHFFFAOYSA-N 2 2 318.248 2.036 20 10 DECDLP CN(CCC[NH2+]Cc1cc(Cl)cc(F)c1O)CC[NH+](C)C ZINC001651379990 1079807253 /nfs/dbraw/zinc/80/72/53/1079807253.db2.gz KBGSBXJCQYFUGE-UHFFFAOYSA-N 2 2 317.836 2.158 20 10 DECDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3cccc(Cl)c3O)C2)C1 ZINC001276380252 1083745959 /nfs/dbraw/zinc/74/59/59/1083745959.db2.gz LULWYFKXRLBPOA-UHFFFAOYSA-N 2 2 323.868 2.115 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)ccc2O1 ZINC001235994111 1084584048 /nfs/dbraw/zinc/58/40/48/1084584048.db2.gz NHEDQGWAQXKBIL-SCLBCKFNSA-N 2 2 300.402 2.500 20 10 DECDLP CC1(C)C=Cc2c(O)c(C[N@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)ccc2O1 ZINC001235994111 1084584053 /nfs/dbraw/zinc/58/40/53/1084584053.db2.gz NHEDQGWAQXKBIL-SCLBCKFNSA-N 2 2 300.402 2.500 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@@H]([NH3+])C3(COC3)C2)c2ccccc21 ZINC001237176692 1138514437 /nfs/dbraw/zinc/51/44/37/1138514437.db2.gz SNNDKZLUKBWSGG-GOSISDBHSA-N 2 2 311.429 2.065 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@@H]([NH3+])C3(COC3)C2)c2ccccc21 ZINC001237176692 1138514444 /nfs/dbraw/zinc/51/44/44/1138514444.db2.gz SNNDKZLUKBWSGG-GOSISDBHSA-N 2 2 311.429 2.065 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H](c3[nH]cc[nH+]3)C1)OCO2 ZINC000092073569 355617697 /nfs/dbraw/zinc/61/76/97/355617697.db2.gz QICYOYNDIWSYAR-LLVKDONJSA-N 2 2 301.346 2.224 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCC[C@@H](c3[nH]cc[nH+]3)C1)OCO2 ZINC000092073569 355617703 /nfs/dbraw/zinc/61/77/03/355617703.db2.gz QICYOYNDIWSYAR-LLVKDONJSA-N 2 2 301.346 2.224 20 10 DECDLP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N1CC[NH+](C)CC1 ZINC000170789705 402525669 /nfs/dbraw/zinc/52/56/69/402525669.db2.gz QIWOZJISAXWEAU-YOEHRIQHSA-N 2 2 323.456 2.454 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000423083693 230345388 /nfs/dbraw/zinc/34/53/88/230345388.db2.gz GISHGMGDTBUDET-MOPGFXCFSA-N 2 2 313.445 2.343 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]CC(C)C)CC2)cc1 ZINC000102560369 650126013 /nfs/dbraw/zinc/12/60/13/650126013.db2.gz WLIJLEVOPVQHIY-UHFFFAOYSA-N 2 2 305.466 2.453 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923531858 637233629 /nfs/dbraw/zinc/23/36/29/637233629.db2.gz WQXJKWZXZYZGTN-IBGZPJMESA-N 2 2 315.461 2.241 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923531858 637233634 /nfs/dbraw/zinc/23/36/34/637233634.db2.gz WQXJKWZXZYZGTN-IBGZPJMESA-N 2 2 315.461 2.241 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000841044754 650412592 /nfs/dbraw/zinc/41/25/92/650412592.db2.gz YRIAXNOHSRNLNF-KRWDZBQOSA-N 2 2 314.389 2.450 20 10 DECDLP C[C@@H]1C[C@H]([NH2+]C[C@H](O)C[NH+]2CCCC2)c2c1c(F)ccc2O ZINC000756450704 639663975 /nfs/dbraw/zinc/66/39/75/639663975.db2.gz UAXJIDWXIJQNTC-DYEKYZERSA-N 2 2 308.397 2.126 20 10 DECDLP C[C@@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046166 650876229 /nfs/dbraw/zinc/87/62/29/650876229.db2.gz PAKCEBLVVXIDPJ-VQIMIIECSA-N 3 2 316.493 2.140 20 10 DECDLP C[C@@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843046166 650876231 /nfs/dbraw/zinc/87/62/31/650876231.db2.gz PAKCEBLVVXIDPJ-VQIMIIECSA-N 3 2 316.493 2.140 20 10 DECDLP C[NH+]1CCN(c2ccc(CNc3cc[nH+]cc3F)cc2)CC1 ZINC000792687227 644139568 /nfs/dbraw/zinc/13/95/68/644139568.db2.gz QHPPEJQWZFTXEB-UHFFFAOYSA-N 2 2 300.381 2.007 20 10 DECDLP COc1ccc(O)c(C[N@H+](CC[NH3+])CCc2ccccc2)c1 ZINC000843121311 650900163 /nfs/dbraw/zinc/90/01/63/650900163.db2.gz CTMNFHMQMHCGKI-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP COc1ccc(O)c(C[N@@H+](CC[NH3+])CCc2ccccc2)c1 ZINC000843121311 650900165 /nfs/dbraw/zinc/90/01/65/650900165.db2.gz CTMNFHMQMHCGKI-UHFFFAOYSA-N 2 2 300.402 2.404 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)ccc1[N+](=O)[O-] ZINC000843127893 650902518 /nfs/dbraw/zinc/90/25/18/650902518.db2.gz JHRKGGGWCUTKKT-CYBMUJFWSA-N 2 2 321.377 2.073 20 10 DECDLP CC[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817888762 647371413 /nfs/dbraw/zinc/37/14/13/647371413.db2.gz OCWKVLXRYMVXID-SJORKVTESA-N 2 2 321.440 2.283 20 10 DECDLP Cc1nn(C)cc1[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939000 647387828 /nfs/dbraw/zinc/38/78/28/647387828.db2.gz XIJJQCULGLNTCI-PXAZEXFGSA-N 2 2 301.438 2.145 20 10 DECDLP C[C@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154258355 647958696 /nfs/dbraw/zinc/95/86/96/647958696.db2.gz SULZHLAIXFAUJJ-GOEBONIOSA-N 2 2 323.456 2.389 20 10 DECDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1cc(F)ccc1O ZINC000850558058 651952559 /nfs/dbraw/zinc/95/25/59/651952559.db2.gz SGTBBLOEAVXDCA-WFASDCNBSA-N 2 2 308.397 2.435 20 10 DECDLP COc1ccc(O)c([C@@H](C)[N@@H+]2CCc3sc(C[NH3+])nc3C2)c1 ZINC000925750206 693334499 /nfs/dbraw/zinc/33/44/99/693334499.db2.gz DXICDBPWTVXBLY-SNVBAGLBSA-N 2 2 319.430 2.435 20 10 DECDLP COc1ccc(O)c([C@@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c1 ZINC000925750206 693334505 /nfs/dbraw/zinc/33/45/05/693334505.db2.gz DXICDBPWTVXBLY-SNVBAGLBSA-N 2 2 319.430 2.435 20 10 DECDLP [NH3+]Cc1nc2c(s1)CC[N@@H+]([C@H]1CCc3cccc(O)c31)C2 ZINC000925749156 693335229 /nfs/dbraw/zinc/33/52/29/693335229.db2.gz HLDOMQJXGNFHKQ-LBPRGKRZSA-N 2 2 301.415 2.353 20 10 DECDLP [NH3+]Cc1nc2c(s1)CC[N@H+]([C@H]1CCc3cccc(O)c31)C2 ZINC000925749156 693335233 /nfs/dbraw/zinc/33/52/33/693335233.db2.gz HLDOMQJXGNFHKQ-LBPRGKRZSA-N 2 2 301.415 2.353 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCN(CC[NH+](C)C)CC2)c(Cl)c1 ZINC001140921386 796597249 /nfs/dbraw/zinc/59/72/49/796597249.db2.gz CTWMABRHLKHBGY-UHFFFAOYSA-N 2 2 324.900 2.085 20 10 DECDLP C[C@H]1C[N@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)CCCO1 ZINC000883103869 799243519 /nfs/dbraw/zinc/24/35/19/799243519.db2.gz HZFVKRCZTPWJOS-LBPRGKRZSA-N 2 2 314.376 2.261 20 10 DECDLP C[C@H]1C[N@@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)CCCO1 ZINC000883103869 799243522 /nfs/dbraw/zinc/24/35/22/799243522.db2.gz HZFVKRCZTPWJOS-LBPRGKRZSA-N 2 2 314.376 2.261 20 10 DECDLP Cc1c(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c2ccccc2n1C ZINC001222497569 802695655 /nfs/dbraw/zinc/69/56/55/802695655.db2.gz PYQVKTUDXGUCDY-HKUYNNGSSA-N 2 2 312.461 2.013 20 10 DECDLP Oc1c(F)cc(Cl)cc1C[NH2+]CCCC[NH+]1CCOCC1 ZINC001461049082 1058578122 /nfs/dbraw/zinc/57/81/22/1058578122.db2.gz FKMYFMNRMHKMIW-UHFFFAOYSA-N 2 2 316.804 2.387 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@H+](C)CCN2C)c1 ZINC001462598851 1058861183 /nfs/dbraw/zinc/86/11/83/1058861183.db2.gz YOJWYIAANBFLCW-PBHICJAKSA-N 2 2 305.466 2.240 20 10 DECDLP CC(C)c1ccc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1 ZINC001462598851 1058861204 /nfs/dbraw/zinc/86/12/04/1058861204.db2.gz YOJWYIAANBFLCW-PBHICJAKSA-N 2 2 305.466 2.240 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2C[C@H]3C[NH+](C)C[C@@]3(C)C2)c1O ZINC001462615315 1058863783 /nfs/dbraw/zinc/86/37/83/1058863783.db2.gz AHIJCZNGNAXKMH-WBMJQRKESA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2C[C@H]3C[NH+](C)C[C@@]3(C)C2)c1O ZINC001462615315 1058863794 /nfs/dbraw/zinc/86/37/94/1058863794.db2.gz AHIJCZNGNAXKMH-WBMJQRKESA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[NH+]2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)c1O ZINC001462615315 1058863817 /nfs/dbraw/zinc/86/38/17/1058863817.db2.gz AHIJCZNGNAXKMH-WBMJQRKESA-N 2 2 310.825 2.438 20 10 DECDLP COc1cc(Cl)cc(C[NH+]2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)c1O ZINC001462615315 1058863836 /nfs/dbraw/zinc/86/38/36/1058863836.db2.gz AHIJCZNGNAXKMH-WBMJQRKESA-N 2 2 310.825 2.438 20 10 DECDLP Oc1ccc(F)cc1C[NH+]1CCC([NH2+]C2CCOCC2)CC1 ZINC001338308753 1142846921 /nfs/dbraw/zinc/84/69/21/1142846921.db2.gz JUSFDPOIFHQHDC-UHFFFAOYSA-N 2 2 308.397 2.264 20 10 DECDLP CN1CC[N@H+](C)C[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000264791408 530071116 /nfs/dbraw/zinc/07/11/16/530071116.db2.gz XFULVDKARHPDEK-LJQANCHMSA-N 2 2 316.493 2.012 20 10 DECDLP CN1CC[N@@H+](C)C[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000264791408 530071117 /nfs/dbraw/zinc/07/11/17/530071117.db2.gz XFULVDKARHPDEK-LJQANCHMSA-N 2 2 316.493 2.012 20 10 DECDLP COc1c(O)c(C[NH2+]CCC[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000278954588 402890460 /nfs/dbraw/zinc/89/04/60/402890460.db2.gz ZZGHRGNEAOQQOT-UHFFFAOYSA-N 2 2 311.382 2.129 20 10 DECDLP COc1c(O)c(C[NH2+]CCC[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000278954588 402890461 /nfs/dbraw/zinc/89/04/61/402890461.db2.gz ZZGHRGNEAOQQOT-UHFFFAOYSA-N 2 2 311.382 2.129 20 10 DECDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262026 280186617 /nfs/dbraw/zinc/18/66/17/280186617.db2.gz XGFZFGLSNHSGGW-CVEARBPZSA-N 2 2 319.449 2.081 20 10 DECDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262026 280186621 /nfs/dbraw/zinc/18/66/21/280186621.db2.gz XGFZFGLSNHSGGW-CVEARBPZSA-N 2 2 319.449 2.081 20 10 DECDLP Cc1cccc(C[NH+]2CCC(C)([NH+]3CCOCC3)CC2)c1O ZINC000529663907 340767140 /nfs/dbraw/zinc/76/71/40/340767140.db2.gz MRWKKRXJOPXLBW-UHFFFAOYSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1nocc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001330600476 1149208099 /nfs/dbraw/zinc/20/80/99/1149208099.db2.gz ISODEWHBEHLWAV-UHFFFAOYSA-N 2 2 318.396 2.164 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000840933985 634779399 /nfs/dbraw/zinc/77/93/99/634779399.db2.gz LJXWOJODEMQPEX-MSOLQXFVSA-N 2 2 303.450 2.014 20 10 DECDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000840933985 634779401 /nfs/dbraw/zinc/77/94/01/634779401.db2.gz LJXWOJODEMQPEX-MSOLQXFVSA-N 2 2 303.450 2.014 20 10 DECDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1O