smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@H+](Cc1cc(Br)ccc1O)C[C@@H]1C[C@@]2(CC[NH2+]C2)CO1 ZINC000903732236 736161279 /nfs/dbraw/zinc/16/12/79/736161279.db2.gz DLZILQSMORGGCX-DOTOQJQBSA-N 2 1 369.303 2.745 20 10 FFCDMP CC[NH+](CC)CCOCC[NH2+]Cc1cc(C)cc(Br)c1O ZINC000757945885 736437919 /nfs/dbraw/zinc/43/79/19/736437919.db2.gz JIFAYDAONLTHGP-UHFFFAOYSA-N 2 1 359.308 2.911 20 10 FFCDMP COc1cc(Cl)cc(C[NH+]2CCN(c3cc[nH+]cc3OC)CC2)c1O ZINC000793369161 739774646 /nfs/dbraw/zinc/77/46/46/739774646.db2.gz CZWVUTXUGTWMDE-UHFFFAOYSA-N 2 1 363.845 2.780 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901915 748131901 /nfs/dbraw/zinc/13/19/01/748131901.db2.gz IWIDOMYMRZTBGS-MJEQTWJJSA-N 2 1 369.303 2.873 20 10 FFCDMP Cn1ccc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000896492307 971510033 /nfs/dbraw/zinc/51/00/33/971510033.db2.gz CBHSFMNINYNLQD-IBGZPJMESA-N 2 1 353.514 2.552 20 10 FFCDMP COc1ccc(C[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(O)c1OC ZINC000893357328 971808097 /nfs/dbraw/zinc/80/80/97/971808097.db2.gz QWWDAAJFIVRLRV-UHFFFAOYSA-N 2 1 372.469 2.575 20 10 FFCDMP CC[C@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(F)cc1O ZINC000873242366 1013441423 /nfs/dbraw/zinc/44/14/23/1013441423.db2.gz AREWPPLWRZXPKK-SFHVURJKSA-N 2 1 355.417 2.812 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206011529 1032108290 /nfs/dbraw/zinc/10/82/90/1032108290.db2.gz DGPJJNKOOHXZKZ-DOTOQJQBSA-N 2 1 351.922 2.983 20 10 FFCDMP Cc1cc(C[N@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)ccc1N(C)C ZINC000923340462 991080895 /nfs/dbraw/zinc/08/08/95/991080895.db2.gz FAYGEADOYACJJD-HXUWFJFHSA-N 2 1 367.541 2.939 20 10 FFCDMP Cc1cc(C[N@@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)ccc1N(C)C ZINC000923340462 991080901 /nfs/dbraw/zinc/08/09/01/991080901.db2.gz FAYGEADOYACJJD-HXUWFJFHSA-N 2 1 367.541 2.939 20 10 FFCDMP Oc1ccccc1C[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000809700736 994575123 /nfs/dbraw/zinc/57/51/23/994575123.db2.gz NISJATHZPUINLV-NRFANRHFSA-N 2 1 351.494 2.784 20 10 FFCDMP COCCC[N@@H+](Cc1ccncc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809741066 994601379 /nfs/dbraw/zinc/60/13/79/994601379.db2.gz OUHOZJCVXLUJFU-UHFFFAOYSA-N 2 1 368.525 2.872 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(O)c1 ZINC001144508742 998621308 /nfs/dbraw/zinc/62/13/08/998621308.db2.gz WUYPHGRXMJXANM-UHFFFAOYSA-N 2 1 369.465 2.687 20 10 FFCDMP CC[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCN1CC(F)F ZINC000775726572 1003859834 /nfs/dbraw/zinc/85/98/34/1003859834.db2.gz UDPHJNJIGMGPIB-SFHVURJKSA-N 2 1 366.500 2.600 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929142 /nfs/dbraw/zinc/92/91/42/1003929142.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929155 /nfs/dbraw/zinc/92/91/55/1003929155.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929164 /nfs/dbraw/zinc/92/91/64/1003929164.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4[C@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929172 /nfs/dbraw/zinc/92/91/72/1003929172.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 2 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4[C@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738387 1003929182 /nfs/dbraw/zinc/92/91/82/1003929182.db2.gz CSKORDKWBDOZGC-OFNKIYASSA-N 2 1 368.569 2.887 20 10 FFCDMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817895338 1007802083 /nfs/dbraw/zinc/80/20/83/1007802083.db2.gz SZYOHPSGCZFUMB-IIBYNOLFSA-N 2 1 371.500 2.835 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1nccn1C ZINC000775425228 1007853365 /nfs/dbraw/zinc/85/33/65/1007853365.db2.gz XSFUWDZBBVXURG-QGZVFWFLSA-N 2 1 353.514 2.803 20 10 FFCDMP O[C@@H](C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)C[NH+]1CCCC1 ZINC000796278167 1011620322 /nfs/dbraw/zinc/62/03/22/1011620322.db2.gz HXGCVDAVPOXYFR-QFIPXVFZSA-N 2 1 365.521 2.796 20 10 FFCDMP COc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3O)CC1)CO2 ZINC001173150547 1012294201 /nfs/dbraw/zinc/29/42/01/1012294201.db2.gz MRTYFOOIFROIQD-GOSISDBHSA-N 2 1 368.477 2.959 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cc(CO)on1 ZINC000925679177 1017815585 /nfs/dbraw/zinc/81/55/85/1017815585.db2.gz YRRNVSULQOBGNY-INIZCTEOSA-N 2 1 370.497 2.550 20 10 FFCDMP NC(=O)C1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000925776225 1017846694 /nfs/dbraw/zinc/84/66/94/1017846694.db2.gz FNFUJPJFSVIKCV-NHCUHLMSSA-N 2 1 364.493 2.623 20 10 FFCDMP COc1cc(C[NH+]2CCN(c3[nH+]ccn3C)CC2)c(O)c(C(C)(C)C)c1 ZINC000827884862 1018919661 /nfs/dbraw/zinc/91/96/61/1018919661.db2.gz KDPIQFRPIOKUFD-UHFFFAOYSA-N 2 1 358.486 2.754 20 10 FFCDMP C[C@@H]1CN(C(=O)C[C@@H]([NH3+])c2ccccc2O)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC001157615752 1029630826 /nfs/dbraw/zinc/63/08/26/1029630826.db2.gz OZAKCOHKQWYQMY-FUHIMQAGSA-N 2 1 367.493 2.904 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+]Cc2cnn(-c3ccc(F)cc3)c2)cc1 ZINC000841041918 1029995656 /nfs/dbraw/zinc/99/56/56/1029995656.db2.gz GDTYYMMSIRCRFM-HXUWFJFHSA-N 2 1 353.445 2.867 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128882 1031195860 /nfs/dbraw/zinc/19/58/60/1031195860.db2.gz YIXGTLZIKMJBAJ-MOPGFXCFSA-N 2 1 361.505 2.874 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)c(O)c1 ZINC001205295942 1031655244 /nfs/dbraw/zinc/65/52/44/1031655244.db2.gz CYDMULUTCXXZHJ-HXUWFJFHSA-N 2 1 364.486 2.818 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(O)cc1Br ZINC001205653037 1031906819 /nfs/dbraw/zinc/90/68/19/1031906819.db2.gz SFAHNZSWDHFGFM-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001138218125 1033969769 /nfs/dbraw/zinc/96/97/69/1033969769.db2.gz BXILWFYJCVWTSA-FCHUYYIVSA-N 2 1 356.558 2.887 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C(=O)OC)[C@@H]3C)cc2)CC1 ZINC001140304287 1035426325 /nfs/dbraw/zinc/42/63/25/1035426325.db2.gz LXQWSJNGFMMIEU-FXAWDEMLSA-N 2 1 359.514 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@]4(C3)CC(F)(F)CO4)cc2)CC1 ZINC001140306197 1035427306 /nfs/dbraw/zinc/42/73/06/1035427306.db2.gz OPHIHEUHOKBTJK-LJQANCHMSA-N 2 1 365.468 2.829 20 10 FFCDMP CCOC(=O)[C@H]1CCCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305831 1035427598 /nfs/dbraw/zinc/42/75/98/1035427598.db2.gz IAEXHPGHFAUBCV-FQEVSTJZSA-N 2 1 373.541 2.994 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C(C)C)[C@H]3CCN(C(C)=O)C3)cc2)CC1 ZINC001140309550 1035429374 /nfs/dbraw/zinc/42/93/74/1035429374.db2.gz LFEPLJVDFDFURC-QFIPXVFZSA-N 2 1 372.557 2.660 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCN(CC3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001140857286 1036294866 /nfs/dbraw/zinc/29/48/66/1036294866.db2.gz OJNUDRRLZDHHRP-UHFFFAOYSA-N 2 1 374.573 2.698 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4cc(O)c(O)cc4O)C[C@H]3C2)cc1 ZINC001233484128 1036651960 /nfs/dbraw/zinc/65/19/60/1036651960.db2.gz ZBMPDMJWKQJCKO-QZTJIDSGSA-N 2 1 354.450 2.676 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(OC)c1 ZINC001141028330 1036764942 /nfs/dbraw/zinc/76/49/42/1036764942.db2.gz KUHZKROBRAJHTL-ROUUACIJSA-N 2 1 368.477 2.973 20 10 FFCDMP CCOC(=O)[C@@]12C[N@H+](Cc3cc(F)c(Cl)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235350225 1037496706 /nfs/dbraw/zinc/49/67/06/1037496706.db2.gz XGNGFQDNEMINNX-UGSOOPFHSA-N 2 1 370.852 2.549 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc(F)c(Cl)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235350225 1037496716 /nfs/dbraw/zinc/49/67/16/1037496716.db2.gz XGNGFQDNEMINNX-UGSOOPFHSA-N 2 1 370.852 2.549 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c(OC)c1 ZINC001235815487 1037765224 /nfs/dbraw/zinc/76/52/24/1037765224.db2.gz LJXBSXZMPVRAPD-UHFFFAOYSA-N 2 1 374.573 2.801 20 10 FFCDMP Fc1ccc(N2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c(F)c1 ZINC001235875466 1037811861 /nfs/dbraw/zinc/81/18/61/1037811861.db2.gz PXDKAUJPYQAJMZ-UHFFFAOYSA-N 2 1 372.463 2.697 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001235935351 1037843913 /nfs/dbraw/zinc/84/39/13/1037843913.db2.gz UCKJHDXUUITWRH-QGZVFWFLSA-N 2 1 355.457 2.930 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@@H](N3CC(C[NH3+])C3)C2)cc1 ZINC001236078733 1037919567 /nfs/dbraw/zinc/91/95/67/1037919567.db2.gz JPHDZRQGEYMGAW-JOCHJYFZSA-N 2 1 352.526 2.949 20 10 FFCDMP [NH3+]C1CN([C@H]2CCC[N@@H+](Cc3ccc(OCc4ccccc4)cc3O)C2)C1 ZINC001236077621 1037921135 /nfs/dbraw/zinc/92/11/35/1037921135.db2.gz JCCQJIWEADDNHT-FQEVSTJZSA-N 2 1 367.493 2.579 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C[C@H]3CCC[NH2+]C3)C3CC3)cc2)CC1 ZINC001236599661 1038148230 /nfs/dbraw/zinc/14/82/30/1038148230.db2.gz USOHISQHHILCSQ-FQEVSTJZSA-N 3 1 356.558 2.793 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)Cc3ccccc3)c(F)c2)CC1 ZINC001236931282 1038363911 /nfs/dbraw/zinc/36/39/11/1038363911.db2.gz IQOJNUXOLLKERE-UHFFFAOYSA-N 2 1 357.473 2.572 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCSCC(F)(F)F)cc2F)CC1 ZINC001319831697 1045281075 /nfs/dbraw/zinc/28/10/75/1045281075.db2.gz GYZJLIRZVDBUBU-UHFFFAOYSA-N 2 1 365.440 2.963 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@H]3O)cc2F)CC1 ZINC001330532991 1049192777 /nfs/dbraw/zinc/19/27/77/1049192777.db2.gz JFDZGGNLYZHSKK-YFVAEKQCSA-N 2 1 361.505 2.703 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCC[C@H]3O)cc2F)CC1 ZINC001330532991 1049192782 /nfs/dbraw/zinc/19/27/82/1049192782.db2.gz JFDZGGNLYZHSKK-YFVAEKQCSA-N 2 1 361.505 2.703 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769724 1051690062 /nfs/dbraw/zinc/69/00/62/1051690062.db2.gz ZFVHTKKODYQKHE-LEWJYISDSA-N 2 1 372.557 2.879 20 10 FFCDMP C[NH+]1CCC(CCO)([NH2+]Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001308672298 1052484544 /nfs/dbraw/zinc/48/45/44/1052484544.db2.gz OKGJKGCYTITCST-UHFFFAOYSA-N 2 1 370.493 2.908 20 10 FFCDMP c1ccc(CN2CCc3cc(C[NH2+]C[C@@H]4C[NH2+]CCCO4)ccc32)cc1 ZINC001580892696 1078888334 /nfs/dbraw/zinc/88/83/34/1078888334.db2.gz CHUGFALWRCBWPO-NRFANRHFSA-N 2 1 351.494 2.717 