ZINC000923519553 637226727 /nfs/dbraw/zinc/22/67/27/637226727.db2.gz FJCALDVFWPSMQA-WCQYABFASA-N 2 2 308.809 2.290 20 10 DECDLP CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1O ZINC000923519553 637226729 /nfs/dbraw/zinc/22/67/29/637226729.db2.gz FJCALDVFWPSMQA-WCQYABFASA-N 2 2 308.809 2.290 20 10 DECDLP CC(C)OC1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000895954819 638283570 /nfs/dbraw/zinc/28/35/70/638283570.db2.gz IDVQMIMTGADWFY-UHFFFAOYSA-N 2 2 303.450 2.048 20 10 DECDLP CN(C)c1ncc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841041206 650411695 /nfs/dbraw/zinc/41/16/95/650411695.db2.gz BXFJLEJQXKNFFU-HNNXBMFYSA-N 2 2 319.478 2.065 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841044922 650413729 /nfs/dbraw/zinc/41/37/29/650413729.db2.gz FYDYSLROCQONAR-MRXNPFEDSA-N 2 2 303.381 2.387 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@]2(COC)CCC[NH2+]2)cc1 ZINC000841065309 650420975 /nfs/dbraw/zinc/42/09/75/650420975.db2.gz APIJPURIHXPCKB-SFHVURJKSA-N 2 2 305.466 2.391 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@H]3C[C@H]3C)CC2)cc1 ZINC000754131292 639392240 /nfs/dbraw/zinc/39/22/40/639392240.db2.gz VAXKKNVBLFPPTM-IAGOWNOFSA-N 2 2 317.477 2.453 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@@H+]1C ZINC000898447179 641665326 /nfs/dbraw/zinc/66/53/26/641665326.db2.gz GJHJVUHGEAEERR-HHXXYDBFSA-N 2 2 318.509 2.428 20 10 DECDLP C[C@@H]1C[C@@H]([NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)CC[N@H+]1C ZINC000898447179 641665332 /nfs/dbraw/zinc/66/53/32/641665332.db2.gz GJHJVUHGEAEERR-HHXXYDBFSA-N 2 2 318.509 2.428 20 10 DECDLP COc1c(O)c(C[NH2+]C2CC[NH+](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774970926 641989170 /nfs/dbraw/zinc/98/91/70/641989170.db2.gz WMLFXZCBRXSIJZ-UHFFFAOYSA-N 2 2 323.393 2.271 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCCC[NH2+]2)c1 ZINC000902482109 643057006 /nfs/dbraw/zinc/05/70/06/643057006.db2.gz JFNCQIAJKAWRSL-TZMCWYRMSA-N 2 2 306.406 2.362 20 10 DECDLP [NH3+][C@H](CC(F)F)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000903905479 643503355 /nfs/dbraw/zinc/50/33/55/643503355.db2.gz GTZGMJAIATUQMA-KGLIPLIRSA-N 2 2 314.376 2.356 20 10 DECDLP [NH3+][C@H](CC(F)F)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000903905479 643503356 /nfs/dbraw/zinc/50/33/56/643503356.db2.gz GTZGMJAIATUQMA-KGLIPLIRSA-N 2 2 314.376 2.356 20 10 DECDLP CN(C)c1ccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c(C(F)(F)F)c1 ZINC000792842603 644159497 /nfs/dbraw/zinc/15/94/97/644159497.db2.gz UBOXITRYDADMAU-CHWSQXEVSA-N 2 2 313.367 2.423 20 10 DECDLP CC[NH2+][C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000817973224 647397986 /nfs/dbraw/zinc/39/79/86/647397986.db2.gz RBYAASRYGQLBBU-KGLIPLIRSA-N 2 2 309.429 2.311 20 10 DECDLP COc1c(O)c(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000862481941 686308235 /nfs/dbraw/zinc/30/82/35/686308235.db2.gz BIKYFUZVAZSDAC-LBPRGKRZSA-N 2 2 323.393 2.131 20 10 DECDLP COc1c(O)c(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000862481941 686308238 /nfs/dbraw/zinc/30/82/38/686308238.db2.gz BIKYFUZVAZSDAC-LBPRGKRZSA-N 2 2 323.393 2.131 20 10 DECDLP [NH3+]C[C@@H]1C[N@H+](Cc2cccc(F)c2O)CC[C@H]1C(F)(F)F ZINC000863645469 686539472 /nfs/dbraw/zinc/53/94/72/686539472.db2.gz IBWCUICTILEQQO-GHMZBOCLSA-N 2 2 306.303 2.490 20 10 DECDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)CC[C@H]1C(F)(F)F ZINC000863645469 686539476 /nfs/dbraw/zinc/53/94/76/686539476.db2.gz IBWCUICTILEQQO-GHMZBOCLSA-N 2 2 306.303 2.490 20 10 DECDLP Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]([NH+]2CCOCC2)CC1 ZINC000877619859 690170105 /nfs/dbraw/zinc/17/01/05/690170105.db2.gz ARRYIIPKNKXJNI-MRXNPFEDSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1cccc(O)c1C[N@H+]1CCC[C@@H]([NH+]2CCOCC2)CC1 ZINC000877619859 690170107 /nfs/dbraw/zinc/17/01/07/690170107.db2.gz ARRYIIPKNKXJNI-MRXNPFEDSA-N 2 2 304.434 2.387 20 10 DECDLP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278589 795361838 /nfs/dbraw/zinc/36/18/38/795361838.db2.gz GAYRJWWXGVNVLR-MRXNPFEDSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278589 795361843 /nfs/dbraw/zinc/36/18/43/795361843.db2.gz GAYRJWWXGVNVLR-MRXNPFEDSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@H+](Cc1ccc2c(c1)OCCN2C)C1CC[NH+](C)CC1 ZINC001141143382 796639080 /nfs/dbraw/zinc/63/90/80/796639080.db2.gz WVJASLKIUXRAFL-UHFFFAOYSA-N 2 2 303.450 2.431 20 10 DECDLP CC[N@@H+](Cc1ccc2c(c1)OCCN2C)C1CC[NH+](C)CC1 ZINC001141143382 796639082 /nfs/dbraw/zinc/63/90/82/796639082.db2.gz WVJASLKIUXRAFL-UHFFFAOYSA-N 2 2 303.450 2.431 20 10 DECDLP Oc1ccc(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c(O)c1 ZINC001204278270 800200620 /nfs/dbraw/zinc/20/06/20/800200620.db2.gz CNAQZWUKGUZHNF-UHFFFAOYSA-N 2 2 308.397 2.496 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@H+]1CCc2[nH+]ccn2CC1 ZINC001231855095 801738741 /nfs/dbraw/zinc/73/87/41/801738741.db2.gz QGKVKTZWZVCYRR-UHFFFAOYSA-N 2 2 300.406 2.016 20 10 DECDLP COc1cc(N(C)C)ccc1C[N@@H+]1CCc2[nH+]ccn2CC1 ZINC001231855095 801738746 /nfs/dbraw/zinc/73/87/46/801738746.db2.gz QGKVKTZWZVCYRR-UHFFFAOYSA-N 2 2 300.406 2.016 20 10 DECDLP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)on1 ZINC001560320741 1075137228 /nfs/dbraw/zinc/13/72/28/1075137228.db2.gz MNNRTLUDRDSWCA-UHFFFAOYSA-N 2 2 318.396 2.164 20 10 DECDLP [NH3+][C@]12CC[C@@H]1C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995128 1084585657 /nfs/dbraw/zinc/58/56/57/1084585657.db2.gz VGHIOWAPFZPHMH-MFKMUULPSA-N 2 2 302.296 2.214 20 10 DECDLP [NH3+][C@]12CC[C@@H]1C[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C2 ZINC001235995128 1084585667 /nfs/dbraw/zinc/58/56/67/1084585667.db2.gz VGHIOWAPFZPHMH-MFKMUULPSA-N 2 2 302.296 2.214 20 10 DECDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cc(OC)cc(OC)c1O ZINC001237682482 1138755155 /nfs/dbraw/zinc/75/51/55/1138755155.db2.gz ZTUDRCHFOQBXOL-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cc(OC)cc(OC)c1O ZINC001237682482 1138755171 /nfs/dbraw/zinc/75/51/71/1138755171.db2.gz ZTUDRCHFOQBXOL-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP CC[NH+](CC)C[C@H](O)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001253189853 1142851509 /nfs/dbraw/zinc/85/15/09/1142851509.db2.gz LPMMROSFTYTALU-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](CC)C[C@H](O)C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001253189853 1142851510 /nfs/dbraw/zinc/85/15/10/1142851510.db2.gz LPMMROSFTYTALU-LJQANCHMSA-N 2 2 319.493 2.421 20 10 DECDLP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001308234056 1147457646 /nfs/dbraw/zinc/45/76/46/1147457646.db2.gz OSEAMXOYYPNYMW-OAHLLOKOSA-N 3 2 322.472 2.007 20 10 DECDLP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)N1CC[NH+](C)CC1 ZINC000170789709 402525658 /nfs/dbraw/zinc/52/56/58/402525658.db2.gz QIWOZJISAXWEAU-RHSMWYFYSA-N 2 2 323.456 2.454 20 10 DECDLP COc1cc(Br)cc(C[NH2+][C@H]2CCC[NH2+]C2)c1O ZINC000841041655 650411563 /nfs/dbraw/zinc/41/15/63/650411563.db2.gz CVWSESZWYRTGDP-NSHDSACASA-N 2 2 315.211 2.005 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000756609945 639678900 /nfs/dbraw/zinc/67/89/00/639678900.db2.gz GOSXHKBNZHAVEA-MBNYWOFBSA-N 2 2 306.406 2.312 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000756609945 639678901 /nfs/dbraw/zinc/67/89/01/639678901.db2.gz GOSXHKBNZHAVEA-MBNYWOFBSA-N 2 2 306.406 2.312 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cnn(C(C)(C)C)c2)cc1 ZINC000841044768 641465537 /nfs/dbraw/zinc/46/55/37/641465537.db2.gz YUDXNIAYOLPBFW-QGZVFWFLSA-N 2 2 315.465 2.494 20 10 DECDLP COc1ccc(N(C)CC[N@H+](C)C[C@H]([NH3+])CC(F)F)cc1 ZINC000903931358 643513292 /nfs/dbraw/zinc/51/32/92/643513292.db2.gz BSLOUDJRIVCOGP-GFCCVEGCSA-N 2 2 301.381 2.046 20 10 DECDLP COc1ccc(N(C)CC[N@@H+](C)C[C@H]([NH3+])CC(F)F)cc1 ZINC000903931358 643513294 /nfs/dbraw/zinc/51/32/94/643513294.db2.gz BSLOUDJRIVCOGP-GFCCVEGCSA-N 2 2 301.381 2.046 20 10 DECDLP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cccc(Br)c1O ZINC000903974503 643531880 /nfs/dbraw/zinc/53/18/80/643531880.db2.gz PSIZTPYSPRQOCU-GHMZBOCLSA-N 2 2 313.239 2.490 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1O ZINC000843368638 650959167 /nfs/dbraw/zinc/95/91/67/650959167.db2.gz PYLSNTYRUFAZQL-IUIKQTSFSA-N 2 2 306.381 2.293 20 10 DECDLP CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1O ZINC000843368638 650959170 /nfs/dbraw/zinc/95/91/70/650959170.db2.gz PYLSNTYRUFAZQL-IUIKQTSFSA-N 2 2 306.381 2.293 20 10 DECDLP C[C@@H]([NH2+]CC1C[NH2+]C1)c1cc(Br)cc(F)c1O ZINC000817965782 647395852 /nfs/dbraw/zinc/39/58/52/647395852.db2.gz VDEGKTSWSXOASB-SSDOTTSWSA-N 2 2 303.175 2.164 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C(F)(F)F)C2)cc1F ZINC000873226786 689187875 /nfs/dbraw/zinc/18/78/75/689187875.db2.gz BKVRVJLWFBZHAT-NWDGAFQWSA-N 2 2 319.346 2.461 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@H](C[NH3+])[C@H](C(F)(F)F)C2)cc1F ZINC000873226786 689187876 /nfs/dbraw/zinc/18/78/76/689187876.db2.gz BKVRVJLWFBZHAT-NWDGAFQWSA-N 2 2 319.346 2.461 20 10 DECDLP CC(C)(O)C[NH+]1CCC([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000877612522 690167321 /nfs/dbraw/zinc/16/73/21/690167321.db2.gz KDNQLYDRCQKKLE-UHFFFAOYSA-N 2 2 312.841 2.371 20 10 DECDLP COc1cc(C[N@@H+]2CCOC[C@H]2C2CC2)cc(C[NH+](C)C)c1O ZINC001139259249 796351686 /nfs/dbraw/zinc/35/16/86/796351686.db2.gz OQQYFFJBQIWUSS-INIZCTEOSA-N 2 2 320.433 2.073 20 10 DECDLP COc1cc(C[N@H+]2CCOC[C@H]2C2CC2)cc(C[NH+](C)C)c1O ZINC001139259249 796351689 /nfs/dbraw/zinc/35/16/89/796351689.db2.gz OQQYFFJBQIWUSS-INIZCTEOSA-N 2 2 320.433 2.073 20 10 DECDLP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141160219 796643202 /nfs/dbraw/zinc/64/32/02/796643202.db2.gz UGVPUEIHBUCTKQ-MRXNPFEDSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141160219 796643203 /nfs/dbraw/zinc/64/32/03/796643203.db2.gz UGVPUEIHBUCTKQ-MRXNPFEDSA-N 2 2 320.433 2.173 20 10 DECDLP COc1cc(Cl)cc(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c1O ZINC001205789174 798120574 /nfs/dbraw/zinc/12/05/74/798120574.db2.gz XGXZCCUMTWJYHC-JTQLQIEISA-N 2 2 320.767 2.470 20 10 DECDLP COc1cc(Cl)cc(C[N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c1O ZINC001205789174 798120578 /nfs/dbraw/zinc/12/05/78/798120578.db2.gz XGXZCCUMTWJYHC-JTQLQIEISA-N 2 2 320.767 2.470 20 10 DECDLP CN1CCOc2cc(C[N@@H+]3CCCC[C@@](F)(C[NH3+])C3)ccc21 ZINC001206352055 800514751 /nfs/dbraw/zinc/51/47/51/800514751.db2.gz MWGPOXJVURDFKP-QGZVFWFLSA-N 2 2 307.413 2.168 20 10 DECDLP CN1CCOc2cc(C[N@H+]3CCCC[C@@](F)(C[NH3+])C3)ccc21 ZINC001206352055 800514755 /nfs/dbraw/zinc/51/47/55/800514755.db2.gz MWGPOXJVURDFKP-QGZVFWFLSA-N 2 2 307.413 2.168 20 10 DECDLP C[NH+](C)CCCN1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC001231912567 801750066 /nfs/dbraw/zinc/75/00/66/801750066.db2.gz NTSPKXMENZYCML-UHFFFAOYSA-N 2 2 311.857 2.115 20 10 DECDLP CC[NH+]1C[C@H]2C[NH+](Cc3cc(Cl)c(OC)cc3O)C[C@@H]2C1 ZINC001232271259 801836344 /nfs/dbraw/zinc/83/63/44/801836344.db2.gz TWJWYTIYBVSOIK-STQMWFEESA-N 2 2 310.825 2.438 20 10 DECDLP Cc1cc(O)c(C[NH+]2CC3(CCN3CC[NH+](C)C)C2)cc1Cl ZINC001276372183 1085855011 /nfs/dbraw/zinc/85/50/11/1085855011.db2.gz IMZNUOYXOQWDHR-UHFFFAOYSA-N 2 2 323.868 2.176 20 10 DECDLP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(Br)cc3O)C[C@@H]2C1 ZINC000706234342 1086636693 /nfs/dbraw/zinc/63/66/93/1086636693.db2.gz GLBZOXCDLJXXOJ-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(Br)cc3O)C[C@@H]2C1 ZINC000706234342 1086636697 /nfs/dbraw/zinc/63/66/97/1086636697.db2.gz GLBZOXCDLJXXOJ-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(Br)cc3O)C[C@@H]2C1 ZINC000706234342 1086636700 /nfs/dbraw/zinc/63/67/00/1086636700.db2.gz GLBZOXCDLJXXOJ-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(Br)cc3O)C[C@@H]2C1 ZINC000706234342 1086636702 /nfs/dbraw/zinc/63/67/02/1086636702.db2.gz GLBZOXCDLJXXOJ-TXEJJXNPSA-N 2 2 311.223 2.148 20 10 DECDLP Oc1cc(O)c(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c(O)c1 ZINC001275112259 1091560032 /nfs/dbraw/zinc/56/00/32/1091560032.db2.gz AIDLFDLEMUNENV-UHFFFAOYSA-N 2 2 318.417 2.254 20 10 DECDLP Oc1cc(O)c(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c(O)c1 ZINC001275112259 1091560043 /nfs/dbraw/zinc/56/00/43/1091560043.db2.gz AIDLFDLEMUNENV-UHFFFAOYSA-N 2 2 318.417 2.254 20 10 DECDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217455 1091620799 /nfs/dbraw/zinc/62/07/99/1091620799.db2.gz OEVJBTFYIFXTMM-UHFFFAOYSA-N 2 2 323.868 2.115 20 10 DECDLP CC[N@H+](Cc1cc(OC)c(OC)cc1O)C1CC[NH+](C)CC1 ZINC001236757038 1138412303 /nfs/dbraw/zinc/41/23/03/1138412303.db2.gz WISONFLJCUVTDB-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC[NH+](C)CC1 ZINC001236757038 1138412311 /nfs/dbraw/zinc/41/23/11/1138412311.db2.gz WISONFLJCUVTDB-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOCC3(C)C)cc2F)CC1 ZINC001321203029 1141083866 /nfs/dbraw/zinc/08/38/66/1141083866.db2.gz URRYRNGAARYCIU-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCOCC3(C)C)cc2F)CC1 ZINC001321203029 1141083875 /nfs/dbraw/zinc/08/38/75/1141083875.db2.gz URRYRNGAARYCIU-UHFFFAOYSA-N 2 2 321.440 2.188 20 10 DECDLP Oc1cc2c(cc1C[N@@H+]1CCC[C@H](c3[nH]cc[nH+]3)C1)OCO2 ZINC000092073571 355617320 /nfs/dbraw/zinc/61/73/20/355617320.db2.gz QICYOYNDIWSYAR-NSHDSACASA-N 2 2 301.346 2.224 20 10 DECDLP Oc1cc2c(cc1C[N@H+]1CCC[C@H](c3[nH]cc[nH+]3)C1)OCO2 ZINC000092073571 355617325 /nfs/dbraw/zinc/61/73/25/355617325.db2.gz QICYOYNDIWSYAR-NSHDSACASA-N 2 2 301.346 2.224 20 10 DECDLP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000271868299 402884975 /nfs/dbraw/zinc/88/49/75/402884975.db2.gz WZBFVBCLFXBMKG-UHFFFAOYSA-N 2 2 312.841 2.371 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@@H](c3[nH+]ccn3C)C2)cc1OC ZINC000371366957 227070515 /nfs/dbraw/zinc/07/05/15/227070515.db2.gz QYUNPOBBXZDRCV-GFCCVEGCSA-N 2 2 317.389 2.132 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@@H](c3[nH+]ccn3C)C2)cc1OC ZINC000371366957 227070517 /nfs/dbraw/zinc/07/05/17/227070517.db2.gz QYUNPOBBXZDRCV-GFCCVEGCSA-N 2 2 317.389 2.132 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000423083694 230344351 /nfs/dbraw/zinc/34/43/51/230344351.db2.gz GISHGMGDTBUDET-OALUTQOASA-N 2 2 313.445 2.343 20 10 DECDLP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285977117 288059434 /nfs/dbraw/zinc/05/94/34/288059434.db2.gz HMARHLMJRZXVTI-BBRMVZONSA-N 2 2 309.429 2.208 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1 ZINC000835037268 649869896 /nfs/dbraw/zinc/86/98/96/649869896.db2.gz IZNOSXCIMSYNCQ-JZPMYCAGSA-N 2 2 315.461 2.219 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc1 ZINC000835037268 649869897 /nfs/dbraw/zinc/86/98/97/649869897.db2.gz IZNOSXCIMSYNCQ-JZPMYCAGSA-N 2 2 315.461 2.219 20 10 DECDLP COc1ccc(C[NH2+]CCCCn2cc[nH+]c2)c(O)c1OC ZINC000892658791 625236202 /nfs/dbraw/zinc/23/62/02/625236202.db2.gz NLGZIWKKQILAFL-UHFFFAOYSA-N 2 2 305.378 2.176 20 10 DECDLP C[N@H+](CCCO)C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000093394933 633927225 /nfs/dbraw/zinc/92/72/25/633927225.db2.gz BDVFGQLANNFWDI-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP C[N@@H+](CCCO)C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000093394933 633927228 /nfs/dbraw/zinc/92/72/28/633927228.db2.gz BDVFGQLANNFWDI-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000756359295 639653970 /nfs/dbraw/zinc/65/39/70/639653970.db2.gz DCHWPXUCNNSRTD-ZDUSSCGKSA-N 2 2 306.406 2.315 20 10 DECDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360080 641895696 /nfs/dbraw/zinc/89/56/96/641895696.db2.gz RGQZHFJKLNTEOC-OTYXRUKQSA-N 2 2 319.232 2.416 20 10 DECDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774360080 641895702 /nfs/dbraw/zinc/89/57/02/641895702.db2.gz RGQZHFJKLNTEOC-OTYXRUKQSA-N 2 2 319.232 2.416 20 10 DECDLP CCN(CC)c1ccc(C[NH2+][C@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1 ZINC000817887872 647371694 /nfs/dbraw/zinc/37/16/94/647371694.db2.gz GHHKISRPEPCCOZ-RTBURBONSA-N 2 2 317.477 2.389 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000817941451 647388724 /nfs/dbraw/zinc/38/87/24/647388724.db2.gz JTEWUBQWKXUBLY-SJORKVTESA-N 2 2 303.450 2.301 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)c1 ZINC000817983097 647399867 /nfs/dbraw/zinc/39/98/67/647399867.db2.gz YAVCWYLYSYCOMX-ABAIWWIYSA-N 2 2 306.406 2.347 20 10 DECDLP CC(C)C[NH2+]C1(CO)CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000852123454 652346742 /nfs/dbraw/zinc/34/67/42/652346742.db2.gz HPGMKTBMSITKMA-UHFFFAOYSA-N 2 2 319.493 2.325 20 10 DECDLP [NH3+][C@@H]1CC[N@H+](Cc2cccc(NCc3ccc(O)c(O)c3)c2)C1 ZINC001169996973 785839903 /nfs/dbraw/zinc/83/99/03/785839903.db2.gz OUWKSYUYFIRNMS-OAHLLOKOSA-N 2 2 313.401 2.243 20 10 DECDLP [NH3+][C@@H]1CC[N@@H+](Cc2cccc(NCc3ccc(O)c(O)c3)c2)C1 ZINC001169996973 785839912 /nfs/dbraw/zinc/83/99/12/785839912.db2.gz OUWKSYUYFIRNMS-OAHLLOKOSA-N 2 2 313.401 2.243 20 10 DECDLP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3ccc(Cl)cc3O)CC2)C1 ZINC001180262569 795267955 /nfs/dbraw/zinc/26/79/55/795267955.db2.gz ZLSHVAYXMQFTPH-MRXNPFEDSA-N 2 2 323.868 2.257 20 10 DECDLP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3ccc(Cl)cc3O)CC2)C1 ZINC001180262569 795267959 /nfs/dbraw/zinc/26/79/59/795267959.db2.gz ZLSHVAYXMQFTPH-MRXNPFEDSA-N 2 2 323.868 2.257 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[NH+]1CCC([NH+]2CCC2)CC1 ZINC001138501048 796228827 /nfs/dbraw/zinc/22/88/27/796228827.db2.gz KZQBIJOBXNLREW-UHFFFAOYSA-N 2 2 315.461 2.193 20 10 DECDLP COc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc(C[NH+](C)C)c1O ZINC001139253983 796349850 /nfs/dbraw/zinc/34/98/50/796349850.db2.gz ADUJYHNBKWZCTJ-QEJZJMRPSA-N 2 2 308.397 2.252 20 10 DECDLP COc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc(C[NH+](C)C)c1O ZINC001139253983 796349854 /nfs/dbraw/zinc/34/98/54/796349854.db2.gz ADUJYHNBKWZCTJ-QEJZJMRPSA-N 2 2 308.397 2.252 20 10 DECDLP COc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139261030 796351514 /nfs/dbraw/zinc/35/15/14/796351514.db2.gz SFDWHJQCXIZFEI-QWHCGFSZSA-N 2 2 308.422 2.072 20 10 DECDLP COc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cc(C[NH+](C)C)c1O ZINC001139261030 796351521 /nfs/dbraw/zinc/35/15/21/796351521.db2.gz SFDWHJQCXIZFEI-QWHCGFSZSA-N 2 2 308.422 2.072 20 10 DECDLP C[C@@H]1CC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C[C@@H]1[NH3+] ZINC001205880675 800437249 /nfs/dbraw/zinc/43/72/49/800437249.db2.gz OLRUFYCMFLMOKW-KOLCDFICSA-N 2 2 304.312 2.460 20 10 DECDLP C[C@@H]1CC[N@@H+](Cc2cccc(OC(F)(F)F)c2O)C[C@@H]1[NH3+] ZINC001205880675 800437251 /nfs/dbraw/zinc/43/72/51/800437251.db2.gz OLRUFYCMFLMOKW-KOLCDFICSA-N 2 2 304.312 2.460 20 10 DECDLP CC[NH+](CC)C1CC[NH+](Cc2cc(OC)c(O)cc2O)CC1 ZINC001231636339 801700789 /nfs/dbraw/zinc/70/07/89/801700789.db2.gz SREDXJMFHYYSJZ-UHFFFAOYSA-N 2 2 308.422 2.413 20 10 DECDLP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccc(Cl)c1O ZINC001231911689 801749283 /nfs/dbraw/zinc/74/92/83/801749283.db2.gz OVGULGPXZDGRMN-JKSUJKDBSA-N 2 2 323.868 2.256 20 10 DECDLP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccc(Cl)c1O ZINC001231911689 801749285 /nfs/dbraw/zinc/74/92/85/801749285.db2.gz OVGULGPXZDGRMN-JKSUJKDBSA-N 