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC000273617812 511552976 /nfs/dbraw/zinc/55/29/76/511552976.db2.gz YAPZPCFOJIYHGN-YRISNDGFSA-N 2 1 370.493 2.934 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC000273617812 511552980 /nfs/dbraw/zinc/55/29/80/511552980.db2.gz YAPZPCFOJIYHGN-YRISNDGFSA-N 2 1 370.493 2.934 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC000273617805 511553143 /nfs/dbraw/zinc/55/31/43/511553143.db2.gz YAPZPCFOJIYHGN-CDXJDZJCSA-N 2 1 370.493 2.934 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC000273617805 511553147 /nfs/dbraw/zinc/55/31/47/511553147.db2.gz YAPZPCFOJIYHGN-CDXJDZJCSA-N 2 1 370.493 2.934 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC2CC[NH+](C)CC2)C1 ZINC000443922212 514073129 /nfs/dbraw/zinc/07/31/29/514073129.db2.gz NYXJREVNOMZQND-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391139 738135899 /nfs/dbraw/zinc/13/58/99/738135899.db2.gz SWKFEMZFDMTBCV-LFVTVUPYSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391139 738135901 /nfs/dbraw/zinc/13/59/01/738135901.db2.gz SWKFEMZFDMTBCV-LFVTVUPYSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391139 738135904 /nfs/dbraw/zinc/13/59/04/738135904.db2.gz SWKFEMZFDMTBCV-LFVTVUPYSA-N 2 1 356.869 2.754 20 10 FFCDMP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1cccc(Br)c1O ZINC000809727169 741337371 /nfs/dbraw/zinc/33/73/71/741337371.db2.gz FCCJIRVSAFOKEM-UHFFFAOYSA-N 2 1 372.351 2.860 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000840759667 972960580 /nfs/dbraw/zinc/96/05/80/972960580.db2.gz ZTVNWQMKRAVLJQ-SNRMKQJTSA-N 2 1 365.468 2.764 20 10 FFCDMP CC(C)CC(=O)N1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000877773943 1014720950 /nfs/dbraw/zinc/72/09/50/1014720950.db2.gz BIRIOMODTBOCSP-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP C[N@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873304 1016280153 /nfs/dbraw/zinc/28/01/53/1016280153.db2.gz GQWTVYWQLYXILH-FQEVSTJZSA-N 2 1 368.529 2.825 20 10 FFCDMP C[N@@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873304 1016280160 /nfs/dbraw/zinc/28/01/60/1016280160.db2.gz GQWTVYWQLYXILH-FQEVSTJZSA-N 2 1 368.529 2.825 20 10 FFCDMP Cc1noc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000775654549 1004963401 /nfs/dbraw/zinc/96/34/01/1004963401.db2.gz LOXMJICUOAJZJB-SFHVURJKSA-N 2 1 355.486 2.509 20 10 FFCDMP CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667263 1005013296 /nfs/dbraw/zinc/01/32/96/1005013296.db2.gz GWLNLFNANBZWOC-FQEVSTJZSA-N 2 1 372.557 2.567 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@H]3CC[N@H+](C4CCCCC4)C3)cc2)CC1 ZINC000850382275 1005812137 /nfs/dbraw/zinc/81/21/37/1005812137.db2.gz QKNPIXGBANOTCK-FQEVSTJZSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCN(C4CCCCC4)C3)cc2)CC1 ZINC000850382275 1005812140 /nfs/dbraw/zinc/81/21/40/1005812140.db2.gz QKNPIXGBANOTCK-FQEVSTJZSA-N 2 1 356.558 2.935 20 10 FFCDMP CCN1CCC([N@H+]2CCCN(Cc3ccc(N(C)C)c(F)c3)CC2)CC1 ZINC000817414381 1007592221 /nfs/dbraw/zinc/59/22/21/1007592221.db2.gz XUQFWQIBPKITER-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP CCOCc1cc(C[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)ccc1OC ZINC001177805021 1008754874 /nfs/dbraw/zinc/75/48/74/1008754874.db2.gz WTFDRTYTXQOIHI-HXUWFJFHSA-N 2 1 362.514 2.965 20 10 FFCDMP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@@H]1CCC[NH2+]CC1 ZINC001206598468 1032357808 /nfs/dbraw/zinc/35/78/08/1032357808.db2.gz KHOQRYRKPSLMTO-LJQANCHMSA-N 3 1 362.537 2.930 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](n3cc(C[NH3+])nn3)C2)cc1F ZINC000841099724 1030035205 /nfs/dbraw/zinc/03/52/05/1030035205.db2.gz NZUDNHFZWABVQP-QGZVFWFLSA-N 2 1 360.481 2.559 20 10 FFCDMP C[C@H](CC[NH+](C)C)C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353238 1031702459 /nfs/dbraw/zinc/70/24/59/1031702459.db2.gz CRRRYPYBVMVUCF-PBHICJAKSA-N 2 1 367.921 2.714 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3cccc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139261110 1035032859 /nfs/dbraw/zinc/03/28/59/1035032859.db2.gz UTJWCAXESBDPTQ-SFHVURJKSA-N 2 1 371.481 2.819 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1c1ccccc1 ZINC001139409604 1035093511 /nfs/dbraw/zinc/09/35/11/1035093511.db2.gz MYZRARGHCDTYLI-QHCPKHFHSA-N 2 1 364.537 2.927 20 10 FFCDMP CCOC(=O)[C@]1(C)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139410970 1035095723 /nfs/dbraw/zinc/09/57/23/1035095723.db2.gz OAZBNVKWSPQZMG-OAQYLSRUSA-N 2 1 359.514 2.604 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(=O)[nH]c4CC3)cc2)CC1 ZINC001140305567 1035427503 /nfs/dbraw/zinc/42/75/03/1035427503.db2.gz CJDKNMAYVOWFOB-UHFFFAOYSA-N 2 1 366.509 2.530 20 10 FFCDMP CN(C)c1ccc(/C=C\C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052747 1035494550 /nfs/dbraw/zinc/49/45/50/1035494550.db2.gz HIESVNJOSZHDHE-QJKPHDSHSA-N 2 1 356.558 2.866 20 10 FFCDMP COC(=O)c1c(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)c2ccccc2n1C ZINC001232406536 1035656355 /nfs/dbraw/zinc/65/63/55/1035656355.db2.gz XPQZENZIVPBGFX-UHFFFAOYSA-N 2 1 355.482 2.883 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001233418242 1036610361 /nfs/dbraw/zinc/61/03/61/1036610361.db2.gz YQXPHQUVDFLOCP-JKSUJKDBSA-N 2 1 357.420 2.621 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001233418242 1036610362 /nfs/dbraw/zinc/61/03/62/1036610362.db2.gz YQXPHQUVDFLOCP-JKSUJKDBSA-N 2 1 357.420 2.621 20 10 FFCDMP COc1cc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)cc1O ZINC001231635826 1037757866 /nfs/dbraw/zinc/75/78/66/1037757866.db2.gz MPSJGJSWOFIUBB-ROUUACIJSA-N 2 1 354.450 2.670 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4cc(N)ccc4C3)cc2)CC1 ZINC001236105917 1037934379 /nfs/dbraw/zinc/93/43/79/1037934379.db2.gz XIYZMKXZDJMREU-UHFFFAOYSA-N 2 1 350.510 2.969 20 10 FFCDMP Oc1cc2c(cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376954 1038059703 /nfs/dbraw/zinc/05/97/03/1038059703.db2.gz XKMMSBXJWORDMS-INIZCTEOSA-N 2 1 359.514 2.618 20 10 FFCDMP [O-]c1cc2c(cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376954 1038059724 /nfs/dbraw/zinc/05/97/24/1038059724.db2.gz XKMMSBXJWORDMS-INIZCTEOSA-N 2 1 359.514 2.618 20 10 FFCDMP [O-]c1cc2c(cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376954 1038059747 /nfs/dbraw/zinc/05/97/47/1038059747.db2.gz XKMMSBXJWORDMS-INIZCTEOSA-N 2 1 359.514 2.618 20 10 FFCDMP COc1ccc(N2CC[NH+](Cc3cc4c(s3)CC[NH2+]C4)CC2)c(OC)c1 ZINC001236410611 1038076162 /nfs/dbraw/zinc/07/61/62/1038076162.db2.gz IKDGPPVQXFCEDP-UHFFFAOYSA-N 2 1 373.522 2.733 20 10 FFCDMP COCCOc1ccc(N2CC[NH+](Cc3cc4c[nH+]ccc4[nH]3)CC2)cc1 ZINC001232016742 1038108997 /nfs/dbraw/zinc/10/89/97/1038108997.db2.gz DYRBEXMQHHFWED-UHFFFAOYSA-N 2 1 366.465 2.910 20 10 FFCDMP Cn1nccc1[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001253996354 1040499964 /nfs/dbraw/zinc/49/99/64/1040499964.db2.gz CECUTEIFWYBXLP-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001253996354 1040499970 /nfs/dbraw/zinc/49/99/70/1040499970.db2.gz CECUTEIFWYBXLP-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP COc1ccc(O)c(C[NH+]2CCC3(CCC[N@@H+](CCN(C)C)C3)CC2)c1 ZINC001278572022 1041219818 /nfs/dbraw/zinc/21/98/18/1041219818.db2.gz ZRFVOPYLWBFKPN-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP COc1ccc(O)c(C[NH+]2CCC3(CCCN(CC[NH+](C)C)C3)CC2)c1 ZINC001278572022 1041219834 /nfs/dbraw/zinc/21/98/34/1041219834.db2.gz ZRFVOPYLWBFKPN-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP Cc1ncsc1C[NH+]1CC2(C1)CC[NH+](Cc1ccc(O)cc1O)CC2 ZINC001279225310 1042951851 /nfs/dbraw/zinc/95/18/51/1042951851.db2.gz DUVRYLSGTUWXAN-UHFFFAOYSA-N 2 1 359.495 2.961 20 10 FFCDMP CCOc1ccc(C[NH+]2CCC3(C[NH+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001279671310 1043439615 /nfs/dbraw/zinc/43/96/15/1043439615.db2.gz PXMIUEAKDKTWHH-UHFFFAOYSA-N 2 1 356.470 2.612 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](n4ccnc4)C3)cc2F)CC1 ZINC001319701138 1045244690 /nfs/dbraw/zinc/24/46/90/1045244690.db2.gz CQXBZAHAJGFIFX-SFHVURJKSA-N 2 1 357.477 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](n4ccnc4)C3)cc2F)CC1 ZINC001319701138 1045244698 /nfs/dbraw/zinc/24/46/98/1045244698.db2.gz CQXBZAHAJGFIFX-SFHVURJKSA-N 2 1 357.477 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c3CCOC4)cc2F)CC1 ZINC001330344352 1049139865 /nfs/dbraw/zinc/13/98/65/1049139865.db2.gz WQGPPQOKHJZTER-UHFFFAOYSA-N 2 1 369.484 2.940 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@@H]2C1 ZINC001333890609 1049158843 /nfs/dbraw/zinc/15/88/43/1049158843.db2.gz FGCAMXYRLNGRDJ-IRFCIJBXSA-N 2 1 357.542 2.810 20 10 FFCDMP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@@H]1n1ccnc1 ZINC001341604656 1050231423 /nfs/dbraw/zinc/23/14/23/1050231423.db2.gz LEAJPOYMRCOOFI-UTKZUKDTSA-N 2 1 371.504 2.857 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@@H]1n1ccnc1 ZINC001341604656 1050231437 /nfs/dbraw/zinc/23/14/37/1050231437.db2.gz LEAJPOYMRCOOFI-UTKZUKDTSA-N 2 1 371.504 2.857 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3OCCc4ccccc43)cc2F)CC1 ZINC001308262240 1052438635 /nfs/dbraw/zinc/43/86/35/1052438635.db2.gz KFUROBPBKDWUQZ-QFIPXVFZSA-N 2 1 369.484 2.981 20 10 FFCDMP CCC[NH2+][C@H](C)C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551309 1078375944 /nfs/dbraw/zinc/37/59/44/1078375944.db2.gz OSIAMALYUUOUDH-CJNGLKHVSA-N 2 1 353.894 2.514 20 10 FFCDMP CC(C)C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)N(C)C ZINC001560258961 1076257234 /nfs/dbraw/zinc/25/72/34/1076257234.db2.gz PPUHAGXUMFNDPJ-SFHVURJKSA-N 2 1 350.526 2.643 20 10 FFCDMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000278899761 511013134 /nfs/dbraw/zinc/01/31/34/511013134.db2.gz FOSIPLKSOCAYSR-HOTGVXAUSA-N 2 1 358.461 2.772 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000375786516 512506582 /nfs/dbraw/zinc/50/65/82/512506582.db2.gz MSVKTZYLUJLQNL-YZGWKJHDSA-N 2 1 361.505 2.749 20 10 FFCDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@H](C)C1 ZINC000894256422 734825905 /nfs/dbraw/zinc/82/59/05/734825905.db2.gz QIASBHGHTJGSMA-AEFFLSMTSA-N 2 1 350.503 2.936 20 10 FFCDMP Fc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146282 746788390 /nfs/dbraw/zinc/78/83/90/746788390.db2.gz BFAXQTOIVUOZCF-JKSUJKDBSA-N 2 1 351.441 2.518 20 10 FFCDMP Fc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146282 746788393 /nfs/dbraw/zinc/78/83/93/746788393.db2.gz BFAXQTOIVUOZCF-JKSUJKDBSA-N 2 1 351.441 2.518 20 10 FFCDMP COC(=O)c1c(CNC[C@H]2CC[N@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172203 978098727 /nfs/dbraw/zinc/09/87/27/978098727.db2.gz DPNIQKTZBBWVTI-CYBMUJFWSA-N 2 1 359.445 2.678 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172203 978098736 /nfs/dbraw/zinc/09/87/36/978098736.db2.gz DPNIQKTZBBWVTI-CYBMUJFWSA-N 2 1 359.445 2.678 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172203 978098744 /nfs/dbraw/zinc/09/87/44/978098744.db2.gz DPNIQKTZBBWVTI-CYBMUJFWSA-N 2 1 359.445 2.678 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(Br)c1 ZINC001206024983 1032111572 /nfs/dbraw/zinc/11/15/72/1032111572.db2.gz LWBYVGJYWDBUOY-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388497 988534881 /nfs/dbraw/zinc/53/48/81/988534881.db2.gz FGMYHSSWSVYOKW-VBSBHUPXSA-N 2 1 367.484 2.600 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C3CCC(C)([NH+]4CCC4)CC3)cc2)CC1 ZINC000922844627 988953326 /nfs/dbraw/zinc/95/33/26/988953326.db2.gz HJDFJGPIWFBROM-UHFFFAOYSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@](CO)(c4ccccc4)C3)cc2)CC1 ZINC000812781455 995532390 /nfs/dbraw/zinc/53/23/90/995532390.db2.gz UXXHEWNCXIRDIW-HSZRJFAPSA-N 2 1 365.521 2.574 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1C ZINC001085202192 999153714 /nfs/dbraw/zinc/15/37/14/999153714.db2.gz RJQBQRKXSOLIQQ-VBSBHUPXSA-N 2 1 373.541 2.861 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850508385 1005819185 /nfs/dbraw/zinc/81/91/85/1005819185.db2.gz MDKVNYWUFAYXMF-YJBOKZPZSA-N 2 1 356.466 2.818 20 10 FFCDMP CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775199884 1006735140 /nfs/dbraw/zinc/73/51/40/1006735140.db2.gz HEUBRONNNXPHRC-JOCHJYFZSA-N 2 1 373.541 2.850 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902532 1007804642 /nfs/dbraw/zinc/80/46/42/1007804642.db2.gz SPRADVLULSFUEL-CEWLAPEOSA-N 2 1 374.548 2.978 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555304 1007884811 /nfs/dbraw/zinc/88/48/11/1007884811.db2.gz ZLCONSAGUCNOAL-IBGZPJMESA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@H+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555304 1007884814 /nfs/dbraw/zinc/88/48/14/1007884814.db2.gz ZLCONSAGUCNOAL-IBGZPJMESA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555304 1007884820 /nfs/dbraw/zinc/88/48/20/1007884820.db2.gz ZLCONSAGUCNOAL-IBGZPJMESA-N 2 1 371.481 2.901 20 10 FFCDMP CN(C)c1cc(F)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1F ZINC000862237986 1009760808 /nfs/dbraw/zinc/76/08/08/1009760808.db2.gz ZPRAHQIXUPXPEQ-UHFFFAOYSA-N 2 1 367.484 2.965 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c2ncnn21 ZINC000925677202 1017815065 /nfs/dbraw/zinc/81/50/65/1017815065.db2.gz ORXZDSWFDHHEAO-OXQOHEQNSA-N 2 1 366.513 2.606 20 10 FFCDMP C[C@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc(C(F)(F)F)c1O ZINC000925852998 1017873773 /nfs/dbraw/zinc/87/37/73/1017873773.db2.gz XNHGHNCZFOKNBR-NWDGAFQWSA-N 2 1 372.387 2.747 20 10 FFCDMP C[C@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116409869 1021203507 /nfs/dbraw/zinc/20/35/07/1021203507.db2.gz ICLOUYYIKIYAKQ-DNVCBOLYSA-N 2 1 361.461 2.772 20 10 FFCDMP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001116565353 1021287317 /nfs/dbraw/zinc/28/73/17/1021287317.db2.gz PWPHRPWJULUIRW-DOTOQJQBSA-N 2 1 359.514 2.781 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547800 1023727076 /nfs/dbraw/zinc/72/70/76/1023727076.db2.gz HPKIXVTXZCIKCG-MAUKXSAKSA-N 2 1 359.514 2.509 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000838983210 1026557985 /nfs/dbraw/zinc/55/79/85/1026557985.db2.gz ZELPOOBOTLRWBB-UHFFFAOYSA-N 3 1 368.569 2.935 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)cc1 ZINC000843058450 1031166840 /nfs/dbraw/zinc/16/68/40/1031166840.db2.gz SLJCAKOKHUPWLK-PZJWPPBQSA-N 2 1 372.557 2.613 20 10 FFCDMP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccc(I)cc2O)C1 ZINC001206631858 1031586777 /nfs/dbraw/zinc/58/67/77/1031586777.db2.gz BGFKOCHOZDGFMX-LLVKDONJSA-N 2 1 360.239 2.558 20 10 FFCDMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(I)cc2O)C1 ZINC001206631858 1031586786 /nfs/dbraw/zinc/58/67/86/1031586786.db2.gz BGFKOCHOZDGFMX-LLVKDONJSA-N 2 1 360.239 2.558 20 10 FFCDMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205582048 1031851145 /nfs/dbraw/zinc/85/11/45/1031851145.db2.gz WHGHKZLSXZNJCL-GOSISDBHSA-N 2 1 355.885 2.830 20 10 FFCDMP COc1cc(C[NH+]2CCN(c3cccc(F)c3)CC2)cc(C[NH+](C)C)c1O ZINC001139259960 1035032208 /nfs/dbraw/zinc/03/22/08/1035032208.db2.gz FNIHLJRHHHUIDB-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP CC(C)c1nc(CC[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)no1 ZINC001139408650 1035092564 /nfs/dbraw/zinc/09/25/64/1035092564.db2.gz OHVIFCOHEBENAH-UHFFFAOYSA-N 2 1 357.502 2.619 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@](O)(C(F)(F)F)C3)cc2)CC1 ZINC001139407700 1035092608 /nfs/dbraw/zinc/09/26/08/1035092608.db2.gz AUDJPTWFFOJKSR-SFHVURJKSA-N 2 1 371.447 2.718 20 10 FFCDMP COC(=O)c1cccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC001139411113 1035095756 /nfs/dbraw/zinc/09/57/56/1035095756.db2.gz VRQRRLMOMDMZLH-UHFFFAOYSA-N 2 1 367.493 2.857 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3c3cnccn3)cc2)CC1 ZINC001140303789 1035426245 /nfs/dbraw/zinc/42/62/45/1035426245.db2.gz ASBIMFYEYSEKLE-NRFANRHFSA-N 2 1 351.498 2.956 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC([N@@H+](C)C4CC4)CC3)cc2)CC1 ZINC001140306053 1035427713 /nfs/dbraw/zinc/42/77/13/1035427713.db2.gz MJDFVCCUBHJAQY-UHFFFAOYSA-N 2 1 356.558 2.887 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c1O ZINC001140744952 1036035456 /nfs/dbraw/zinc/03/54/56/1036035456.db2.gz QQJTUKMSMZESKJ-WIYYLYMNSA-N 2 1 360.498 2.587 20 10 FFCDMP Cc1c(O)ccc(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001140744952 1036035477 /nfs/dbraw/zinc/03/54/77/1036035477.db2.gz QQJTUKMSMZESKJ-WIYYLYMNSA-N 2 1 360.498 2.587 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001140744952 1036035498 /nfs/dbraw/zinc/03/54/98/1036035498.db2.gz QQJTUKMSMZESKJ-WIYYLYMNSA-N 2 1 360.498 2.587 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CC[NH2+]CC4)CC3)c(F)c2)CC1 ZINC001235131808 1037379221 /nfs/dbraw/zinc/37/92/21/1037379221.db2.gz CFKLWQSORKUSDQ-UHFFFAOYSA-N 2 1 360.521 2.543 20 10 FFCDMP CCOc1ccc(N2CC[NH+](C[C@@H]3[C@H](C)C[NH2+]CC3(F)F)CC2)cc1 ZINC001236433826 1038087106 /nfs/dbraw/zinc/08/71/06/1038087106.db2.gz MIEVKOVIJAWAIU-CRAIPNDOSA-N 2 1 353.457 2.698 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)cc2)CC1 ZINC001236599663 1038147894 /nfs/dbraw/zinc/14/78/94/1038147894.db2.gz USOHISQHHILCSQ-HXUWFJFHSA-N 3 1 356.558 2.793 20 10 FFCDMP CCc1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001236788992 1038271759 /nfs/dbraw/zinc/27/17/59/1038271759.db2.gz YUTTWUQRFZBSBD-UHFFFAOYSA-N 2 1 354.498 2.805 20 10 FFCDMP Cc1nc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)no1 ZINC001236933617 1038366037 /nfs/dbraw/zinc/36/60/37/1038366037.db2.gz YWIGKYWFRNEZJK-KRWDZBQOSA-N 2 1 373.476 2.649 20 10 FFCDMP C[C@@H]1C[C@@H]([NH+]2CCN(c3ccc(OCc4cccnc4)cc3)CC2)CC[NH2+]1 ZINC001246998873 1039570951 /nfs/dbraw/zinc/57/09/51/1039570951.db2.gz HFFGQHCYSOSFQI-NQIIRXRSSA-N 2 1 366.509 2.923 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c(O)c1 ZINC001249184382 1040619527 /nfs/dbraw/zinc/61/95/27/1040619527.db2.gz AQSRRUZKKPIQBB-UHFFFAOYSA-N 2 1 372.509 2.948 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c(O)c1 ZINC001249184382 1040619532 /nfs/dbraw/zinc/61/95/32/1040619532.db2.gz AQSRRUZKKPIQBB-UHFFFAOYSA-N 2 1 372.509 2.948 20 10 FFCDMP Oc1ccc([C@@H](O)C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255382895 1041311413 /nfs/dbraw/zinc/31/14/13/1041311413.db2.gz YDJYRHVAUKMVSE-RXVVDRJESA-N 2 1 356.466 2.776 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CCC3(CCC[N@H+](CCN(C)C)C3)CC2)c1O ZINC001279313073 1042995815 /nfs/dbraw/zinc/99/58/15/1042995815.db2.gz KLUUEYXBLJHUSU-UHFFFAOYSA-N 2 1 361.530 2.646 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CCC3(CCCN(CC[NH+](C)C)C3)CC2)c1O ZINC001279313073 1042995819 /nfs/dbraw/zinc/99/58/19/1042995819.db2.gz KLUUEYXBLJHUSU-UHFFFAOYSA-N 2 1 361.530 2.646 20 10 FFCDMP Cc1cc(O)c(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1Cl ZINC001279432435 1043106334 /nfs/dbraw/zinc/10/63/34/1043106334.db2.gz FMYPNOFMBOMAPO-UHFFFAOYSA-N 2 1 351.922 2.813 20 10 FFCDMP Cc1cccc(O)c1C[N@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001237489342 1043202486 /nfs/dbraw/zinc/20/24/86/1043202486.db2.gz WRWINMWZXQMOMC-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP COc1cc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c(OC)c1 ZINC001237675176 1043304116 /nfs/dbraw/zinc/30/41/16/1043304116.db2.gz BCQBRTAHNAURIC-OALUTQOASA-N 2 1 368.477 2.973 20 10 FFCDMP CCOc1ccc(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001279672066 1043441186 /nfs/dbraw/zinc/44/11/86/1043441186.db2.gz LNRGCSVRTTZCKD-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP CCOc1ccc(C[NH+]2CCC3(CCN(CC[NH+](C)C)C3)CC2)c(O)c1 ZINC001279672066 1043441194 /nfs/dbraw/zinc/44/11/94/1043441194.db2.gz LNRGCSVRTTZCKD-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP Cc1cc(F)cc(C[N@@H+]2C[C@@H]3CC[NH+](Cc4cn[nH]c4)CC[C@@H]3C2)c1O ZINC001280033687 1044110167 /nfs/dbraw/zinc/11/01/67/1044110167.db2.gz QCATYTDABMGEMO-CALCHBBNSA-N 2 1 358.461 2.907 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@@H]3CC[N@@H+](Cc4cn[nH]c4)CC[C@@H]3C2)c1O ZINC001280033687 1044110172 /nfs/dbraw/zinc/11/01/72/1044110172.db2.gz QCATYTDABMGEMO-CALCHBBNSA-N 2 1 358.461 2.907 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@@H]3CC[N@H+](Cc4cn[nH]c4)CC[C@@H]3C2)c1O