2 2 323.868 2.256 20 10 DECDLP CC(C)(C)c1cccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c1O ZINC001222502729 802696330 /nfs/dbraw/zinc/69/63/30/802696330.db2.gz QZRXHYNKIYDRRH-IRXDYDNUSA-N 2 2 317.477 2.216 20 10 DECDLP Cc1cc(Br)c(O)c(C[NH2+]CCn2cc[nH+]c2)c1 ZINC001648698598 1075005796 /nfs/dbraw/zinc/00/57/96/1075005796.db2.gz VXOVUVJDTYRCSF-UHFFFAOYSA-N 2 2 310.195 2.449 20 10 DECDLP Oc1c(Cl)cccc1C[NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC001580886132 1076014508 /nfs/dbraw/zinc/01/45/08/1076014508.db2.gz ZXDHCLMBYJBEPJ-ZDUSSCGKSA-N 2 2 310.825 2.294 20 10 DECDLP C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319932050 1140804770 /nfs/dbraw/zinc/80/47/70/1140804770.db2.gz HGNSZLIHBBYDET-CABCVRRESA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319932050 1140804771 /nfs/dbraw/zinc/80/47/71/1140804771.db2.gz HGNSZLIHBBYDET-CABCVRRESA-N 2 2 321.440 2.187 20 10 DECDLP CC[NH+](CC)C[C@@H](O)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001253189852 1142851690 /nfs/dbraw/zinc/85/16/90/1142851690.db2.gz LPMMROSFTYTALU-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](CC)C[C@@H](O)C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001253189852 1142851691 /nfs/dbraw/zinc/85/16/91/1142851691.db2.gz LPMMROSFTYTALU-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](CC)CCC[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278478713 402867162 /nfs/dbraw/zinc/86/71/62/402867162.db2.gz IZLAJFIOJPVEIP-UHFFFAOYSA-N 2 2 311.382 2.131 20 10 DECDLP Cc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)ccc1N(C)C ZINC000292890432 403380927 /nfs/dbraw/zinc/38/09/27/403380927.db2.gz VBTBVDYBBBPXCL-GOSISDBHSA-N 2 2 317.477 2.215 20 10 DECDLP Cc1cc(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)ccc1N(C)C ZINC000292890432 403380930 /nfs/dbraw/zinc/38/09/30/403380930.db2.gz VBTBVDYBBBPXCL-GOSISDBHSA-N 2 2 317.477 2.215 20 10 DECDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000311211904 625303360 /nfs/dbraw/zinc/30/33/60/625303360.db2.gz LMRJEHXCWSADQF-MFKMUULPSA-N 2 2 311.223 2.339 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000311211904 625303364 /nfs/dbraw/zinc/30/33/64/625303364.db2.gz LMRJEHXCWSADQF-MFKMUULPSA-N 2 2 311.223 2.339 20 10 DECDLP COc1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)c1OC ZINC000891841837 624625767 /nfs/dbraw/zinc/62/57/67/624625767.db2.gz HCQCVNLULBWSGF-UHFFFAOYSA-N 2 2 317.389 2.443 20 10 DECDLP CCO[C@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C[NH+](C)C ZINC000922756948 636380031 /nfs/dbraw/zinc/38/00/31/636380031.db2.gz VJCKMVVWZIEAGF-GFCCVEGCSA-N 2 2 300.830 2.410 20 10 DECDLP Cc1cc(Br)cc(C[NH2+]C[C@@H]2C[C@H](F)C[NH2+]2)c1O ZINC000841077610 643426468 /nfs/dbraw/zinc/42/64/68/643426468.db2.gz DDRYFRQLLCUSLI-RYUDHWBXSA-N 2 2 317.202 2.253 20 10 DECDLP CN(C)c1ccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)cc1F ZINC000903973416 643531071 /nfs/dbraw/zinc/53/10/71/643531071.db2.gz CQBCVOJMJRRBQJ-HNNXBMFYSA-N 2 2 321.440 2.140 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1Cl ZINC000825247188 648731068 /nfs/dbraw/zinc/73/10/68/648731068.db2.gz OEOFDJFTNWPRED-KGLIPLIRSA-N 2 2 310.825 2.307 20 10 DECDLP Cc1cc(O)c(C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)cc1Cl ZINC000825247188 648731072 /nfs/dbraw/zinc/73/10/72/648731072.db2.gz OEOFDJFTNWPRED-KGLIPLIRSA-N 2 2 310.825 2.307 20 10 DECDLP COc1ccc(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929101 651564890 /nfs/dbraw/zinc/56/48/90/651564890.db2.gz ANHOCLXTQLJACA-INIZCTEOSA-N 2 2 320.433 2.088 20 10 DECDLP COc1ccc(O)c(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929101 651564891 /nfs/dbraw/zinc/56/48/91/651564891.db2.gz ANHOCLXTQLJACA-INIZCTEOSA-N 2 2 320.433 2.088 20 10 DECDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929819 651565779 /nfs/dbraw/zinc/56/57/79/651565779.db2.gz JKSYKEAGHJMXCM-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP Cc1ccc(O)c(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)c1 ZINC000848929819 651565782 /nfs/dbraw/zinc/56/57/82/651565782.db2.gz JKSYKEAGHJMXCM-KRWDZBQOSA-N 2 2 304.434 2.387 20 10 DECDLP [NH3+]C[C@@H]1C[N@H+](Cc2cccc(F)c2O)CC[C@@H]1C(F)(F)F ZINC000863645470 686539411 /nfs/dbraw/zinc/53/94/11/686539411.db2.gz IBWCUICTILEQQO-MNOVXSKESA-N 2 2 306.303 2.490 20 10 DECDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(F)c2O)CC[C@@H]1C(F)(F)F ZINC000863645470 686539416 /nfs/dbraw/zinc/53/94/16/686539416.db2.gz IBWCUICTILEQQO-MNOVXSKESA-N 2 2 306.303 2.490 20 10 DECDLP CCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877635750 690174692 /nfs/dbraw/zinc/17/46/92/690174692.db2.gz CUSRSXHWFCYYRV-KRWDZBQOSA-N 2 2 317.477 2.222 20 10 DECDLP CCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877635750 690174696 /nfs/dbraw/zinc/17/46/96/690174696.db2.gz CUSRSXHWFCYYRV-KRWDZBQOSA-N 2 2 317.477 2.222 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]([NH3+])[C@H](F)CC1 ZINC001206173477 793477565 /nfs/dbraw/zinc/47/75/65/793477565.db2.gz HMIVRQOYTCOZQI-ZIAGYGMSSA-N 2 2 320.364 2.068 20 10 DECDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]([NH3+])[C@H](F)CC1 ZINC001206173477 793477567 /nfs/dbraw/zinc/47/75/67/793477567.db2.gz HMIVRQOYTCOZQI-ZIAGYGMSSA-N 2 2 320.364 2.068 20 10 DECDLP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c(O)c1Cl ZINC001206201589 793734237 /nfs/dbraw/zinc/73/42/37/793734237.db2.gz XXOHHHZBHMNSPE-WDEREUQCSA-N 2 2 302.777 2.315 20 10 DECDLP COc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c(O)c1Cl ZINC001206201589 793734245 /nfs/dbraw/zinc/73/42/45/793734245.db2.gz XXOHHHZBHMNSPE-WDEREUQCSA-N 2 2 302.777 2.315 20 10 DECDLP Oc1cccc(Br)c1C[NH2+][C@@H]1CCn2cc[nH+]c2C1 ZINC001118852442 795232787 /nfs/dbraw/zinc/23/27/87/795232787.db2.gz LDHMCZXLCVGXMG-SNVBAGLBSA-N 2 2 322.206 2.456 20 10 DECDLP CN(Cc1ccc[nH+]c1N)c1ccc(OCC[NH+](C)C)cc1 ZINC001462050724 1058755647 /nfs/dbraw/zinc/75/56/47/1058755647.db2.gz IEKLKTGLQMFCAP-UHFFFAOYSA-N 2 2 300.406 2.241 20 10 DECDLP COc1cncc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC001579321685 1067304277 /nfs/dbraw/zinc/30/42/77/1067304277.db2.gz MYOYJXRQHXMHRS-QGZVFWFLSA-N 2 2 314.433 2.254 20 10 DECDLP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@]3(C[NH2+]CCO3)C2)cc1 ZINC001235114108 1084316135 /nfs/dbraw/zinc/31/61/35/1084316135.db2.gz JXZAOEOOIUSQLF-LJQANCHMSA-N 2 2 317.477 2.487 20 10 DECDLP CCN(CC)c1ccc(C[N@H+]2CCC[C@@]3(C[NH2+]CCO3)C2)cc1 ZINC001235114108 1084316142 /nfs/dbraw/zinc/31/61/42/1084316142.db2.gz JXZAOEOOIUSQLF-LJQANCHMSA-N 2 2 317.477 2.487 20 10 DECDLP COc1cc(O)c(C[NH+]2CCC([NH+]3CCC3)CC2)cc1OC ZINC001236755709 1138409946 /nfs/dbraw/zinc/40/99/46/1138409946.db2.gz HFVKLDVISOOYIH-UHFFFAOYSA-N 2 2 306.406 2.080 20 10 DECDLP COc1cccc(C[NH+]2CCC(C)([NH+]3CCOCC3)CC2)c1O ZINC000529665482 284234949 /nfs/dbraw/zinc/23/49/49/284234949.db2.gz YONKGVAWYHSCFZ-UHFFFAOYSA-N 2 2 320.433 2.088 20 10 DECDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000093018008 402010642 /nfs/dbraw/zinc/01/06/42/402010642.db2.gz BCZVDSRCUKDRCR-INIZCTEOSA-N 2 2 304.434 2.245 20 10 DECDLP Cc1ccc(O)c(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000093018008 402010646 /nfs/dbraw/zinc/01/06/46/402010646.db2.gz BCZVDSRCUKDRCR-INIZCTEOSA-N 2 2 304.434 2.245 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@@H]3CCC[N@@H+]3C)CC2)cc1F ZINC000125177418 402217807 /nfs/dbraw/zinc/21/78/07/402217807.db2.gz GJXFQOVYUHLAQO-HNNXBMFYSA-N 2 2 321.440 2.441 20 10 DECDLP COc1ccc(N2CC[NH+](CC[C@@H]3CCC[N@H+]3C)CC2)cc1F ZINC000125177418 402217808 /nfs/dbraw/zinc/21/78/08/402217808.db2.gz GJXFQOVYUHLAQO-HNNXBMFYSA-N 2 2 321.440 2.441 20 10 DECDLP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)N1CC[NH+](C)CC1 ZINC000170789711 402525676 /nfs/dbraw/zinc/52/56/76/402525676.db2.gz QIWOZJISAXWEAU-PBHICJAKSA-N 2 2 323.456 2.454 20 10 DECDLP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000296164556 404124059 /nfs/dbraw/zinc/12/40/59/404124059.db2.gz XKJMEBRMVJWYEF-IJEWVQPXSA-N 2 2 304.434 2.468 20 10 DECDLP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000296164556 404124064 /nfs/dbraw/zinc/12/40/64/404124064.db2.gz XKJMEBRMVJWYEF-IJEWVQPXSA-N 2 2 304.434 2.468 20 10 DECDLP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000286323384 286909346 /nfs/dbraw/zinc/90/93/46/286909346.db2.gz XQRXDSDKSRMYDR-RHSMWYFYSA-N 2 2 323.456 2.456 20 10 DECDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc(OC)c(OC)cc1O ZINC000180697434 521722648 /nfs/dbraw/zinc/72/26/48/521722648.db2.gz VIOWTJCGWZPIPX-CABCVRRESA-N 2 2 320.433 2.468 20 10 DECDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc(OC)c(OC)cc1O ZINC000180697434 521722649 /nfs/dbraw/zinc/72/26/49/521722649.db2.gz VIOWTJCGWZPIPX-CABCVRRESA-N 2 2 320.433 2.468 20 10 DECDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(OC)c(OC)cc1O ZINC000180697434 521722651 /nfs/dbraw/zinc/72/26/51/521722651.db2.gz VIOWTJCGWZPIPX-CABCVRRESA-N 2 2 320.433 2.468 20 10 DECDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(OC)c(OC)cc1O ZINC000180697434 521722653 /nfs/dbraw/zinc/72/26/53/521722653.db2.gz VIOWTJCGWZPIPX-CABCVRRESA-N 2 2 320.433 2.468 20 10 DECDLP Cc1cc(Br)cc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1O ZINC000775747728 642089024 /nfs/dbraw/zinc/08/90/24/642089024.db2.gz MYWSAKOMPSUEKQ-RYUDHWBXSA-N 2 2 311.223 2.114 20 10 DECDLP Oc1c(C[NH2+]CCC[NH+]2CCC(O)CC2)ccc2ccccc21 ZINC000816538049 647148954 /nfs/dbraw/zinc/14/89/54/647148954.db2.gz CBKIUWDODMLWEZ-UHFFFAOYSA-N 2 2 314.429 2.482 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1cccc(C(F)(F)F)c1O ZINC000817983191 647400914 /nfs/dbraw/zinc/40/09/14/647400914.db2.gz ZCRCKQQNZOWFLU-GHMZBOCLSA-N 2 2 318.339 2.440 20 10 DECDLP Cc1cc(O)c(C[NH+]2CCN(c3[nH+]ccn3C)CC2)cc1Cl ZINC000827885323 649099132 /nfs/dbraw/zinc/09/91/32/649099132.db2.gz WZRFSOUZBLFDAN-UHFFFAOYSA-N 2 2 320.824 2.410 20 10 DECDLP CN(C)c1cc(F)c(C[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)cc1F ZINC000858165858 652270110 /nfs/dbraw/zinc/27/01/10/652270110.db2.gz PESILCDQRISUQU-LLVKDONJSA-N 2 2 306.360 2.401 20 10 DECDLP CCCOC1C[NH+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140303877 777044178 /nfs/dbraw/zinc/04/41/78/777044178.db2.gz CKCQSAUQRGBPFI-UHFFFAOYSA-N 2 2 317.477 2.439 20 10 DECDLP COc1cc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc(C[NH+](C)C)c1O ZINC001139253474 796348971 /nfs/dbraw/zinc/34/89/71/796348971.db2.gz VNLWAVCTBQIGAK-STQMWFEESA-N 2 2 308.422 2.072 20 10 DECDLP COc1cc(C[N@H+](C)Cc2ccno2)cc(C[NH+](C)C)c1O ZINC001139258972 796351377 /nfs/dbraw/zinc/35/13/77/796351377.db2.gz COIIFWKCNALQOE-UHFFFAOYSA-N 2 2 305.378 2.082 20 10 DECDLP COc1cc(C[N@@H+](C)Cc2ccno2)cc(C[NH+](C)C)c1O ZINC001139258972 796351382 /nfs/dbraw/zinc/35/13/82/796351382.db2.gz COIIFWKCNALQOE-UHFFFAOYSA-N 2 2 305.378 2.082 20 10 DECDLP CC[NH+]1CCC([N@H+](C)Cc2c(O)cc(OC)cc2OC)CC1 ZINC001141028298 796619933 /nfs/dbraw/zinc/61/99/33/796619933.db2.gz JWKCGABWZVRTIW-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP CC[NH+]1CCC([N@@H+](C)Cc2c(O)cc(OC)cc2OC)CC1 ZINC001141028298 796619935 /nfs/dbraw/zinc/61/99/35/796619935.db2.gz JWKCGABWZVRTIW-UHFFFAOYSA-N 2 2 308.422 2.326 20 10 DECDLP Oc1cc(OCC(F)(F)F)ccc1C[N@@H+]1CCC[NH2+]CC1 ZINC001204685150 800246422 /nfs/dbraw/zinc/24/64/22/800246422.db2.gz UMVSCSPBSBYLKC-UHFFFAOYSA-N 2 2 304.312 2.129 20 10 DECDLP Oc1cc(OCC(F)(F)F)ccc1C[N@H+]1CCC[NH2+]CC1 ZINC001204685150 800246425 /nfs/dbraw/zinc/24/64/25/800246425.db2.gz UMVSCSPBSBYLKC-UHFFFAOYSA-N 2 2 304.312 2.129 20 10 DECDLP C[C@@H]1[C@H]([NH3+])CC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001205197658 800314057 /nfs/dbraw/zinc/31/40/57/800314057.db2.gz YLEKWFRWCDROJS-BXKDBHETSA-N 2 2 304.312 2.255 20 10 DECDLP C[C@@H]1[C@H]([NH3+])CC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1O ZINC001205197658 800314062 /nfs/dbraw/zinc/31/40/62/800314062.db2.gz YLEKWFRWCDROJS-BXKDBHETSA-N 2 2 304.312 2.255 20 10 DECDLP COc1cc(O)c(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c(Cl)c1 ZINC001206200719 800488279 /nfs/dbraw/zinc/48/82/79/800488279.db2.gz SSJRGIPQRPYPCG-CHWSQXEVSA-N 2 2 302.777 2.315 20 10 DECDLP COc1cc(O)c(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c(Cl)c1 ZINC001206200719 800488283 /nfs/dbraw/zinc/48/82/83/800488283.db2.gz SSJRGIPQRPYPCG-CHWSQXEVSA-N 2 2 302.777 2.315 20 10 DECDLP C[C@@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001650630238 1079764666 /nfs/dbraw/zinc/76/46/66/1079764666.db2.gz IUELDFXRLPMFBQ-QGZVFWFLSA-N 3 2 316.493 2.012 20 10 DECDLP C[C@@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001650630238 1079764672 /nfs/dbraw/zinc/76/46/72/1079764672.db2.gz IUELDFXRLPMFBQ-QGZVFWFLSA-N 3 2 316.493 2.012 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc2ccccc2c1O)[C@@H]1C[N@H+](C)CCN1C ZINC001660047334 1080259779 /nfs/dbraw/zinc/25/97/79/1080259779.db2.gz IVJOGPATGPGGIX-KDOFPFPSSA-N 2 2 313.445 2.269 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc2ccccc2c1O)[C@@H]1C[N@@H+](C)CCN1C ZINC001660047334 1080259789 /nfs/dbraw/zinc/25/97/89/1080259789.db2.gz IVJOGPATGPGGIX-KDOFPFPSSA-N 2 2 313.445 2.269 20 10 DECDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)ccc1O ZINC001275914108 1092300519 /nfs/dbraw/zinc/30/05/19/1092300519.db2.gz VIAJTHKRLQVXMG-ALOPSCKCSA-N 2 2 321.440 2.178 20 10 DECDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(F)ccc1O ZINC001275914108 1092300530 /nfs/dbraw/zinc/30/05/30/1092300530.db2.gz VIAJTHKRLQVXMG-ALOPSCKCSA-N 2 2 321.440 2.178 20 10 DECDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCCn2cc[nH+]c2)c1 ZINC000273303866 130105138 /nfs/dbraw/zinc/10/51/38/130105138.db2.gz CFJADZXSGPZEEG-GFCCVEGCSA-N 2 2 303.362 2.116 20 10 DECDLP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000185343844 402345441 /nfs/dbraw/zinc/34/54/41/402345441.db2.gz YJCKBEWUQORPNW-UONOGXRCSA-N 2 2 309.429 2.065 20 10 DECDLP C[C@@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCOCC2)c(F)c1 ZINC000155668856 525469577 /nfs/dbraw/zinc/46/95/77/525469577.db2.gz VPLPPFVAIORTBQ-CQSZACIVSA-N 2 2 318.396 2.210 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCC[N@@H+]2CCCO)cc1 ZINC000835055813 649873026 /nfs/dbraw/zinc/87/30/26/649873026.db2.gz ZMJMRGDWKJYXTA-ORUDLHBZSA-N 2 2 317.477 2.202 20 10 DECDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCC[N@H+]2CCCO)cc1 ZINC000835055813 649873027 /nfs/dbraw/zinc/87/30/27/649873027.db2.gz ZMJMRGDWKJYXTA-ORUDLHBZSA-N 2 2 317.477 2.202 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@H]3C[C@@H]3C)CC2)cc1 ZINC000754131291 639392416 /nfs/dbraw/zinc/39/24/16/639392416.db2.gz VAXKKNVBLFPPTM-DLBZAZTESA-N 2 2 317.477 2.453 20 10 DECDLP [NH3+][C@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000841034975 640889244 /nfs/dbraw/zinc/88/92/44/640889244.db2.gz FSQLYBFUDWRQEX-LJQANCHMSA-N 2 2 311.429 2.313 20 10 DECDLP CC[C@@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810216212 646340253 /nfs/dbraw/zinc/34/02/53/646340253.db2.gz FUHSPPDKVNRHJM-DGCLKSJQSA-N 2 2 320.355 2.374 20 10 DECDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616377 647036316 /nfs/dbraw/zinc/03/63/16/647036316.db2.gz NEZYHXGQMRTEJH-QMTHXVAHSA-N 2 2 318.339 2.128 20 10 DECDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815616377 647036320 /nfs/dbraw/zinc/03/63/20/647036320.db2.gz NEZYHXGQMRTEJH-QMTHXVAHSA-N 2 2 318.339 2.128 20 10 DECDLP Cc1cc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)n(C)n1 ZINC000817942413 647388984 /nfs/dbraw/zinc/38/89/84/647388984.db2.gz ORKXIQFCNHBQTR-XJKSGUPXSA-N 2 2 301.438 2.145 20 10 DECDLP Oc1cc(Br)ccc1C[NH2+][C@H]1CCn2cc[nH+]c2C1 ZINC000825563365 648781244 /nfs/dbraw/zinc/78/12/44/648781244.db2.gz WIEIGAZOKLNNSZ-LBPRGKRZSA-N 2 2 322.206 2.456 20 10 DECDLP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000125503256 684146232 /nfs/dbraw/zinc/14/62/32/684146232.db2.gz VYQCTEXWTLPXOT-INIZCTEOSA-N 2 2 321.440 2.046 20 10 DECDLP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000125503256 684146234 /nfs/dbraw/zinc/14/62/34/684146234.db2.gz VYQCTEXWTLPXOT-INIZCTEOSA-N 2 2 321.440 2.046 20 10 DECDLP CC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876881998 689963149 /nfs/dbraw/zinc/96/31/49/689963149.db2.gz WGAVEPJZTZECOT-SFHVURJKSA-N 2 2 317.477 2.222 20 10 DECDLP CC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876881998 689963151 /nfs/dbraw/zinc/96/31/51/689963151.db2.gz WGAVEPJZTZECOT-SFHVURJKSA-N 2 2 317.477 2.222 20 10 DECDLP CC[N@H+]([C@H]1CCOC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278585 795362123 /nfs/dbraw/zinc/36/21/23/795362123.db2.gz GAYRJWWXGVNVLR-INIZCTEOSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278585 795362131 /nfs/dbraw/zinc/36/21/31/795362131.db2.gz GAYRJWWXGVNVLR-INIZCTEOSA-N 2 2 320.433 2.173 20 10 DECDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)c(C)c3)C[C@@H]2C1 ZINC001139670576 796107849 /nfs/dbraw/zinc/10/78/49/796107849.db2.gz CXENHHDAEJQAKI-PKOBYXMFSA-N 2 2 317.477 2.214 20 10 DECDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)c(C)c3)C[C@@H]2C1 ZINC001139670576 796107853 /nfs/dbraw/zinc/10/78/53/796107853.db2.gz CXENHHDAEJQAKI-PKOBYXMFSA-N 2 2 317.477 2.214 20 10 DECDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(N(C)C)c(C)c3)C[C@@H]2C1 ZINC001139670576 796107856 /nfs/dbraw/zinc/10/78/56/796107856.db2.gz CXENHHDAEJQAKI-PKOBYXMFSA-N 2 2 317.477 2.214 20 10 DECDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(N(C)C)c(C)c3)C[C@@H]2C1 ZINC001139670576 796107859 /nfs/dbraw/zinc/10/78/59/796107859.db2.gz CXENHHDAEJQAKI-PKOBYXMFSA-N 2 2 317.477 2.214 20 10 DECDLP COc1cc(C[N@@H+]2CCCC[C@@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139259360 796351717 /nfs/dbraw/zinc/35/17/17/796351717.db2.gz SPRZYOCSHNYSAB-MRXNPFEDSA-N 2 2 320.433 2.406 20 10 DECDLP COc1cc(C[N@H+]2CCCC[C@@H]2C(C)=O)cc(C[NH+](C)C)c1O ZINC001139259360 796351720 /nfs/dbraw/zinc/35/17/20/796351720.db2.gz SPRZYOCSHNYSAB-MRXNPFEDSA-N 2 2 320.433 2.406 20 10 DECDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCCCO4)cc2)CC1 ZINC001139409021 796373097 /nfs/dbraw/zinc/37/30/97/796373097.db2.gz SBBPRYBGTMHHHR-UHFFFAOYSA-N 2 2 315.461 2.193 20 10 DECDLP CC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCOCC2)cc1F ZINC001140664605 796553333 /nfs/dbraw/zinc/55/33/33/796553333.db2.gz NDPUZYFZUDFBSY-UHFFFAOYSA-N 2 2 323.456 2.436 20 10 DECDLP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(N2CCOCC2)cc1F ZINC001140664605 796553336 /nfs/dbraw/zinc/55/33/36/796553336.db2.gz NDPUZYFZUDFBSY-UHFFFAOYSA-N 2 2 323.456 2.436 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H](C)O1 ZINC001254247377 1143065427 /nfs/dbraw/zinc/06/54/27/1143065427.db2.gz ZLDOBAPEDRHXEY-GASCZTMLSA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H](C)O1 ZINC001254247377 1143065433 /nfs/dbraw/zinc/06/54/33/1143065433.db2.gz ZLDOBAPEDRHXEY-GASCZTMLSA-N 2 2 321.440 2.187 20 10 DECDLP COc1cccc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1O ZINC000093866104 355689207 /nfs/dbraw/zinc/68/92/07/355689207.db2.gz YTRQUJQFJLLRPL-OAHLLOKOSA-N 2 2 300.358 2.449 20 10 DECDLP COc1cccc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1O ZINC000093866104 355689210 /nfs/dbraw/zinc/68/92/10/355689210.db2.gz