ZINC001280033687 1044110177 /nfs/dbraw/zinc/11/01/77/1044110177.db2.gz QCATYTDABMGEMO-CALCHBBNSA-N 2 1 358.461 2.907 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@@](C)(O)c1ccccc1 ZINC001332002238 1048203915 /nfs/dbraw/zinc/20/39/15/1048203915.db2.gz CKBYDHGIIKDDDE-JOCHJYFZSA-N 2 1 371.500 2.917 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@@](C)(O)c1ccccc1 ZINC001332002238 1048203929 /nfs/dbraw/zinc/20/39/29/1048203929.db2.gz CKBYDHGIIKDDDE-JOCHJYFZSA-N 2 1 371.500 2.917 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3COc4ccccc43)cc2F)CC1 ZINC001346910824 1053434382 /nfs/dbraw/zinc/43/43/82/1053434382.db2.gz HCLBACBHNGMMIM-KRWDZBQOSA-N 2 1 355.457 2.843 20 10 FFCDMP CC[C@@](C)(C[NH3+])C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948329 1078288513 /nfs/dbraw/zinc/28/85/13/1078288513.db2.gz IXVHPRVBRMPKRH-YJBOKZPZSA-N 2 1 353.894 2.501 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)cc2F)CC1 ZINC001560282618 1076260084 /nfs/dbraw/zinc/26/00/84/1076260084.db2.gz WVYGJXSWSIBARN-UHFFFAOYSA-N 2 1 358.417 2.776 20 10 FFCDMP Cc1c2ccccc2n(C)c1C[NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C ZINC001560302524 1076261560 /nfs/dbraw/zinc/26/15/60/1076261560.db2.gz BQILTDQRVSGSSV-LJQANCHMSA-N 2 1 356.514 2.519 20 10 FFCDMP Cc1c2ccccc2n(C)c1C[NH2+]CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC001560302524 1076261561 /nfs/dbraw/zinc/26/15/61/1076261561.db2.gz BQILTDQRVSGSSV-LJQANCHMSA-N 2 1 356.514 2.519 20 10 FFCDMP C[NH+]1CCC([NH2+]Cc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 ZINC000177227617 509949108 /nfs/dbraw/zinc/94/91/08/509949108.db2.gz PNGRQIOTHHLNCA-UHFFFAOYSA-N 2 1 357.420 2.726 20 10 FFCDMP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1O ZINC000185322129 510804719 /nfs/dbraw/zinc/80/47/19/510804719.db2.gz WPFPCYONZBVAFN-CQSZACIVSA-N 2 1 359.445 2.674 20 10 FFCDMP Cc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1O ZINC000182202644 510812670 /nfs/dbraw/zinc/81/26/70/510812670.db2.gz NGGAJGLEHOSENP-HXUWFJFHSA-N 2 1 367.493 2.688 20 10 FFCDMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000278899763 511013211 /nfs/dbraw/zinc/01/32/11/511013211.db2.gz FOSIPLKSOCAYSR-HZPDHXFCSA-N 2 1 358.461 2.772 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273446698 511526477 /nfs/dbraw/zinc/52/64/77/511526477.db2.gz NXIYVQLHPNALDG-KDOFPFPSSA-N 2 1 371.437 2.718 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(O)cccc1Br ZINC000862252508 730682266 /nfs/dbraw/zinc/68/22/66/730682266.db2.gz DAQVQXYQHQWNRR-ISTRZQFTSA-N 2 1 369.303 2.838 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1c(O)cccc1Br ZINC000862252508 730682267 /nfs/dbraw/zinc/68/22/67/730682267.db2.gz DAQVQXYQHQWNRR-ISTRZQFTSA-N 2 1 369.303 2.838 20 10 FFCDMP COc1cc(Br)cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1O ZINC000725846017 734395903 /nfs/dbraw/zinc/39/59/03/734395903.db2.gz UMFJXVVGZYUDFZ-KBPBESRZSA-N 2 1 355.276 2.880 20 10 FFCDMP C[N@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000816610569 742047047 /nfs/dbraw/zinc/04/70/47/742047047.db2.gz PLGYVVHFXPAEFE-OAHLLOKOSA-N 2 1 355.885 2.785 20 10 FFCDMP C[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000816610569 742047052 /nfs/dbraw/zinc/04/70/52/742047052.db2.gz PLGYVVHFXPAEFE-OAHLLOKOSA-N 2 1 355.885 2.785 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000894297910 964317496 /nfs/dbraw/zinc/31/74/96/964317496.db2.gz KEJGLISWTGMXPH-VQTJNVASSA-N 2 1 370.493 2.682 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000894297910 964317507 /nfs/dbraw/zinc/31/75/07/964317507.db2.gz KEJGLISWTGMXPH-VQTJNVASSA-N 2 1 370.493 2.682 20 10 FFCDMP COc1cc(C)cc(C[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1O ZINC000894393528 965238722 /nfs/dbraw/zinc/23/87/22/965238722.db2.gz MOCZUNFFLXVCNP-UHFFFAOYSA-N 2 1 356.470 2.875 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895558225 970742342 /nfs/dbraw/zinc/74/23/42/970742342.db2.gz UGEAQJNPVPOZSQ-GOSISDBHSA-N 2 1 366.509 2.753 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c1O ZINC000894139378 977956329 /nfs/dbraw/zinc/95/63/29/977956329.db2.gz SSDDUOUKXYCXJS-HXUWFJFHSA-N 2 1 369.509 2.788 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(O)cc1Br ZINC001206025655 1032111758 /nfs/dbraw/zinc/11/17/58/1032111758.db2.gz OPQHEGFPEZRGIR-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 ZINC000765973793 987922597 /nfs/dbraw/zinc/92/25/97/987922597.db2.gz FRLSUVXROBFPBN-PGRDOPGGSA-N 2 1 373.541 2.817 20 10 FFCDMP COc1ccc(N2CCC([NH2+]C3CC[NH+](C[C@@H]4CCCO4)CC3)CC2)cc1 ZINC000765978138 988226737 /nfs/dbraw/zinc/22/67/37/988226737.db2.gz SSUCHMUNJPAVJQ-QFIPXVFZSA-N 2 1 373.541 2.897 20 10 FFCDMP C[C@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000879650586 1015626111 /nfs/dbraw/zinc/62/61/11/1015626111.db2.gz IKETWWAAGJMAIB-JENIJYKNSA-N 2 1 367.493 2.822 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)c3cccs3)cc2F)CC1 ZINC001116115400 1032135337 /nfs/dbraw/zinc/13/53/37/1032135337.db2.gz LFUQRGLRPMLSOG-IBGZPJMESA-N 2 1 363.502 2.636 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)Cn2cc[nH+]c2C)cc1C ZINC001085423506 999498138 /nfs/dbraw/zinc/49/81/38/999498138.db2.gz SXHPKRGDDUHTQA-RTBURBONSA-N 2 1 370.497 2.726 20 10 FFCDMP C[C@H]1C[N@H+](Cc2cccc(I)c2O)CCC[C@@H]1C[NH3+] ZINC001206028299 1000501455 /nfs/dbraw/zinc/50/14/55/1000501455.db2.gz YBFHTXPVXJIAAD-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2cccc(I)c2O)CCC[C@@H]1C[NH3+] ZINC001206028299 1000501463 /nfs/dbraw/zinc/50/14/63/1000501463.db2.gz YBFHTXPVXJIAAD-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775662435 1004985837 /nfs/dbraw/zinc/98/58/37/1004985837.db2.gz XKAYQHDXTKCKTR-SFHVURJKSA-N 2 1 374.529 2.537 20 10 FFCDMP CC1(C)[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925504078 1017770119 /nfs/dbraw/zinc/77/01/19/1017770119.db2.gz PGMDHGLFVIDOAA-LSTHTHJFSA-N 2 1 361.505 2.653 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@@H+]1Cc1cc(Cl)c(C)cc1O)CC[NH2+]CC2 ZINC001222226384 1032837222 /nfs/dbraw/zinc/83/72/22/1032837222.db2.gz RPCHJDSHKQFKQU-INIZCTEOSA-N 2 1 366.889 2.861 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@H+]1Cc1cc(Cl)c(C)cc1O)CC[NH2+]CC2 ZINC001222226384 1032837239 /nfs/dbraw/zinc/83/72/39/1032837239.db2.gz RPCHJDSHKQFKQU-INIZCTEOSA-N 2 1 366.889 2.861 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](CO)CC(C)(C)C ZINC001117788936 1021890990 /nfs/dbraw/zinc/89/09/90/1021890990.db2.gz CFUDYLMVUJJBEX-KRWDZBQOSA-N 2 1 351.510 2.806 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](CO)CC(C)(C)C ZINC001117788936 1021891002 /nfs/dbraw/zinc/89/10/02/1021891002.db2.gz CFUDYLMVUJJBEX-KRWDZBQOSA-N 2 1 351.510 2.806 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000840948240 1029942113 /nfs/dbraw/zinc/94/21/13/1029942113.db2.gz FYCQHXPWCUFCFF-CBQGHPETSA-N 2 1 356.558 2.804 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(OC)c1O)C2 ZINC001203592676 1030776785 /nfs/dbraw/zinc/77/67/85/1030776785.db2.gz VSJMHQXZFBKCKC-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1ccc(C[N@@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001203628838 1030795701 /nfs/dbraw/zinc/79/57/01/1030795701.db2.gz GTLQDQXTPJRQLG-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(C[N@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001203628838 1030795714 /nfs/dbraw/zinc/79/57/14/1030795714.db2.gz GTLQDQXTPJRQLG-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(C[NH+]2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001203628838 1030795727 /nfs/dbraw/zinc/79/57/27/1030795727.db2.gz GTLQDQXTPJRQLG-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(C[NH+]2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001203628838 1030795743 /nfs/dbraw/zinc/79/57/43/1030795743.db2.gz GTLQDQXTPJRQLG-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP C[N@H+]1C[C@@H](C[NH2+]Cc2ccc(N3CCOCC3)cc2)[C@H](c2ccccc2)C1 ZINC000842765052 1030948037 /nfs/dbraw/zinc/94/80/37/1030948037.db2.gz UCZRPHBQSQTBKK-GGAORHGYSA-N 2 1 365.521 2.958 20 10 FFCDMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001205591725 1031855862 /nfs/dbraw/zinc/85/58/62/1031855862.db2.gz OIRRZAWIFNGNPX-OAHLLOKOSA-N 2 1 350.356 2.986 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1O ZINC001205627464 1031884903 /nfs/dbraw/zinc/88/49/03/1031884903.db2.gz PQZLSFPWICTYQZ-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839906 1036093595 /nfs/dbraw/zinc/09/35/95/1036093595.db2.gz YCNUFEWTURSVHF-UGKGYDQZSA-N 2 1 373.541 2.639 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839906 1036093609 /nfs/dbraw/zinc/09/36/09/1036093609.db2.gz YCNUFEWTURSVHF-UGKGYDQZSA-N 2 1 373.541 2.639 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839906 1036093619 /nfs/dbraw/zinc/09/36/19/1036093619.db2.gz YCNUFEWTURSVHF-UGKGYDQZSA-N 2 1 373.541 2.639 20 10 FFCDMP COc1cc(O)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)cc1Br ZINC001233141469 1036392592 /nfs/dbraw/zinc/39/25/92/1036392592.db2.gz JRAQZYXMYXSEPV-UHFFFAOYSA-N 2 1 355.276 2.691 20 10 FFCDMP CCCCN(CCCC)c1ccc(CN2CC[NH2+]C[C@]23CC[NH2+]C3)c(O)c1 ZINC001234994517 1037286312 /nfs/dbraw/zinc/28/63/12/1037286312.db2.gz XYTBUCSENLIHJQ-JOCHJYFZSA-N 2 1 374.573 2.936 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4c5ccccc5CN[C@@H]4C3)cc2)CC1 ZINC001235221917 1037422657 /nfs/dbraw/zinc/42/26/57/1037422657.db2.gz TUGPSTDRWSQXHH-XZOQPEGZSA-N 2 1 362.521 2.510 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4c5ccccc5CN[C@@H]4C3)cc2)CC1 ZINC001235221917 1037422661 /nfs/dbraw/zinc/42/26/61/1037422661.db2.gz TUGPSTDRWSQXHH-XZOQPEGZSA-N 2 1 362.521 2.510 20 10 FFCDMP COc1cc2c(cc1OC)C[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001235718150 1037707134 /nfs/dbraw/zinc/70/71/34/1037707134.db2.gz FGRWNSXHSWWHBI-UHFFFAOYSA-N 2 1 367.493 2.672 20 10 FFCDMP COc1cccc(CCC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2O)c1 ZINC001236043060 1037905906 /nfs/dbraw/zinc/90/59/06/1037905906.db2.gz UAKDJCNGFWNZHA-UHFFFAOYSA-N 2 1 369.509 2.875 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4cc(N)ccc4C3)c(F)c2)CC1 ZINC001236104980 1037933471 /nfs/dbraw/zinc/93/34/71/1037933471.db2.gz DUJQPVUTYHDYFZ-UHFFFAOYSA-N 2 1 354.473 2.718 20 10 FFCDMP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465263 1039474621 /nfs/dbraw/zinc/47/46/21/1039474621.db2.gz WHNDRRZDBQZLKO-JOCHJYFZSA-N 2 1 357.542 2.956 20 10 FFCDMP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465263 1039474628 /nfs/dbraw/zinc/47/46/28/1039474628.db2.gz WHNDRRZDBQZLKO-JOCHJYFZSA-N 2 1 357.542 2.956 20 10 FFCDMP C[NH+]1CCC[C@@]2(CCC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465263 1039474636 /nfs/dbraw/zinc/47/46/36/1039474636.db2.gz WHNDRRZDBQZLKO-JOCHJYFZSA-N 2 1 357.542 2.956 20 10 FFCDMP FC(F)(F)Oc1ccc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC001246998493 1039569744 /nfs/dbraw/zinc/56/97/44/1039569744.db2.gz XPJRBCGYMQPNSS-MZBDJJRSSA-N 2 1 355.404 2.990 20 10 FFCDMP CCn1ccnc1CN1CC[C@H]2C[N@H+](Cc3ccccc3O)C[C@H]2CC1 ZINC001278552532 1041120660 /nfs/dbraw/zinc/12/06/60/1041120660.db2.gz WZLCDRMIGNDZBA-HDICACEKSA-N 2 1 354.498 2.953 20 10 FFCDMP CCn1ccnc1C[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3O)C[C@H]2CC1 ZINC001278552532 1041120663 /nfs/dbraw/zinc/12/06/63/1041120663.db2.gz WZLCDRMIGNDZBA-HDICACEKSA-N 2 1 354.498 2.953 20 10 FFCDMP CCn1ccnc1C[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3O)C[C@H]2CC1 ZINC001278552532 1041120668 /nfs/dbraw/zinc/12/06/68/1041120668.db2.gz WZLCDRMIGNDZBA-HDICACEKSA-N 2 1 354.498 2.953 20 10 FFCDMP COc1cccc(C[NH+]2CCC3(CCC[N@@H+](CCN(C)C)C3)CC2)c1O ZINC001278563214 1041182638 /nfs/dbraw/zinc/18/26/38/1041182638.db2.gz VHBAFFQYGFBYGY-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP COc1cccc(C[NH+]2CCC3(CCCN(CC[NH+](C)C)C3)CC2)c1O ZINC001278563214 1041182644 /nfs/dbraw/zinc/18/26/44/1041182644.db2.gz VHBAFFQYGFBYGY-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568746 1041204576 /nfs/dbraw/zinc/20/45/76/1041204576.db2.gz HUPQMYMWARPYIA-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568746 1041204587 /nfs/dbraw/zinc/20/45/87/1041204587.db2.gz HUPQMYMWARPYIA-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568746 1041204600 /nfs/dbraw/zinc/20/46/00/1041204600.db2.gz HUPQMYMWARPYIA-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c1O ZINC001262109915 1041563461 /nfs/dbraw/zinc/56/34/61/1041563461.db2.gz KSPXBICAIZUQEN-UHFFFAOYSA-N 2 1 356.466 2.831 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cc(C(F)(F)F)ccc1O ZINC001279686050 1043467287 /nfs/dbraw/zinc/46/72/87/1043467287.db2.gz LVESWQGNHUOOHP-HOTGVXAUSA-N 2 1 357.420 2.621 20 10 FFCDMP c1cn(Cc2ccccc2)c2cc[nH+]c(-c3cnc(N4CC[NH2+]CC4)nc3)c12 ZINC001241895573 1044630586 /nfs/dbraw/zinc/63/05/86/1044630586.db2.gz FXDLRKILOPPBSQ-UHFFFAOYSA-N 2 1 370.460 2.951 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4cn[nH]c4)CC3)cc2F)CC1 ZINC001319700845 1045243963 /nfs/dbraw/zinc/24/39/63/1045243963.db2.gz REGKPSAWPRZNLY-UHFFFAOYSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(O)cc4CC3)cc2F)CC1 ZINC001319701067 1045244455 /nfs/dbraw/zinc/24/44/55/1045244455.db2.gz BAGWHISKAORPTP-UHFFFAOYSA-N 2 1 369.484 2.884 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc(O)cc4CC3)cc2F)CC1 ZINC001319701067 1045244463 /nfs/dbraw/zinc/24/44/63/1045244463.db2.gz BAGWHISKAORPTP-UHFFFAOYSA-N 2 1 369.484 2.884 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2)CC1 ZINC001320068005 1045341914 /nfs/dbraw/zinc/34/19/14/1045341914.db2.gz OXUAIPJBURWBBF-UHFFFAOYSA-N 2 1 366.465 2.905 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2)CC1 ZINC001320068005 1045341921 /nfs/dbraw/zinc/34/19/21/1045341921.db2.gz OXUAIPJBURWBBF-UHFFFAOYSA-N 2 1 366.465 2.905 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCCC(C)(C)C3)cc2F)CC1 ZINC001322017436 1045916992 /nfs/dbraw/zinc/91/69/92/1045916992.db2.gz IWCGMVIPOAGJNT-UHFFFAOYSA-N 2 1 362.537 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)C3CCCCC3)cc2F)CC1 ZINC001327815768 1048052873 /nfs/dbraw/zinc/05/28/73/1048052873.db2.gz BSGGQWCNRNPWFJ-IBGZPJMESA-N 2 1 363.521 2.856 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCCC[C@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC001332340034 1048354170 /nfs/dbraw/zinc/35/41/70/1048354170.db2.gz UYXUBOWWYRWWMT-FPOVZHCZSA-N 2 1 360.521 2.684 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](O)c1ccccc1 ZINC001329836870 1048932471 /nfs/dbraw/zinc/93/24/71/1048932471.db2.gz YROIZRHEFKQYER-IIBYNOLFSA-N 2 1 357.473 2.789 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCC[N@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769726 1051690290 /nfs/dbraw/zinc/69/02/90/1051690290.db2.gz ZFVHTKKODYQKHE-RTWAWAEBSA-N 2 1 372.557 2.879 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)cc2F)CC1 ZINC001344074107 1052580275 /nfs/dbraw/zinc/58/02/75/1052580275.db2.gz BCTCKLXIVYUQNK-LJQANCHMSA-N 2 1 370.472 2.626 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)cc2F)CC1 ZINC001344074107 1052580291 /nfs/dbraw/zinc/58/02/91/1052580291.db2.gz BCTCKLXIVYUQNK-LJQANCHMSA-N 2 1 370.472 2.626 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)[C@@H](c2ccccc2)[NH+](C)C)[NH+](C)C)cc1 ZINC001456927133 1060229999 /nfs/dbraw/zinc/22/99/99/1060229999.db2.gz ALHWDBKMCTZFMN-NHCUHLMSSA-N 2 1 368.525 2.774 20 10 FFCDMP COc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C[C@@H]4CCCO4)CC3)C2)cc1 ZINC000848552447 1060264420 /nfs/dbraw/zinc/26/44/20/1060264420.db2.gz BMDHXBSDAODKEA-AVRDEDQJSA-N 2 1 373.541 2.755 20 10 FFCDMP CSC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCOCC1 ZINC001560353519 1076266477 /nfs/dbraw/zinc/26/64/77/1076266477.db2.gz NLCMASSLMKEISO-UHFFFAOYSA-N 2 1 367.534 2.579 20 10 FFCDMP C[C@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1O ZINC000183503969 509831315 /nfs/dbraw/zinc/83/13/15/509831315.db2.gz OPKVOEGOMNDLBM-LPHOPBHVSA-N 2 1 367.493 2.940 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)c1O ZINC000725849329 734396330 /nfs/dbraw/zinc/39/63/30/734396330.db2.gz KNUNCRHANJIZNF-LBPRGKRZSA-N 2 1 357.292 2.983 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)CCCN2CC[NH+](C)CC2)cc1F ZINC000809743562 741339329 /nfs/dbraw/zinc/33/93/29/741339329.db2.gz VMFXXGTZMWAZQT-UHFFFAOYSA-N 2 1 350.526 2.741 20 10 FFCDMP Cc1cc(O)c(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825916455 743342987 /nfs/dbraw/zinc/34/29/87/743342987.db2.gz ORDKQUNWGYPIFT-KRWDZBQOSA-N 2 1 351.922 2.954 20 10 FFCDMP OC1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000877643622 1014659140 /nfs/dbraw/zinc/65/91/40/1014659140.db2.gz LKORYPVVNRFNGC-FQEVSTJZSA-N 2 1 357.542 2.859 20 10 FFCDMP NC(=O)[C@H]1CCC[N@@H+](CCC[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729683851 981289102 /nfs/dbraw/zinc/28/91/02/981289102.db2.gz CZGJPPKYLKUJBT-IBGZPJMESA-N 2 1 367.493 2.736 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000741258161 999717520 /nfs/dbraw/zinc/71/75/20/999717520.db2.gz LLBANMCQSYHAHQ-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000741258161 999717522 /nfs/dbraw/zinc/71/75/22/999717522.db2.gz LLBANMCQSYHAHQ-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOC(=O)[C@H](CC)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000787438582 1001690808 /nfs/dbraw/zinc/69/08/08/1001690808.db2.gz DIPOSOUVFSHAOH-FQEVSTJZSA-N 2 1 359.514 2.745 20 10 FFCDMP CCOC(=O)[C@H](CC)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000787438582 1001690811 /nfs/dbraw/zinc/69/08/11/1001690811.db2.gz DIPOSOUVFSHAOH-FQEVSTJZSA-N 2 1 359.514 2.745 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205601770 1004166386 /nfs/dbraw/zinc/16/63/86/1004166386.db2.gz GGJUQYJJIIDQBK-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850118835 1005787419 /nfs/dbraw/zinc/78/74/19/1005787419.db2.gz KERBFGHRLAENTF-UHFFFAOYSA-N 2 1 363.546 2.816 20 10 FFCDMP COc1ccc(N2CCN(CC[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)CC2)cc1 ZINC000817894946 1007802816 /nfs/dbraw/zinc/80/28/16/1007802816.db2.gz PJNFEJFEUHLDKL-YADHBBJMSA-N 2 1 366.509 2.552 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940260 1007818767 /nfs/dbraw/zinc/81/87/67/1007818767.db2.gz FCBMLSRKQWZQFB-VOQZNFBZSA-N 2 1 367.541 2.648 20 10 FFCDMP CCCn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn1 ZINC000865517006 1010804266 /nfs/dbraw/zinc/80/42/66/1010804266.db2.gz KBKMXXDJRDUVJD-UHFFFAOYSA-N 2 1 368.529 2.510 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c1 ZINC000925887192 1017883644 /nfs/dbraw/zinc/88/36/44/1017883644.db2.gz UWKWVZIYHDXJMH-ZVGUJKQYSA-N 2 1 354.450 2.889 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222173537 1032801595 /nfs/dbraw/zinc/80/15/95/1032801595.db2.gz UPSGPZOKFZGAAO-NRFANRHFSA-N 2 1 360.498 2.854 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c(O)c1 ZINC001222173538 1032802230 /nfs/dbraw/zinc/80/22/30/1032802230.db2.gz UPSGPZOKFZGAAO-OAQYLSRUSA-N 2 1 360.498 2.854 20 10 FFCDMP CCOc1ccc(O)c(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665985 1027395708 /nfs/dbraw/zinc/39/57/08/1027395708.db2.gz CXACXAWTASMWFI-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP CCOc1ccc(O)c(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665985 1027395725 /nfs/dbraw/zinc/39/57/25/1027395725.db2.gz CXACXAWTASMWFI-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)c(Br)c1 ZINC001205592315 1031859332 /nfs/dbraw/zinc/85/93/32/1031859332.db2.gz SKRKVZJTKXJKLM-OAHLLOKOSA-N 2 1 361.255 2.816 20 10 FFCDMP CCC[NH+]1C[C@@H]2C[N@H+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@@H]2C1 ZINC001138343235 1034174657 /nfs/dbraw/zinc/17/46/57/1034174657.db2.gz ZJOMQWAUYLTQIS-KDURUIRLSA-N 2 1 355.526 2.865 20 10 FFCDMP Cc1ccc2c(n1)N(C)CC[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001139407523 1035093203 /nfs/dbraw/zinc/09/32/03/1035093203.db2.gz FRSJXRWHWAYOLC-UHFFFAOYSA-N 2 1 365.525 2.594 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4nc(C)no4)C3)cc2)CC1 ZINC001140306690 1035428265 /nfs/dbraw/zinc/42/82/65/1035428265.db2.gz VIJMFCSBPQEXKO-SFHVURJKSA-N 2 1 