YTRQUJQFJLLRPL-OAHLLOKOSA-N 2 2 300.358 2.449 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592793 130142512 /nfs/dbraw/zinc/14/25/12/130142512.db2.gz PQUNOARZOKNHJA-PBHICJAKSA-N 2 2 317.477 2.167 20 10 DECDLP C[C@@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592793 130142514 /nfs/dbraw/zinc/14/25/14/130142514.db2.gz PQUNOARZOKNHJA-PBHICJAKSA-N 2 2 317.477 2.167 20 10 DECDLP COCC[N@@H+]1CCC[C@@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036103 649870000 /nfs/dbraw/zinc/87/00/00/649870000.db2.gz HSSZLNOKHVLBMT-GJEJWFRCSA-N 2 2 317.477 2.466 20 10 DECDLP COCC[N@H+]1CCC[C@@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036103 649870002 /nfs/dbraw/zinc/87/00/02/649870002.db2.gz HSSZLNOKHVLBMT-GJEJWFRCSA-N 2 2 317.477 2.466 20 10 DECDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000306076735 623110231 /nfs/dbraw/zinc/11/02/31/623110231.db2.gz GNVZBSPXJRJEDF-AWEZNQCLSA-N 2 2 311.223 2.340 20 10 DECDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000306076735 623110233 /nfs/dbraw/zinc/11/02/33/623110233.db2.gz GNVZBSPXJRJEDF-AWEZNQCLSA-N 2 2 311.223 2.340 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1csnn1 ZINC000840970717 650396906 /nfs/dbraw/zinc/39/69/06/650396906.db2.gz VVKBRAUTZKRZGG-ZDUSSCGKSA-N 2 2 317.462 2.141 20 10 DECDLP [NH3+]C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000841028338 650407988 /nfs/dbraw/zinc/40/79/88/650407988.db2.gz OWFQPIZXLZKADM-OAHLLOKOSA-N 2 2 318.421 2.412 20 10 DECDLP COC[C@]1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CCC[NH2+]1 ZINC000841067913 650420929 /nfs/dbraw/zinc/42/09/29/650420929.db2.gz QMCBIMPSDNJPEN-WLPBJKJWSA-N 2 2 303.450 2.124 20 10 DECDLP CCO[C@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)C[NH+](C)C ZINC000896876221 638748465 /nfs/dbraw/zinc/74/84/65/638748465.db2.gz CFQLWAYPCULQTN-CYBMUJFWSA-N 2 2 300.830 2.410 20 10 DECDLP COc1ccc(N(C)CC[N@H+](C)C[C@@H]([NH3+])CC(F)F)cc1 ZINC000903931359 643513167 /nfs/dbraw/zinc/51/31/67/643513167.db2.gz BSLOUDJRIVCOGP-LBPRGKRZSA-N 2 2 301.381 2.046 20 10 DECDLP COc1ccc(N(C)CC[N@@H+](C)C[C@@H]([NH3+])CC(F)F)cc1 ZINC000903931359 643513171 /nfs/dbraw/zinc/51/31/71/643513171.db2.gz BSLOUDJRIVCOGP-LBPRGKRZSA-N 2 2 301.381 2.046 20 10 DECDLP CCOc1ccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)c(O)c1 ZINC000903973206 643531078 /nfs/dbraw/zinc/53/10/78/643531078.db2.gz BGERSWRQKHGXKL-OAHLLOKOSA-N 2 2 320.433 2.039 20 10 DECDLP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](O)C[NH+]2CCCC2)c1O ZINC000808680189 646127126 /nfs/dbraw/zinc/12/71/26/646127126.db2.gz JBKKPOMTHHTESQ-OCCSQVGLSA-N 2 2 312.841 2.461 20 10 DECDLP Cn1c[nH+]cc1CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000809575925 646239415 /nfs/dbraw/zinc/23/94/15/646239415.db2.gz NGANQWZDVFDTMJ-KRWDZBQOSA-N 2 2 315.417 2.349 20 10 DECDLP Cn1c[nH+]cc1CC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000809575925 646239421 /nfs/dbraw/zinc/23/94/21/646239421.db2.gz NGANQWZDVFDTMJ-KRWDZBQOSA-N 2 2 315.417 2.349 20 10 DECDLP Oc1c(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)ccc2ccccc21 ZINC000816548476 647150731 /nfs/dbraw/zinc/15/07/31/647150731.db2.gz JGEQCWVDZOVVJL-DLBZAZTESA-N 2 2 312.413 2.498 20 10 DECDLP Oc1c(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc2ccccc21 ZINC000816548476 647150733 /nfs/dbraw/zinc/15/07/33/647150733.db2.gz JGEQCWVDZOVVJL-DLBZAZTESA-N 2 2 312.413 2.498 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCC[NH2+]1 ZINC000817893082 647373963 /nfs/dbraw/zinc/37/39/63/647373963.db2.gz DNICTRBYGNIUFI-CXAGYDPISA-N 2 2 321.440 2.017 20 10 DECDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1CC[NH+](C)CC1 ZINC000817938604 647388041 /nfs/dbraw/zinc/38/80/41/647388041.db2.gz OGCZGXSYPSYHSS-KBXCAEBGSA-N 3 2 304.482 2.072 20 10 DECDLP COc1cccc([C@@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1O ZINC000850554956 651952723 /nfs/dbraw/zinc/95/27/23/651952723.db2.gz FTCUWMICSSTDJI-UKRRQHHQSA-N 2 2 320.433 2.305 20 10 DECDLP CCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000389261140 685433029 /nfs/dbraw/zinc/43/30/29/685433029.db2.gz ORROLKOLHLZSEZ-QGZVFWFLSA-N 2 2 303.450 2.097 20 10 DECDLP CCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000389261140 685433034 /nfs/dbraw/zinc/43/30/34/685433034.db2.gz ORROLKOLHLZSEZ-QGZVFWFLSA-N 2 2 303.450 2.097 20 10 DECDLP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)c1ccc(N2CCOCC2)cc1 ZINC000863540209 686517520 /nfs/dbraw/zinc/51/75/20/686517520.db2.gz CITGBLJWXLXWKX-MAUKXSAKSA-N 2 2 315.461 2.458 20 10 DECDLP Oc1cccc2c1[C@@H]([NH2+][C@@H]1C[NH2+]CC3(CCOCC3)C1)CC2 ZINC000925796123 693343919 /nfs/dbraw/zinc/34/39/19/693343919.db2.gz KSPOMKKTLAEJSC-GJZGRUSLSA-N 2 2 302.418 2.128 20 10 DECDLP Oc1cccc(Br)c1C[NH2+][C@H]1CCn2cc[nH+]c2C1 ZINC001118852441 795233214 /nfs/dbraw/zinc/23/32/14/795233214.db2.gz LDHMCZXLCVGXMG-JTQLQIEISA-N 2 2 322.206 2.456 20 10 DECDLP Cc1ccc(C[N@@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c(O)c1 ZINC001140952566 796606431 /nfs/dbraw/zinc/60/64/31/796606431.db2.gz XPSTUGGJBVPRQZ-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP Cc1ccc(C[N@H+]2CCc3onc(Cn4cc[nH+]c4)c3C2)c(O)c1 ZINC001140952566 796606435 /nfs/dbraw/zinc/60/64/35/796606435.db2.gz XPSTUGGJBVPRQZ-UHFFFAOYSA-N 2 2 324.384 2.492 20 10 DECDLP CCOc1cccc(C[N@H+](CCOC)C2CC[NH+](C)CC2)c1O ZINC001203609233 800089185 /nfs/dbraw/zinc/08/91/85/800089185.db2.gz CXBWUTHTKIURBG-UHFFFAOYSA-N 2 2 322.449 2.334 20 10 DECDLP CCOc1cccc(C[N@@H+](CCOC)C2CC[NH+](C)CC2)c1O ZINC001203609233 800089192 /nfs/dbraw/zinc/08/91/92/800089192.db2.gz CXBWUTHTKIURBG-UHFFFAOYSA-N 2 2 322.449 2.334 20 10 DECDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC001648780005 1075009341 /nfs/dbraw/zinc/00/93/41/1075009341.db2.gz RNKNYRDZPRSBCI-CQSZACIVSA-N 2 2 318.396 2.037 20 10 DECDLP Oc1c(Cl)cccc1C[NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC001580886131 1076014535 /nfs/dbraw/zinc/01/45/35/1076014535.db2.gz ZXDHCLMBYJBEPJ-CYBMUJFWSA-N 2 2 310.825 2.294 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@H]([NH3+])C3(COC3)C2)c2ccccc21 ZINC001237176694 1138515283 /nfs/dbraw/zinc/51/52/83/1138515283.db2.gz SNNDKZLUKBWSGG-SFHVURJKSA-N 2 2 311.429 2.065 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@H]([NH3+])C3(COC3)C2)c2ccccc21 ZINC001237176694 1138515302 /nfs/dbraw/zinc/51/53/02/1138515302.db2.gz SNNDKZLUKBWSGG-SFHVURJKSA-N 2 2 311.429 2.065 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592799 130141314 /nfs/dbraw/zinc/14/13/14/130141314.db2.gz PQUNOARZOKNHJA-WMLDXEAASA-N 2 2 317.477 2.167 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)CCN1C)c1cc2c(cc1O)CCCC2 ZINC000273592799 130141315 /nfs/dbraw/zinc/14/13/15/130141315.db2.gz PQUNOARZOKNHJA-WMLDXEAASA-N 2 2 317.477 2.167 20 10 DECDLP C[C@@H]1C[NH+](CCC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@@H](C)O1 ZINC000296164554 404123421 /nfs/dbraw/zinc/12/34/21/404123421.db2.gz XKJMEBRMVJWYEF-IIAWOOMASA-N 2 2 304.434 2.468 20 10 DECDLP COc1cc(O)c(C[N@H+](C)CCCn2cc[nH+]c2)cc1OC ZINC000160447792 522771074 /nfs/dbraw/zinc/77/10/74/522771074.db2.gz RJGGKXOHLQOAGM-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP COc1cc(O)c(C[N@@H+](C)CCCn2cc[nH+]c2)cc1OC ZINC000160447792 522771075 /nfs/dbraw/zinc/77/10/75/522771075.db2.gz RJGGKXOHLQOAGM-UHFFFAOYSA-N 2 2 305.378 2.128 20 10 DECDLP CCO[C@@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)C[NH+](C)C ZINC000922756950 636379569 /nfs/dbraw/zinc/37/95/69/636379569.db2.gz VJCKMVVWZIEAGF-LBPRGKRZSA-N 2 2 300.830 2.410 20 10 DECDLP C[C@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)Cn1cc[nH+]c1 ZINC000067500749 639188523 /nfs/dbraw/zinc/18/85/23/639188523.db2.gz GMWHSVJQMSHIIN-MRXNPFEDSA-N 2 2 314.433 2.146 20 10 DECDLP CCn1c[nH+]cc1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC000841874129 650588523 /nfs/dbraw/zinc/58/85/23/650588523.db2.gz KVDBHWQUBWXMLK-UHFFFAOYSA-N 2 2 302.422 2.480 20 10 DECDLP CN(Cc1ccc(N)[nH+]c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000843071115 650884614 /nfs/dbraw/zinc/88/46/14/650884614.db2.gz YXXJGFFIHFFLFM-UHFFFAOYSA-N 2 2 300.406 2.241 20 10 DECDLP C[C@@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)cc1 ZINC000817892837 647373850 /nfs/dbraw/zinc/37/38/50/647373850.db2.gz WERZZUVMYDRIFX-IIDMSEBBSA-N 2 2 303.450 2.314 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817895830 647375093 /nfs/dbraw/zinc/37/50/93/647375093.db2.gz WTUVTEMEOXWDNJ-DNVCBOLYSA-N 2 2 317.477 2.125 20 10 DECDLP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+]([C@H]3CCOC3)CC1)CC2 ZINC000850554759 651952812 /nfs/dbraw/zinc/95/28/12/651952812.db2.gz FQLJXMDBOKHDAZ-HOTGVXAUSA-N 2 2 302.418 2.222 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCCC[NH2+]1 ZINC000854230594 652662598 /nfs/dbraw/zinc/66/25/98/652662598.db2.gz VFDSGORCCKRRGM-KXBFYZLASA-N 2 2 317.477 2.268 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C(F)(F)F)C2)cc1F ZINC000873226788 689187823 /nfs/dbraw/zinc/18/78/23/689187823.db2.gz BKVRVJLWFBZHAT-VXGBXAGGSA-N 2 2 319.346 2.461 20 10 DECDLP CN(C)c1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C(F)(F)F)C2)cc1F ZINC000873226788 689187824 /nfs/dbraw/zinc/18/78/24/689187824.db2.gz BKVRVJLWFBZHAT-VXGBXAGGSA-N 2 2 319.346 2.461 20 10 DECDLP Fc1cc(C[NH2+][C@@]23CCC[C@H]2[NH2+]CC3)ccc1N1CCOCC1 ZINC000873229843 689190249 /nfs/dbraw/zinc/19/02/49/689190249.db2.gz HIQFMCYAOODYDL-QZTJIDSGSA-N 2 2 319.424 2.037 20 10 DECDLP CC[NH+]1CCC([NH+]2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC001169244178 785110753 /nfs/dbraw/zinc/11/07/53/785110753.db2.gz GFCGTZUFWHSBJU-UHFFFAOYSA-N 