355.486 2.509 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429448 1037544086 /nfs/dbraw/zinc/54/40/86/1037544086.db2.gz UENRAZQRDUTYKQ-RTBURBONSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429448 1037544097 /nfs/dbraw/zinc/54/40/97/1037544097.db2.gz UENRAZQRDUTYKQ-RTBURBONSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429448 1037544109 /nfs/dbraw/zinc/54/41/09/1037544109.db2.gz UENRAZQRDUTYKQ-RTBURBONSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1c1ccccc1 ZINC001235675509 1037676794 /nfs/dbraw/zinc/67/67/94/1037676794.db2.gz YURQAWQOOPHJHB-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1c1ccccc1 ZINC001235675509 1037676799 /nfs/dbraw/zinc/67/67/99/1037676799.db2.gz YURQAWQOOPHJHB-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1c1ccccc1 ZINC001235675509 1037676803 /nfs/dbraw/zinc/67/68/03/1037676803.db2.gz YURQAWQOOPHJHB-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP Cc1ccccc1O[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001235674555 1037677740 /nfs/dbraw/zinc/67/77/40/1037677740.db2.gz KADJVWZNMPTZSP-SFHVURJKSA-N 2 1 354.450 2.836 20 10 FFCDMP COc1cc(C[NH+]2C[C@@H]3C[NH+](Cc4ccc(C)cc4)C[C@H]3C2)c(O)cc1O ZINC001231634433 1037754414 /nfs/dbraw/zinc/75/44/14/1037754414.db2.gz IUAMOVAUNJWKFZ-OALUTQOASA-N 2 1 368.477 2.979 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4c(N)cccc4C3)c(F)c2)CC1 ZINC001236365799 1038058493 /nfs/dbraw/zinc/05/84/93/1038058493.db2.gz WOILQLXBBHQXKT-UHFFFAOYSA-N 2 1 354.473 2.718 20 10 FFCDMP COc1ccc2c(c1)C[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1O)CCC2 ZINC001236432696 1038087507 /nfs/dbraw/zinc/08/75/07/1038087507.db2.gz AWAVFSQWOFDJDR-UHFFFAOYSA-N 2 1 367.493 2.759 20 10 FFCDMP Cc1cccnc1O[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001236535603 1038121869 /nfs/dbraw/zinc/12/18/69/1038121869.db2.gz IMUZUSQDPQUGFF-SFHVURJKSA-N 2 1 369.465 2.621 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1OC ZINC001236751807 1038237029 /nfs/dbraw/zinc/23/70/29/1038237029.db2.gz JQZVGJQNTUTPHW-OALUTQOASA-N 2 1 368.477 2.973 20 10 FFCDMP CCC[N@@H+](Cc1c(O)cc(OC)cc1Br)C[C@@H]1CC[NH2+]C1 ZINC001236845185 1038306631 /nfs/dbraw/zinc/30/66/31/1038306631.db2.gz ZLIKREITMOSDPE-GFCCVEGCSA-N 2 1 357.292 2.985 20 10 FFCDMP CCC[N@H+](Cc1c(O)cc(OC)cc1Br)C[C@@H]1CC[NH2+]C1 ZINC001236845185 1038306644 /nfs/dbraw/zinc/30/66/44/1038306644.db2.gz ZLIKREITMOSDPE-GFCCVEGCSA-N 2 1 357.292 2.985 20 10 FFCDMP CCC[N@@H+]1C[C@H]2CN(Cc3c(O)cc(OC)cc3Br)C[C@H]2C1 ZINC001237063941 1038430210 /nfs/dbraw/zinc/43/02/10/1038430210.db2.gz APWHNHAQMANSEE-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP C[NH2+]CC[C@@H](C)[N@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246701001 1039442453 /nfs/dbraw/zinc/44/24/53/1039442453.db2.gz HYRWZTYYOYSABC-WIYYLYMNSA-N 2 1 361.530 2.612 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001249208638 1040629503 /nfs/dbraw/zinc/62/95/03/1040629503.db2.gz ZNFDMJOUIHSPRQ-RBUKOAKNSA-N 2 1 360.498 2.947 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)c(O)c1 ZINC001249208638 1040629509 /nfs/dbraw/zinc/62/95/09/1040629509.db2.gz ZNFDMJOUIHSPRQ-RBUKOAKNSA-N 2 1 360.498 2.947 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)c(O)c1 ZINC001249208638 1040629519 /nfs/dbraw/zinc/62/95/19/1040629519.db2.gz ZNFDMJOUIHSPRQ-RBUKOAKNSA-N 2 1 360.498 2.947 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1 ZINC001278571424 1041216964 /nfs/dbraw/zinc/21/69/64/1041216964.db2.gz RLAXYPYPVJCPCW-NRFANRHFSA-N 2 1 361.530 2.640 20 10 FFCDMP [O-]c1cccc(F)c1C[N@@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093911 /nfs/dbraw/zinc/09/39/11/1043093911.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP [O-]c1cccc(F)c1C[NH+]1C[C@@H]2CC[N@@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093923 /nfs/dbraw/zinc/09/39/23/1043093923.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP [O-]c1cccc(F)c1C[NH+]1C[C@@H]2CC[N@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093931 /nfs/dbraw/zinc/09/39/31/1043093931.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1cccc(F)c1C[N@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093939 /nfs/dbraw/zinc/09/39/39/1043093939.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1cccc(F)c1C[N@@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093947 /nfs/dbraw/zinc/09/39/47/1043093947.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 3 1 358.461 2.572 20 10 FFCDMP Oc1cccc(F)c1C[NH+]1C[C@@H]2CC[N@@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093957 /nfs/dbraw/zinc/09/39/57/1043093957.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 3 1 358.461 2.572 20 10 FFCDMP Oc1cccc(F)c1C[NH+]1C[C@@H]2CC[N@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279421225 1043093969 /nfs/dbraw/zinc/09/39/69/1043093969.db2.gz CAQFEJGCGSXUJE-CALCHBBNSA-N 3 1 358.461 2.572 20 10 FFCDMP C[N@@H+](CCN1CC[NH+](C)CC1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237645887 1043290490 /nfs/dbraw/zinc/29/04/90/1043290490.db2.gz MEXNTAPGIASXSH-UHFFFAOYSA-N 2 1 357.473 2.878 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C3CCOCC3)cc2F)CC1 ZINC001319869634 1045289660 /nfs/dbraw/zinc/28/96/60/1045289660.db2.gz FNHRIIARTBZPIK-HXUWFJFHSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3C3CCOCC3)cc2F)CC1 ZINC001319869634 1045289664 /nfs/dbraw/zinc/28/96/64/1045289664.db2.gz FNHRIIARTBZPIK-HXUWFJFHSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C4CCOCC4)C3)cc2F)CC1 ZINC001319961634 1045313486 /nfs/dbraw/zinc/31/34/86/1045313486.db2.gz CXUIVLUVWARHLM-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)cc2F)CC1 ZINC001319961634 1045313493 /nfs/dbraw/zinc/31/34/93/1045313493.db2.gz CXUIVLUVWARHLM-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001320203249 1045368140 /nfs/dbraw/zinc/36/81/40/1045368140.db2.gz PVFKJMITBHQIDS-HXUWFJFHSA-N 2 1 367.541 2.627 20 10 FFCDMP C[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001323451743 1045595616 /nfs/dbraw/zinc/59/56/16/1045595616.db2.gz JNSQAPUSOPURCO-LJQANCHMSA-N 2 1 353.510 2.821 20 10 FFCDMP COC(=O)c1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001324443188 1046033055 /nfs/dbraw/zinc/03/30/55/1046033055.db2.gz RWDCMOKWDZZYHO-UHFFFAOYSA-N 2 1 371.456 2.654 20 10 FFCDMP C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325712849 1046619783 /nfs/dbraw/zinc/61/97/83/1046619783.db2.gz DTIOOMVKJDRLHT-XLIONFOSSA-N 2 1 360.521 2.636 20 10 FFCDMP COCC1(C2CCC2)C[NH+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001328273165 1048243382 /nfs/dbraw/zinc/24/33/82/1048243382.db2.gz JQGLZELSKCXQMC-UHFFFAOYSA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCN4CCCC[C@H]34)cc2F)CC1 ZINC001329113375 1048581536 /nfs/dbraw/zinc/58/15/36/1048581536.db2.gz JPZVYMRKBCITCX-TZIWHRDSSA-N 2 1 360.521 2.684 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104156 1052259595 /nfs/dbraw/zinc/25/95/95/1052259595.db2.gz KCGOBNANNGNAKD-AZUAARDMSA-N 2 1 360.521 2.542 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)c3ccc(F)cc3)cc2F)CC1 ZINC001343915543 1052486734 /nfs/dbraw/zinc/48/67/34/1052486734.db2.gz SQKSUTONEVTAIX-FQEVSTJZSA-N 2 1 361.436 2.540 20 10 FFCDMP CCOC1CC2(C1)CC[N@H+](Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)C2 ZINC001347212752 1053725446 /nfs/dbraw/zinc/72/54/46/1053725446.db2.gz YIPGQOYTDDUSBV-UHFFFAOYSA-N 2 1 361.505 2.969 20 10 FFCDMP CCOC1CC2(C1)CC[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)C2 ZINC001347212752 1053725452 /nfs/dbraw/zinc/72/54/52/1053725452.db2.gz YIPGQOYTDDUSBV-UHFFFAOYSA-N 2 1 361.505 2.969 20 10 FFCDMP C[C@H](CCO)C1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCC1 ZINC001337273985 1054615456 /nfs/dbraw/zinc/61/54/56/1054615456.db2.gz FCJXMNFJDWVTDU-QGZVFWFLSA-N 2 1 363.521 2.856 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(O)(C4CCC4)CC3)cc2F)CC1 ZINC001352087514 1055181022 /nfs/dbraw/zinc/18/10/22/1055181022.db2.gz BAWDPWLPPIXLBB-UHFFFAOYSA-N 2 1 361.505 2.705 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(F)cc1O ZINC000186060315 509505319 /nfs/dbraw/zinc/50/53/19/509505319.db2.gz BBSUSBVBNFBVKR-AWEZNQCLSA-N 2 1 359.445 2.674 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNc3cc(C)[nH+]c(C)n3)CC2)cc1 ZINC000301096086 511688399 /nfs/dbraw/zinc/68/83/99/511688399.db2.gz ZNBPTSWOAWVNQH-UHFFFAOYSA-N 2 1 355.486 2.726 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1c(O)cccc1Br ZINC000862252509 730682304 /nfs/dbraw/zinc/68/23/04/730682304.db2.gz DAQVQXYQHQWNRR-PVUWLOKVSA-N 2 1 369.303 2.838 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1c(O)cccc1Br ZINC000862252509 730682307 /nfs/dbraw/zinc/68/23/07/730682307.db2.gz DAQVQXYQHQWNRR-PVUWLOKVSA-N 2 1 369.303 2.838 20 10 FFCDMP COc1cccc(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)c1O ZINC000725841684 734395824 /nfs/dbraw/zinc/39/58/24/734395824.db2.gz URPWKIPSVXHIPR-INIZCTEOSA-N 2 1 361.511 2.541 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125306 747777315 /nfs/dbraw/zinc/77/73/15/747777315.db2.gz RUHHKOOHCFBBLU-CHWSQXEVSA-N 2 1 369.303 2.985 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1O ZINC000844910435 748134491 /nfs/dbraw/zinc/13/44/91/748134491.db2.gz IBKRXVCHAFMWRK-OAGGEKHMSA-N 2 1 354.878 2.915 20 10 FFCDMP c1cc(N2CCSCC2)ccc1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000848521338 748948611 /nfs/dbraw/zinc/94/86/11/748948611.db2.gz MSPDXDPZGJWAEF-HXUWFJFHSA-N 2 1 361.555 2.583 20 10 FFCDMP COCCC[NH+]1CCC([NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000873036979 1013358816 /nfs/dbraw/zinc/35/88/16/1013358816.db2.gz IHGYRLYUULKVPX-UHFFFAOYSA-N 2 1 372.513 2.531 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1n1ccnc1 ZINC000775738148 1003929262 /nfs/dbraw/zinc/92/92/62/1003929262.db2.gz UFXMLDGXRQWLFC-WIYYLYMNSA-N 2 1 353.514 2.718 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@@H]3CC[N@H+](C4CCCCC4)C3)cc2)CC1 ZINC000850382278 1005811949 /nfs/dbraw/zinc/81/19/49/1005811949.db2.gz QKNPIXGBANOTCK-HXUWFJFHSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCN(C4CCCCC4)C3)cc2)CC1 