2 2 303.450 2.302 20 10 DECDLP C[C@@H]1C[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)C[C@H]1[NH3+] ZINC001206075776 800468537 /nfs/dbraw/zinc/46/85/37/800468537.db2.gz YLFHMIXPGXRPEX-BXKDBHETSA-N 2 2 304.312 2.112 20 10 DECDLP C[C@@H]1C[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)C[C@H]1[NH3+] ZINC001206075776 800468540 /nfs/dbraw/zinc/46/85/40/800468540.db2.gz YLFHMIXPGXRPEX-BXKDBHETSA-N 2 2 304.312 2.112 20 10 DECDLP CN(C)c1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)c1 ZINC001232840161 801969544 /nfs/dbraw/zinc/96/95/44/801969544.db2.gz NNBUDWAOKMNPRH-UHFFFAOYSA-N 2 2 300.406 2.492 20 10 DECDLP CC[C@H]([NH3+])C[N@H+](C)Cc1cc(Br)cc(OC)c1O ZINC001236866320 1138445285 /nfs/dbraw/zinc/44/52/85/1138445285.db2.gz ZCMLBUONXIFIEN-NSHDSACASA-N 2 2 317.227 2.332 20 10 DECDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC001236866320 1138445288 /nfs/dbraw/zinc/44/52/88/1138445288.db2.gz ZCMLBUONXIFIEN-NSHDSACASA-N 2 2 317.227 2.332 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235115736 1084315926 /nfs/dbraw/zinc/31/59/26/1084315926.db2.gz KBUVRYFIUFJLNM-IBGZPJMESA-N 2 2 315.461 2.241 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235115736 1084315935 /nfs/dbraw/zinc/31/59/35/1084315935.db2.gz KBUVRYFIUFJLNM-IBGZPJMESA-N 2 2 315.461 2.241 20 10 DECDLP Cc1cc(N2CC[NH+](Cc3c(C)cccc3O)CC2)nc(C)[nH+]1 ZINC001237489660 1138655989 /nfs/dbraw/zinc/65/59/89/1138655989.db2.gz JPHNYSFTKQGYML-UHFFFAOYSA-N 2 2 312.417 2.430 20 10 DECDLP C[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789842 1141060737 /nfs/dbraw/zinc/06/07/37/1141060737.db2.gz KFKZNZFKCYUKSJ-QAPCUYQASA-N 2 2 303.450 2.096 20 10 DECDLP C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789842 1141060744 /nfs/dbraw/zinc/06/07/44/1141060744.db2.gz KFKZNZFKCYUKSJ-QAPCUYQASA-N 2 2 303.450 2.096 20 10 DECDLP C[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789844 1141061733 /nfs/dbraw/zinc/06/17/33/1141061733.db2.gz KFKZNZFKCYUKSJ-YJBOKZPZSA-N 2 2 303.450 2.096 20 10 DECDLP C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[NH2+]1 ZINC001246789844 1141061743 /nfs/dbraw/zinc/06/17/43/1141061743.db2.gz KFKZNZFKCYUKSJ-YJBOKZPZSA-N 2 2 303.450 2.096 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000278472483 402866544 /nfs/dbraw/zinc/86/65/44/402866544.db2.gz HOOOCSJVROVMDA-CHWSQXEVSA-N 2 2 323.393 2.271 20 10 DECDLP COc1c(O)c(C[N@H+](C)CCCn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000290549038 404216387 /nfs/dbraw/zinc/21/63/87/404216387.db2.gz RSUMJMXFHHCKIZ-UHFFFAOYSA-N 2 2 320.349 2.028 20 10 DECDLP COc1c(O)c(C[N@@H+](C)CCCn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000290549038 404216389 /nfs/dbraw/zinc/21/63/89/404216389.db2.gz RSUMJMXFHHCKIZ-UHFFFAOYSA-N 2 2 320.349 2.028 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000365821538 404726409 /nfs/dbraw/zinc/72/64/09/404726409.db2.gz LGGTYWWYMGGKSK-OLZOCXBDSA-N 2 2 321.377 2.025 20 10 DECDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000365821538 404726413 /nfs/dbraw/zinc/72/64/13/404726413.db2.gz LGGTYWWYMGGKSK-OLZOCXBDSA-N 2 2 321.377 2.025 20 10 DECDLP CC1([NH+]2CCOCC2)CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000529663252 405763563 /nfs/dbraw/zinc/76/35/63/405763563.db2.gz IDGSCWCCWYDUFO-UHFFFAOYSA-N 2 2 308.397 2.218 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000377394609 227190243 /nfs/dbraw/zinc/19/02/43/227190243.db2.gz YDGLKRLAEBMTOG-MNOVXSKESA-N 2 2 314.788 2.138 20 10 DECDLP Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000377394609 227190246 /nfs/dbraw/zinc/19/02/46/227190246.db2.gz YDGLKRLAEBMTOG-MNOVXSKESA-N 2 2 314.788 2.138 20 10 DECDLP COc1cc(O)c(C[NH2+]Cc2c[nH+]c3n2CCCC3)cc1OC ZINC000368488698 522782237 /nfs/dbraw/zinc/78/22/37/522782237.db2.gz SBNZKDPMJCZEJG-UHFFFAOYSA-N 2 2 317.389 2.232 20 10 DECDLP Cc1cccc(C[NH+]2CCN(C3=[NH+]C[C@@H](C)S3)CC2)c1O ZINC000180448029 524400174 /nfs/dbraw/zinc/40/01/74/524400174.db2.gz YVWHQINMGRSRQC-CYBMUJFWSA-N 2 2 305.447 2.310 20 10 DECDLP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)no1 ZINC000771825016 641555919 /nfs/dbraw/zinc/55/59/19/641555919.db2.gz UTTLRWWYZBRHCV-UHFFFAOYSA-N 2 2 300.406 2.025 20 10 DECDLP Oc1cccc(Cl)c1C[NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903974384 643531737 /nfs/dbraw/zinc/53/17/37/643531737.db2.gz PNTMEOTXOJFHQX-GFCCVEGCSA-N 2 2 310.825 2.294 20 10 DECDLP Oc1c(C[NH2+]C[C@H](O)C[NH+]2CCCC2)ccc2ccccc21 ZINC000816538528 647148884 /nfs/dbraw/zinc/14/88/84/647148884.db2.gz USIMNGSNNPGCCD-INIZCTEOSA-N 2 2 300.402 2.092 20 10 DECDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCC[NH2+]1 ZINC000817887775 647371636 /nfs/dbraw/zinc/37/16/36/647371636.db2.gz DURJUUHHWOMCJE-YOEHRIQHSA-N 2 2 321.440 2.283 20 10 DECDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000817900371 647376844 /nfs/dbraw/zinc/37/68/44/647376844.db2.gz SCHWRBDMCVWLCW-MOPGFXCFSA-N 2 2 315.461 2.143 20 10 DECDLP C[C@@H]([NH2+]CC1C[NH2+]C1)c1cc(Br)c(F)cc1O ZINC000817964970 647395735 /nfs/dbraw/zinc/39/57/35/647395735.db2.gz LKINGQPVTMRIMP-SSDOTTSWSA-N 2 2 303.175 2.164 20 10 DECDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1cccc(C(F)(F)F)c1O ZINC000817983194 647400658 /nfs/dbraw/zinc/40/06/58/647400658.db2.gz ZCRCKQQNZOWFLU-WDEREUQCSA-N 2 2 318.339 2.440 20 10 DECDLP Cc1cc(O)c(C[NH2+]C2(CCO)CC[NH+](C)CC2)c(Cl)c1 ZINC000848558103 651470593 /nfs/dbraw/zinc/47/05/93/651470593.db2.gz JSUJSAYYXBUGKH-UHFFFAOYSA-N 2 2 312.841 2.290 20 10 DECDLP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000848911583 651557189 /nfs/dbraw/zinc/55/71/89/651557189.db2.gz HGLFTBCLLFPENQ-UKRRQHHQSA-N 2 2 320.433 2.305 20 10 DECDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500279 796228242 /nfs/dbraw/zinc/22/82/42/796228242.db2.gz WBKJXZDQOBQYPH-HKUYNNGSSA-N 2 2 315.461 2.049 20 10 DECDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500279 796228246 /nfs/dbraw/zinc/22/82/46/796228246.db2.gz WBKJXZDQOBQYPH-HKUYNNGSSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500279 796228251 /nfs/dbraw/zinc/22/82/51/796228251.db2.gz WBKJXZDQOBQYPH-HKUYNNGSSA-N 2 2 315.461 2.049 20 10 DECDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 ZINC001138500279 796228256 /nfs/dbraw/zinc/22/82/56/796228256.db2.gz WBKJXZDQOBQYPH-HKUYNNGSSA-N 2 2 315.461 2.049 20 10 DECDLP CC1(C[NH3+])C[NH+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001206738310 796423510 /nfs/dbraw/zinc/42/35/10/796423510.db2.gz ZSWKXSZXUHPSMB-UHFFFAOYSA-N 2 2 304.312 2.114 20 10 DECDLP COc1cc(C[N@H+](C(C)C)C2CC[NH+](C)CC2)cc(O)c1O ZINC001204351970 800208246 /nfs/dbraw/zinc/20/82/46/800208246.db2.gz XSELMWUEJROOKS-UHFFFAOYSA-N 2 2 308.422 2.411 20 10 DECDLP COc1cc(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)cc(O)c1O ZINC001204351970 800208249 /nfs/dbraw/zinc/20/82/49/800208249.db2.gz XSELMWUEJROOKS-UHFFFAOYSA-N 2 2 308.422 2.411 20 10 DECDLP Oc1cc(O)c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC001232259326 801831546 /nfs/dbraw/zinc/83/15/46/801831546.db2.gz VXZABBAEXKBAFT-UHFFFAOYSA-N 2 2 319.792 2.468 20 10 DECDLP Oc1cc(Cl)ccc1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC001474637412 1060910809 /nfs/dbraw/zinc/91/08/09/1060910809.db2.gz ZQWJNURDWOWBTQ-HNNXBMFYSA-N 2 2 310.825 2.389 20 10 DECDLP COCC[C@H]([NH3+])C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001579000091 1067217962 /nfs/dbraw/zinc/21/79/62/1067217962.db2.gz OFEGIMKVXDEJHC-KRWDZBQOSA-N 2 2 305.466 2.473 20 10 DECDLP COCC[C@H]([NH3+])C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC001579000091 1067217969 /nfs/dbraw/zinc/21/79/69/1067217969.db2.gz OFEGIMKVXDEJHC-KRWDZBQOSA-N 2 2 305.466 2.473 20 10 DECDLP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(F)c1O ZINC001276539283 1083484620 /nfs/dbraw/zinc/48/46/20/1083484620.db2.gz QCLLHRWZAPHBFB-MQVJKMGUSA-N 2 2 321.440 2.178 20 10 DECDLP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(F)c1O ZINC001276539283 1083484625 /nfs/dbraw/zinc/48/46/25/1083484625.db2.gz QCLLHRWZAPHBFB-MQVJKMGUSA-N 2 2 321.440 2.178 20 10 DECDLP C[N@H+](CCCO)C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000126323559 401689180 /nfs/dbraw/zinc/68/91/80/401689180.db2.gz JYBQNOOZAZKONP-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP C[N@@H+](CCCO)C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000126323559 401689185 /nfs/dbraw/zinc/68/91/85/401689185.db2.gz JYBQNOOZAZKONP-UHFFFAOYSA-N 2 2 312.841 2.324 20 10 DECDLP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000119606620 401961401 /nfs/dbraw/zinc/96/14/01/401961401.db2.gz DTGXAKLNRPULAE-CQSZACIVSA-N 2 2 323.868 2.257 20 10 DECDLP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)CC1 ZINC000119606620 401961405 /nfs/dbraw/zinc/96/14/05/401961405.db2.gz DTGXAKLNRPULAE-CQSZACIVSA-N 2 2 323.868 2.257 20 10 DECDLP CC[C@@H]([NH2+]C[C@H]1C[N@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905403 403120915 /nfs/dbraw/zinc/12/09/15/403120915.db2.gz LSMMOVHZADFFMH-ZWKOTPCHSA-N 2 2 304.482 2.039 20 10 DECDLP CC[C@@H]([NH2+]C[C@H]1C[N@@H+](C)CCN1C)c1ccc(N(C)C)cc1 ZINC000268905403 403120917 /nfs/dbraw/zinc/12/09/17/403120917.db2.gz LSMMOVHZADFFMH-ZWKOTPCHSA-N 2 2 304.482 2.039 20 10 DECDLP Oc1cc2c(cc1C[NH+]1CCC(c3[nH]cc[nH+]3)CC1)OCO2 ZINC000271209609 403279039 /nfs/dbraw/zinc/27/90/39/403279039.db2.gz USTKZWBUKVLGIJ-UHFFFAOYSA-N 2 2 301.346 2.224 20 10 DECDLP COc1cccc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1O ZINC000841043558 650412447 /nfs/dbraw/zinc/41/24/47/650412447.db2.gz PICJYWVISFDAKQ-MRXNPFEDSA-N 2 2 315.417 2.256 20 10 DECDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@@H]3C[C@H]3C)CC2)cc1 ZINC000754131295 639392396 /nfs/dbraw/zinc/39/23/96/639392396.db2.gz VAXKKNVBLFPPTM-SJORKVTESA-N 2 2 317.477 2.453 20 10 DECDLP CCOc1cccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)c1O ZINC000903974885 643531618 /nfs/dbraw/zinc/53/16/18/643531618.db2.gz UMLFDMQVUSLACN-OAHLLOKOSA-N 2 2 320.433 2.039 20 10 DECDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000843129723 650902979 /nfs/dbraw/zinc/90/29/79/650902979.db2.gz YSNDZOVFYJJLKG-SFHVURJKSA-N 2 2 315.461 2.288 20 10 DECDLP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](O)C[NH+]2CCCC2)c1O ZINC000808680192 646127215 /nfs/dbraw/zinc/12/72/15/646127215.db2.gz JBKKPOMTHHTESQ-TZMCWYRMSA-N 2 2 312.841 2.461 20 10 DECDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817893083 647373728 /nfs/dbraw/zinc/37/37/28/647373728.db2.gz DNICTRBYGNIUFI-DYVFJYSZSA-N 2 2 321.440 2.017 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000817941449 647389090 /nfs/dbraw/zinc/38/90/90/647389090.db2.gz JTEWUBQWKXUBLY-IRXDYDNUSA-N 2 2 303.450 2.301 20 10 DECDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCc3nn(C)cc32)cc1 ZINC000817943559 647389934 /nfs/dbraw/zinc/38/99/34/647389934.db2.gz VLQTUABSEQJFGU-DLBZAZTESA-N 2 2 313.449 2.153 20 10 DECDLP C[C@@H]([NH2+]C[C@@H]1CCCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817946000 647390566 /nfs/dbraw/zinc/39/05/66/647390566.db2.gz PMWUBKFVRVVQLG-ZBFHGGJFSA-N 2 2 321.440 2.455 20 10 DECDLP C[C@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154258156 647959196 /nfs/dbraw/zinc/95/91/96/647959196.db2.gz SULZHLAIXFAUJJ-HOCLYGCPSA-N 2 2 323.456 2.389 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[N@@H+]2CCCO)cc1 ZINC000824558962 648610565 /nfs/dbraw/zinc/61/05/65/648610565.db2.gz ATSYGHIYTUQKRN-LJQANCHMSA-N 2 2 319.493 2.469 20 10 DECDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[N@H+]2CCCO)cc1 ZINC000824558962 648610568 /nfs/dbraw/zinc/61/05/68/648610568.db2.gz ATSYGHIYTUQKRN-LJQANCHMSA-N 2 2 319.493 2.469 20 10 DECDLP CC[N@H+](C)C[C@H](O)C[NH+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765953 651350237 /nfs/dbraw/zinc/35/02/37/651350237.db2.gz GIXJOJMRCKHAPB-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CC[N@@H+](C)C[C@H](O)C[NH+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765953 651350238 /nfs/dbraw/zinc/35/02/38/651350238.db2.gz GIXJOJMRCKHAPB-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](C)C[C@H](O)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765953 651350239 /nfs/dbraw/zinc/35/02/39/651350239.db2.gz GIXJOJMRCKHAPB-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CC[NH+](C)C[C@H](O)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000846765953 651350240 /nfs/dbraw/zinc/35/02/40/651350240.db2.gz GIXJOJMRCKHAPB-IBGZPJMESA-N 2 2 319.493 2.421 20 10 DECDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC000849350779 651655356 /nfs/dbraw/zinc/65/53/56/651655356.db2.gz VZGJSRDRZUZZEY-HXUWFJFHSA-N 3 2 324.472 2.188 20 10 DECDLP CC(C)c1ccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222511134 802698689 /nfs/dbraw/zinc/69/86/89/802698689.db2.gz PWNYXOHGUOXJGP-IRXDYDNUSA-N 2 2 303.450 2.041 20 10 DECDLP CC(C)C[C@@](C)(C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001575530759 1066336705 /nfs/dbraw/zinc/33/67/05/1066336705.db2.gz FROCGCWBFMMCGD-IBGZPJMESA-N 3 2 318.509 2.292 20 10 DECDLP C[NH+]1CCN(C2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C2)CC1 ZINC001235681521 1084496510 /nfs/dbraw/zinc/49/65/10/1084496510.db2.gz MWMAKLFDZDGGFO-UHFFFAOYSA-N 2 2 317.477 2.121 20 10 DECDLP COc1ccc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(O)c1Cl ZINC001236803240 1138434063 /nfs/dbraw/zinc/43/40/63/1138434063.db2.gz XPNMTTIJDIZBCN-YPMHNXCESA-N 2 2 310.825 2.438 20 10 DECDLP COc1ccc(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(O)c1Cl ZINC001236803240 1138434065 /nfs/dbraw/zinc/43/40/65/1138434065.db2.gz XPNMTTIJDIZBCN-YPMHNXCESA-N 2 2 310.825 2.438 20 10 DECDLP COc1ccc(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)c(O)c1Cl ZINC001236803240 1138434069 /nfs/dbraw/zinc/43/40/69/1138434069.db2.gz XPNMTTIJDIZBCN-YPMHNXCESA-N 2 2 310.825 2.438 20 10 DECDLP COc1ccc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c(O)c1Cl ZINC001236803240 1138434071 /nfs/dbraw/zinc/43/40/71/1138434071.db2.gz XPNMTTIJDIZBCN-YPMHNXCESA-N 2 2 310.825 2.438 20 10 DECDLP C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254010941 1143025262 /nfs/dbraw/zinc/02/52/62/1143025262.db2.gz QLFGCCOAZUKSKZ-CABCVRRESA-N 2 2 321.440 2.187 20 10 DECDLP C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254010941 1143025270 /nfs/dbraw/zinc/02/52/70/1143025270.db2.gz QLFGCCOAZUKSKZ-CABCVRRESA-N 2 2 321.440 2.187 20 10 DECDLP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)C1 ZINC000273303919 130104828 /nfs/dbraw/zinc/10/48/28/130104828.db2.gz CGPJAMAWEINYSQ-STQMWFEESA-N 2 2 306.406 2.171 20 10 DECDLP COc1c(O)c(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000278472491 402866551 /nfs/dbraw/zinc/86/65/51/402866551.db2.gz HOOOCSJVROVMDA-STQMWFEESA-N 2 2 323.393 2.271 20 10 DECDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262033 402981165 /nfs/dbraw/zinc/98/11/65/402981165.db2.gz XGFZFGLSNHSGGW-JKSUJKDBSA-N 2 2 319.449 2.081 20 10 DECDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(C)cc1O ZINC000280262033 402981167 /nfs/dbraw/zinc/98/11/67/402981167.db2.gz XGFZFGLSNHSGGW-JKSUJKDBSA-N 2 2 319.449 2.081 20 10 DECDLP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285977133 403423457 /nfs/dbraw/zinc/42/34/57/403423457.db2.gz HMARHLMJRZXVTI-XJKSGUPXSA-N 2 2 309.429 2.208 20 10 DECDLP C[C@@H]1C[NH+](CCC[NH2+][C@H]2CCc3cccc(O)c32)C[C@@H](C)O1 ZINC000296164552 404123453 /nfs/dbraw/zinc/12/34/53/404123453.db2.gz XKJMEBRMVJWYEF-FMKPAKJESA-N 2 2 304.434 2.468 20 10 DECDLP Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C[C@H]1COCC[NH2+]1 ZINC000423081115 405700051 /nfs/dbraw/zinc/70/00/51/405700051.db2.gz BEVUFYIZVBBYSF-ZFWWWQNUSA-N 2 2 301.434 2.343 20 10 DECDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000369684810 227037250 /nfs/dbraw/zinc/03/72/50/227037250.db2.gz XQBNLFYDSYQONW-GFCCVEGCSA-N 2 2 315.373 2.234 20 10 DECDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000369684810 227037254 /nfs/dbraw/zinc/03/72/54/227037254.db2.gz XQBNLFYDSYQONW-GFCCVEGCSA-N 2 2 315.373 2.234 20 10 DECDLP COc1ccc(C[NH2+]CCCNc2cccc[nH+]2)c(O)c1OC ZINC000893361355 625686548 /nfs/dbraw/zinc/68/65/48/625686548.db2.gz PHAALLOATPIUFN-UHFFFAOYSA-N 2 2 317.389 2.396 20 10 DECDLP C[C@@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000841076530 650424023 /nfs/dbraw/zinc/42/40/23/650424023.db2.gz HYAWRZHJZWJGHX-OLZOCXBDSA-N 2 2 306.410 2.410 20 10 DECDLP [NH3+][C@@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000903819929 643472031 /nfs/dbraw/zinc/47/20/31/643472031.db2.gz QPXLWISWPOKDEF-WOJBJXKFSA-N 2 2 323.440 2.238 20 10 DECDLP [NH3+][C@H](CC(F)F)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000903905481 643503285 /nfs/dbraw/zinc/50/32/85/643503285.db2.gz GTZGMJAIATUQMA-ZIAGYGMSSA-N 2 2 314.376 2.356 20 10 DECDLP [NH3+][C@H](CC(F)F)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000903905481 643503286 /nfs/dbraw/zinc/50/32/86/643503286.db2.gz GTZGMJAIATUQMA-ZIAGYGMSSA-N 2 2 314.376 2.356 20 10 DECDLP Cc1cc(C[NH+]2CCN(c3[nH+]ccn3C)CC2)ccc1N(C)C ZINC000815073783 646963427 /nfs/dbraw/zinc/96/34/27/646963427.db2.gz AEZMHSLRWZCXOT-UHFFFAOYSA-N 2 2 313.449 2.117 20 10 DECDLP Oc1cccc2c1[C@@H](Nc1ccc(N3CC[NH2+]CC3)c[nH+]1)CC2 ZINC000817951372 647391969 /nfs/dbraw/zinc/39/19/69/647391969.db2.gz DWLBVNXYLVOQNB-HNNXBMFYSA-N 2 2 310.401 2.296 20 10 DECDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817982417 647399800 /nfs/dbraw/zinc/39/98/00/647399800.db2.gz DPMOYJVUTZESQP-HOCLYGCPSA-N 2 2 321.440 2.455 20 10 DECDLP CN(C)c1ccc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)cc1F ZINC000827855653 649095335 /nfs/dbraw/zinc/09/53/35/649095335.db2.gz GDVDJAKSLHAYIY-INIZCTEOSA-N 2 2 323.456 2.434 20 10 DECDLP CN(C)c1ccc(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)cc1F ZINC000827855653 649095337 /nfs/dbraw/zinc/09/53/37/649095337.db2.gz GDVDJAKSLHAYIY-INIZCTEOSA-N 2 2 323.456 2.434 20 10 DECDLP C[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(N2CCOCC2)c(F)c1 ZINC000854228323 652661532 /nfs/dbraw/zinc/66/15/32/652661532.db2.gz VEWKJMYCBOACOQ-WRSVWVKZSA-N 2 2 319.424 2.065 20 10 DECDLP C[N@@H+]1CCC[C@H]2[C@@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621997 694441402 /nfs/dbraw/zinc/44/14/02/694441402.db2.gz MVPNFDLYKXGNIG-OALUTQOASA-N 2 2 315.461 2.192 20 10 DECDLP C[N@H+]1CCC[C@H]2[C@@H]1CC[NH+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621997 694441406 /nfs/dbraw/zinc/44/14/06/694441406.db2.gz MVPNFDLYKXGNIG-OALUTQOASA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@H]2[C@@H]1CC[N@@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621997 694441408 /nfs/dbraw/zinc/44/14/08/694441408.db2.gz MVPNFDLYKXGNIG-OALUTQOASA-N 2 2 315.461 2.192 20 10 DECDLP C[NH+]1CCC[C@H]2[C@@H]1CC[N@H+]2Cc1ccc(N2CCOCC2)cc1 ZINC000931621997 694441412 /nfs/dbraw/zinc/44/14/12/694441412.db2.gz MVPNFDLYKXGNIG-OALUTQOASA-N 2 2 315.461 2.192 20 10 DECDLP COc1ccc(O)c([C@H](C)[N@@H+]2CCc3sc(C[NH3+])nc3C2)c1 ZINC000925750205 693334947 /nfs/dbraw/zinc/33/49/47/693334947.db2.gz DXICDBPWTVXBLY-JTQLQIEISA-N 2 2 319.430 2.435 20 10 DECDLP COc1ccc(O)c([C@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c1 ZINC000925750205 693334953 /nfs/dbraw/zinc/33/49/53/693334953.db2.gz DXICDBPWTVXBLY-JTQLQIEISA-N 2 2 319.430 2.435 20 10 DECDLP