ZINC000850382278 1005811952 /nfs/dbraw/zinc/81/19/52/1005811952.db2.gz QKNPIXGBANOTCK-HXUWFJFHSA-N 2 1 356.558 2.935 20 10 FFCDMP CC[NH+]1CCC([NH+]2CCC(C(=O)N(C)Cc3ccccc3O)CC2)CC1 ZINC000816889032 1007241261 /nfs/dbraw/zinc/24/12/61/1007241261.db2.gz KBOUGZSGXWTYCX-UHFFFAOYSA-N 2 1 359.514 2.547 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1c[nH+]ccc1N ZINC000817916905 1007807815 /nfs/dbraw/zinc/80/78/15/1007807815.db2.gz MHHXPVWIXZQNLO-QGZVFWFLSA-N 3 1 365.525 2.877 20 10 FFCDMP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1c(O)cccc1F ZINC000886520329 1008714690 /nfs/dbraw/zinc/71/46/90/1008714690.db2.gz BIWXUEXCTSVOAE-CQSZACIVSA-N 2 1 359.445 2.674 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1c(O)cccc1F ZINC000886549075 1008732633 /nfs/dbraw/zinc/73/26/33/1008732633.db2.gz BEXMBBHYCZRDRT-CQSZACIVSA-N 2 1 359.445 2.674 20 10 FFCDMP CCOCc1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)ccc1OC ZINC001177805020 1008754837 /nfs/dbraw/zinc/75/48/37/1008754837.db2.gz WTFDRTYTXQOIHI-FQEVSTJZSA-N 2 1 362.514 2.965 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(N(CC)CC)cc3)C[C@@H]1C[NH2+]CCC2 ZINC001222125490 1032769641 /nfs/dbraw/zinc/76/96/41/1032769641.db2.gz NIBJDJYOOIWVOR-UGKGYDQZSA-N 2 1 373.541 2.898 20 10 FFCDMP Cc1nc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc(N2CCCC2)[nH+]1 ZINC001156656091 1029290022 /nfs/dbraw/zinc/29/00/22/1029290022.db2.gz OOLMHSIEWGNIDI-UHFFFAOYSA-N 2 1 366.513 2.749 20 10 FFCDMP COC[C@@]1(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)CCC[NH2+]1 ZINC000841067934 1030012757 /nfs/dbraw/zinc/01/27/57/1030012757.db2.gz QUAQLOGAQORFKZ-NRFANRHFSA-N 2 1 356.466 2.829 20 10 FFCDMP Oc1ccc(C[NH+]2CCC3(CC2)C[N@@H+](Cc2ccccc2)CCO3)cc1O ZINC001203878087 1030951583 /nfs/dbraw/zinc/95/15/83/1030951583.db2.gz BBIWDICMKBAMFG-UHFFFAOYSA-N 2 1 368.477 2.965 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c(C(F)(F)F)c1 ZINC000843125237 1031193463 /nfs/dbraw/zinc/19/34/63/1031193463.db2.gz OSFRWHGVBBRHQV-HNNXBMFYSA-N 2 1 371.447 2.959 20 10 FFCDMP C[N@@H+](Cc1ccco1)[C@H]1COC2(C1)CC[NH+](Cc1ccc(O)cc1O)CC2 ZINC001204272584 1031198844 /nfs/dbraw/zinc/19/88/44/1031198844.db2.gz CYTPQWUGTDWQDW-QGZVFWFLSA-N 2 1 372.465 2.946 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCC[C@H](C[NH2+]C)C2)c(O)c1 ZINC001205016908 1031486420 /nfs/dbraw/zinc/48/64/20/1031486420.db2.gz LNBJXPBRAUYBOA-MRXNPFEDSA-N 2 1 364.486 2.546 20 10 FFCDMP Cn1c(Cl)cnc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000799340557 1031741693 /nfs/dbraw/zinc/74/16/93/1031741693.db2.gz GTJUJKNVTLONKY-UHFFFAOYSA-N 2 1 373.932 2.895 20 10 FFCDMP Cc1cnccc1O[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411645 1035095058 /nfs/dbraw/zinc/09/50/58/1035095058.db2.gz WMRXPTVCUJPGKQ-OAQYLSRUSA-N 2 1 366.509 2.795 20 10 FFCDMP Cc1ccc(C)c(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c1O ZINC001140181233 1035370873 /nfs/dbraw/zinc/37/08/73/1035370873.db2.gz QVZGIGOIOLEDRV-UHFFFAOYSA-N 2 1 354.498 2.860 20 10 FFCDMP Clc1ccc([C@@H]2C[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001235789627 1037745986 /nfs/dbraw/zinc/74/59/86/1037745986.db2.gz DKGYRGQCUBSKAU-NRFANRHFSA-N 2 1 370.928 2.896 20 10 FFCDMP Clc1ccc([C@@H]2CN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001235789627 1037746000 /nfs/dbraw/zinc/74/60/00/1037746000.db2.gz DKGYRGQCUBSKAU-NRFANRHFSA-N 2 1 370.928 2.896 20 10 FFCDMP C[C@H](c1ccccc1)N1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235864506 1037802113 /nfs/dbraw/zinc/80/21/13/1037802113.db2.gz RWBRPKHVWJXZIL-HXUWFJFHSA-N 2 1 364.537 2.975 20 10 FFCDMP COc1cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c(O)cc1Br ZINC001236757849 1038244858 /nfs/dbraw/zinc/24/48/58/1038244858.db2.gz YPBIALFKHDSMSA-UHFFFAOYSA-N 2 1 355.276 2.691 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1c(C)cc(OC)cc1O)C2 ZINC001236809861 1038283914 /nfs/dbraw/zinc/28/39/14/1038283914.db2.gz SVXHNRZGTJDHNG-AVRDEDQJSA-N 2 1 374.525 2.890 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001256528276 1038546847 /nfs/dbraw/zinc/54/68/47/1038546847.db2.gz YOBKHFXZKXQDSY-YJBOKZPZSA-N 2 1 356.466 2.989 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@H+]1Cc1ccccc1 ZINC001256528276 1038546853 /nfs/dbraw/zinc/54/68/53/1038546853.db2.gz YOBKHFXZKXQDSY-YJBOKZPZSA-N 2 1 356.466 2.989 20 10 FFCDMP C[N@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCOCC4)cc3F)CC2)C1 ZINC001278624220 1038924074 /nfs/dbraw/zinc/92/40/74/1038924074.db2.gz XIQXSQISZUESOX-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP Oc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278751422 1040474438 /nfs/dbraw/zinc/47/44/38/1040474438.db2.gz ZTRDTBSCOHSGGC-HXUWFJFHSA-N 2 1 356.470 2.699 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278571144 1041217529 /nfs/dbraw/zinc/21/75/29/1041217529.db2.gz PCYJUGWSXJKIHH-HXUWFJFHSA-N 2 1 356.470 2.612 20 10 FFCDMP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC[N@H+]1C1CCCCC1 ZINC001237247920 1043075274 /nfs/dbraw/zinc/07/52/74/1043075274.db2.gz KLPTYDUCCXAHMD-IBGZPJMESA-N 2 1 356.558 2.935 20 10 FFCDMP C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319811159 1045276176 /nfs/dbraw/zinc/27/61/76/1045276176.db2.gz VASLUTCIXDTPCX-SFHVURJKSA-N 2 1 371.500 2.961 20 10 FFCDMP C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319811159 1045276180 /nfs/dbraw/zinc/27/61/80/1045276180.db2.gz VASLUTCIXDTPCX-SFHVURJKSA-N 2 1 371.500 2.961 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4ccccn4)C3)cc2F)CC1 ZINC001321153412 1045564733 /nfs/dbraw/zinc/56/47/33/1045564733.db2.gz AJYNFVNDRFPYGO-GOSISDBHSA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4ccccn4)C3)cc2F)CC1 ZINC001321153412 1045564740 /nfs/dbraw/zinc/56/47/40/1045564740.db2.gz AJYNFVNDRFPYGO-GOSISDBHSA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CCO)Cc3ccccc3)cc2F)CC1 ZINC001321351109 1045637647 /nfs/dbraw/zinc/63/76/47/1045637647.db2.gz XOAPIZJMNICQRY-HXUWFJFHSA-N 2 1 371.500 2.661 20 10 FFCDMP CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001330422459 1049161861 /nfs/dbraw/zinc/16/18/61/1049161861.db2.gz COIVQVDJNZOIJX-NRFANRHFSA-N 2 1 363.521 2.808 20 10 FFCDMP CC(C)[C@@]1(CO)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001330422459 1049161865 /nfs/dbraw/zinc/16/18/65/1049161865.db2.gz COIVQVDJNZOIJX-NRFANRHFSA-N 2 1 363.521 2.808 20 10 FFCDMP CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001330422459 1049161869 /nfs/dbraw/zinc/16/18/69/1049161869.db2.gz COIVQVDJNZOIJX-NRFANRHFSA-N 2 1 363.521 2.808 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@H]3O)cc2F)CC1 ZINC001330532986 1049192818 /nfs/dbraw/zinc/19/28/18/1049192818.db2.gz JFDZGGNLYZHSKK-FBBABVLZSA-N 2 1 361.505 2.703 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCC[C@H]3O)cc2F)CC1 ZINC001330532986 1049192826 /nfs/dbraw/zinc/19/28/26/1049192826.db2.gz JFDZGGNLYZHSKK-FBBABVLZSA-N 2 1 361.505 2.703 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@@H]([NH+]4CCCC4)C3)cc2F)CC1 ZINC001341540423 1050169737 /nfs/dbraw/zinc/16/97/37/1050169737.db2.gz SYXRKOMDEGNAER-LJQANCHMSA-N 2 1 360.521 2.638 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]Cc3cccc(C[NH+](C)C)c3)cc2)CC1 ZINC001461036740 1061193575 /nfs/dbraw/zinc/19/35/75/1061193575.db2.gz UQRVWXDHNMZFBN-UHFFFAOYSA-N 2 1 352.526 2.790 20 10 FFCDMP COC(=O)c1c(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c2cc(F)ccc2n1C ZINC001462327273 1061584238 /nfs/dbraw/zinc/58/42/38/1061584238.db2.gz OPWVZXVUXUJQJQ-AWEZNQCLSA-N 2 1 361.461 2.926 20 10 FFCDMP COc1c([O-])c(C[N@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463777 1061634361 /nfs/dbraw/zinc/63/43/61/1061634361.db2.gz WHQWJVJERGETJW-ZFWWWQNUSA-N 2 1 351.447 2.861 20 10 FFCDMP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cc1C ZINC001474019582 1065442111 /nfs/dbraw/zinc/44/21/11/1065442111.db2.gz DQLNEPJZDBIPOO-SFTDATJTSA-N 2 1 354.494 2.976 20 10 FFCDMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1C ZINC001474019582 1065442113 /nfs/dbraw/zinc/44/21/13/1065442113.db2.gz DQLNEPJZDBIPOO-SFTDATJTSA-N 2 1 354.494 2.976 20 10 FFCDMP CC[C@](C)(C[NH3+])C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948323 1078288546 /nfs/dbraw/zinc/28/85/46/1078288546.db2.gz IXVHPRVBRMPKRH-CRAIPNDOSA-N 2 1 353.894 2.501 20 10 FFCDMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc(C)c(C)cc3O)CC2)CC1 ZINC000066450412 506523127 /nfs/dbraw/zinc/52/31/27/506523127.db2.gz GTWPAZVYVNHZRR-UHFFFAOYSA-N 2 1 373.541 2.775 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNCc3ccnn3C(C)C)CC2)cc1 ZINC000279826024 511230147 /nfs/dbraw/zinc/23/01/47/511230147.db2.gz GQYQMNDGHMJMQB-UHFFFAOYSA-N 2 1 371.529 2.775 20 10 FFCDMP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c1 ZINC000273390345 511524767 /nfs/dbraw/zinc/52/47/67/511524767.db2.gz KODVRVZHCMOBRQ-QGZVFWFLSA-N 2 1 367.493 2.939 20 10 FFCDMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)C1=CC(=O)CS1 ZINC000751069347 735843879 /nfs/dbraw/zinc/84/38/79/735843879.db2.gz AHSPOZBMLFQIBL-UHFFFAOYSA-N 2 1 365.543 2.722 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817864729 742219260 /nfs/dbraw/zinc/21/92/60/742219260.db2.gz BAYDITDTRDBMIC-LOWVWBTDSA-N 2 1 357.292 2.969 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817864729 742219261 /nfs/dbraw/zinc/21/92/61/742219261.db2.gz BAYDITDTRDBMIC-LOWVWBTDSA-N 2 1 357.292 2.969 20 10 FFCDMP CN(CC[N@@H+](C)Cc1ccc(Br)cc1O)C1CC[NH+](C)CC1 ZINC000825903316 743341151 /nfs/dbraw/zinc/34/11/51/743341151.db2.gz CXYVPBOOCFYTGS-UHFFFAOYSA-N 2 1 370.335 2.613 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)c1O ZINC000843043932 747755224 /nfs/dbraw/zinc/75/52/24/747755224.db2.gz QPEQWQMNTPXVOF-UHFFFAOYSA-N 2 1 355.276 2.880 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c2cc(F)ccc2n1C ZINC000894765487 965678655 /nfs/dbraw/zinc/67/86/55/965678655.db2.gz JCTDUFRSWXOJBH-AWEZNQCLSA-N 2 1 361.461 2.924 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)c2cc(F)ccc2n1C ZINC000894765487 965678664 /nfs/dbraw/zinc/67/86/64/965678664.db2.gz JCTDUFRSWXOJBH-AWEZNQCLSA-N 2 1 361.461 2.924 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c2cc(F)ccc2n1C ZINC000894765491 965678869 /nfs/dbraw/zinc/67/88/69/965678869.db2.gz JCTDUFRSWXOJBH-CQSZACIVSA-N 2 1 361.461 2.924 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)c2cc(F)ccc2n1C ZINC000894765491 965678878 /nfs/dbraw/zinc/67/88/78/965678878.db2.gz JCTDUFRSWXOJBH-CQSZACIVSA-N 2 1 361.461 2.924 20 10 FFCDMP CC(C)[N@@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 ZINC000728572333 967623330 /nfs/dbraw/zinc/62/33/30/967623330.db2.gz YHVPSPXFWFHQNY-UHFFFAOYSA-N 2 1 374.573 2.763 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206011532 1032108182 /nfs/dbraw/zinc/10/81/82/1032108182.db2.gz DGPJJNKOOHXZKZ-WBVHZDCISA-N 2 1 351.922 2.983 20 10 FFCDMP Cc1c(C[C@@H](C[NH3+])C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cnn1C ZINC000903884284 1016287862 /nfs/dbraw/zinc/28/78/62/1016287862.db2.gz WPRJLINZOJGLQG-IBGZPJMESA-N 2 1 357.546 2.823 20 10 FFCDMP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC1 ZINC000734057860 999186124 /nfs/dbraw/zinc/18/61/24/999186124.db2.gz BEFFEGOIXMTDCL-UHFFFAOYSA-N 2 1 372.557 2.706 20 10 FFCDMP C[N@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465834 1000262696 /nfs/dbraw/zinc/26/26/96/1000262696.db2.gz MHIJMCKXQBVYNB-UTKZUKDTSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000768465834 1000262701 /nfs/dbraw/zinc/26/27/01/1000262701.db2.gz MHIJMCKXQBVYNB-UTKZUKDTSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768465834 1000262704 /nfs/dbraw/zinc/26/27/04/1000262704.db2.gz MHIJMCKXQBVYNB-UTKZUKDTSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](OCC(F)(F)F)C3)cc2)CC1 ZINC000771824643 1001220796 /nfs/dbraw/zinc/22/07/96/1001220796.db2.gz OZEAUIHTBOADEO-GOSISDBHSA-N 2 1 371.447 2.982 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712917 1003758386 /nfs/dbraw/zinc/75/83/86/1003758386.db2.gz RZABXNCDNMCAIT-OAQYLSRUSA-N 3 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712917 1003758397 /nfs/dbraw/zinc/75/83/97/1003758397.db2.gz RZABXNCDNMCAIT-OAQYLSRUSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](CC)CN1C(C)=O ZINC000775720213 1003786476 /nfs/dbraw/zinc/78/64/76/1003786476.db2.gz IRRJOAJGLRUHGR-NHCUHLMSSA-N 2 1 372.557 2.660 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCN(c4nccs4)CC3)cc2)CC1 ZINC000775661799 1004986114 /nfs/dbraw/zinc/98/61/14/1004986114.db2.gz OYVRTRYELXKEDT-UHFFFAOYSA-N 2 1 371.554 2.607 20 10 FFCDMP CCOc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c(O)c1 ZINC000850357474 1005811057 /nfs/dbraw/zinc/81/10/57/1005811057.db2.gz KPEVXRLUHVQXHT-LJQANCHMSA-N 2 1 356.466 2.647 20 10 FFCDMP C[C@@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+](C)Cc1ccccc1O ZINC000111235257 1006362668 /nfs/dbraw/zinc/36/26/68/1006362668.db2.gz WFDKFFHSEQJUSC-FXAWDEMLSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235257 1006362678 /nfs/dbraw/zinc/36/26/78/1006362678.db2.gz WFDKFFHSEQJUSC-FXAWDEMLSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235257 1006362686 /nfs/dbraw/zinc/36/26/86/1006362686.db2.gz WFDKFFHSEQJUSC-FXAWDEMLSA-N 2 1 367.493 2.603 20 10 FFCDMP CCCC[N@@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)Cc1ccccc1O ZINC000801596673 1019157537 /nfs/dbraw/zinc/15/75/37/1019157537.db2.gz JMVRPSDOWHTIPS-UHFFFAOYSA-N 2 1 359.514 2.737 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@@H+]1Cc1cc(Cl)cc(C)c1O)CC[NH2+]CC2 ZINC001222230609 1032840626 /nfs/dbraw/zinc/84/06/26/1032840626.db2.gz BIMFXVQDJMBSML-MRXNPFEDSA-N 2 1 366.889 2.861 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(C)c1O)CC[NH2+]CC2 ZINC001222230609 1032840645 /nfs/dbraw/zinc/84/06/45/1032840645.db2.gz BIMFXVQDJMBSML-MRXNPFEDSA-N 2 1 366.889 2.861 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1O ZINC001118246009 1022141873 /nfs/dbraw/zinc/14/18/73/1022141873.db2.gz LMUFGQLLIHVPNH-KRWDZBQOSA-N 2 1 369.509 2.999 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CC3)C3CCOCC3)cc2F)CC1 ZINC001118248533 1022142099 /nfs/dbraw/zinc/14/20/99/1022142099.db2.gz YMZHFHQLPNGXKW-OAQYLSRUSA-N 2 1 361.505 2.872 20 10 FFCDMP COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000779605186 1024255312 /nfs/dbraw/zinc/25/53/12/1024255312.db2.gz RLEQGCFPSNMJGN-IBGZPJMESA-N 2 1 373.541 2.850 20 10 FFCDMP CC[N@H+]1CC[C@@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000248041125 1027371922 /nfs/dbraw/zinc/37/19/22/1027371922.db2.gz SUTAWWNUVAWWAJ-SIKLNZKXSA-N 2 1 374.573 2.527 20 10 FFCDMP CN(C)c1ccc([C@H]([NH3+])CNCc2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000841041205 1029996424 /nfs/dbraw/zinc/99/64/24/1029996424.db2.gz BVFIIJVAOZGMDA-HXUWFJFHSA-N 2 1 372.488 2.518 20 10 FFCDMP Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000798960956 1031595864 /nfs/dbraw/zinc/59/58/64/1031595864.db2.gz ONCHFOFHACCDAK-OAQYLSRUSA-N 2 1 353.514 2.899 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@H]1C[NH3+] ZINC001205654153 1031908782 /nfs/dbraw/zinc/90/87/82/1031908782.db2.gz WOHLPRFDPMFMDS-HOTGVXAUSA-N 2 1 351.922 2.983 20 10 FFCDMP CC[N@@H+](C)[C@@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281724 1034698762 /nfs/dbraw/zinc/69/87/62/1034698762.db2.gz VWJSDHRARUKKQD-VQTJNVASSA-N 2 1 354.498 2.562 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](c3nnc(C)o3)C2)cc(C[NH+](C)C)c1O ZINC001139259292 1035031799 /nfs/dbraw/zinc/03/17/99/1035031799.db2.gz PMEGWTCNYWKRRL-OAHLLOKOSA-N 2 1 360.458 2.533 20 10 FFCDMP COC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673249 1035194449 /nfs/dbraw/zinc/19/44/49/1035194449.db2.gz FJPAYOKCRZTHMT-IBGZPJMESA-N 2 1 373.541 2.910 20 10 FFCDMP COC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673249 1035194451 /nfs/dbraw/zinc/19/44/51/1035194451.db2.gz FJPAYOKCRZTHMT-IBGZPJMESA-N 2 1 373.541 2.910 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C(=O)OC)CC3)cc2)CC1 ZINC001140309424 1035429668 /nfs/dbraw/zinc/42/96/68/1035429668.db2.gz GCGCPWKHXMKMNS-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@@H+](Cc1cccc(C)c1O)C2 ZINC001235322552 1037475922 /nfs/dbraw/zinc/47/59/22/1037475922.db2.gz ZDVANFHSFWXFIA-PGRDOPGGSA-N 2 1 372.509 2.846 20 10 FFCDMP COc1ccc(Br)c(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c1O ZINC001231558258 1037681995 /nfs/dbraw/zinc/68/19/95/1037681995.db2.gz ZYRRHGZMGCDLDV-INIZCTEOSA-N 2 1 355.276 2.691 20 10 FFCDMP Cc1cccc(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c1O ZINC001231594143 1037713740 /nfs/dbraw/zinc/71/37/40/1037713740.db2.gz ZNWFGBSZHDKDML-TZIWHRDSSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1cccc(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccncc4)CCO[C@@H]3C2)c1O ZINC001231594143 1037713755 /nfs/dbraw/zinc/71/37/55/1037713755.db2.gz ZNWFGBSZHDKDML-TZIWHRDSSA-N 2 1 367.493 2.819 20 10 FFCDMP Clc1ccc([C@H]2C[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCN2)cc1 ZINC001235789629 1037746852 /nfs/dbraw/zinc/74/68/52/1037746852.db2.gz DKGYRGQCUBSKAU-OAQYLSRUSA-N 2 1 370.928 2.896 20 10 FFCDMP Clc1ccc([C@H]2CN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001235789629 1037746868 /nfs/dbraw/zinc/74/68/68/1037746868.db2.gz DKGYRGQCUBSKAU-OAQYLSRUSA-N 2 1 370.928 2.896 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]1C[NH2+]CC2 ZINC001236039618 1037901634 /nfs/dbraw/zinc/90/16/34/1037901634.db2.gz WMSYDIOYTMVCII-IIBYNOLFSA-N 2 1 360.498 2.664 20 10 FFCDMP COC(=O)[C@@H]([NH3+])C1CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001236067798 1037912779 /nfs/dbraw/zinc/91/27/79/1037912779.db2.gz PYKVRYSBMQCPNH-FQEVSTJZSA-N 2 1 355.482 2.806 20 10 FFCDMP CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236274257 1038014711 /nfs/dbraw/zinc/01/47/11/1038014711.db2.gz DUBMTTSZBJNAKK-UHFFFAOYSA-N 2 1 355.482 2.962 20 10 FFCDMP COc1ccc(Br)c(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236321138 1038043721 /nfs/dbraw/zinc/04/37/21/1038043721.db2.gz GAAMZPLUSGBOBT-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP CCOC(=O)c1c(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c2ccccc2n1C ZINC001236321373 1038046494 /nfs/dbraw/zinc/04/64/94/1038046494.db2.gz IXLMHPWELMGBKW-IYBDPMFKSA-N 2 1 355.482 2.786 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374570 1038061849 /nfs/dbraw/zinc/06/18/49/1038061849.db2.gz FDWHFLRVBGVRIQ-HXUWFJFHSA-N 2 1 356.558 2.840 20 10 FFCDMP COC(=O)c1c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599810 1038148186 /nfs/dbraw/zinc/14/81/86/1038148186.db2.gz DQQYJLCTUFPXPE-OAHLLOKOSA-N 2 1 355.482 2.929 20 10 FFCDMP COC(=O)c1c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599810 1038148190 /nfs/dbraw/zinc/14/81/90/1038148190.db2.gz DQQYJLCTUFPXPE-OAHLLOKOSA-N 2 1 355.482 2.929 20 10 FFCDMP CCC[N@@H+](Cc1c(O)cc(OC)cc1Br)C[C@H]1CC[NH2+]C1 ZINC001236845186 1038307007 /nfs/dbraw/zinc/30/70/07/1038307007.db2.gz ZLIKREITMOSDPE-LBPRGKRZSA-N 2 1 357.292 2.985 20 10 FFCDMP CCC[N@H+](Cc1c(O)cc(OC)cc1Br)C[C@H]1CC[NH2+]C1 ZINC001236845186 1038307022 /nfs/dbraw/zinc/30/70/22/1038307022.db2.gz ZLIKREITMOSDPE-LBPRGKRZSA-N 2 1 357.292 2.985 20 10 FFCDMP COc1cc(O)c(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(Br)c1 ZINC001237060466 1038428467 /nfs/dbraw/zinc/42/84/67/1038428467.db2.gz BHLASTQXWBOAJS-NEPJUHHUSA-N 2 1 355.276 2.547 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237485311 1043199086 /nfs/dbraw/zinc/19/90/86/1043199086.db2.gz NVGWVKPEERMTOD-KRWDZBQOSA-N 2 1 360.498 2.940 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001279523165 1043221099 /nfs/dbraw/zinc/22/10/99/1043221099.db2.gz NLDUHNBRYXROCY-GJZGRUSLSA-N 2 1 373.419 2.501 20 10 FFCDMP Oc1c(F)cccc1C[NH+]1CCC2(CC[N@H+](CCn3ccnc3)C2)CC1 ZINC001279528706 1043228435 /nfs/dbraw/zinc/22/84/35/1043228435.db2.gz GYFCLSVAVFSWIV-UHFFFAOYSA-N 2 1 358.461 2.716 20 10 FFCDMP Oc1c(F)cccc1C[NH+]1CCC2(CC[N@@H+](CCn3ccnc3)C2)CC1 ZINC001279528706 1043228442 /nfs/dbraw/zinc/22/84/42/1043228442.db2.gz GYFCLSVAVFSWIV-UHFFFAOYSA-N 2 1 358.461 2.716 20 10 FFCDMP C[NH+]1CCC2(CC1)C[N@H+](Cc1cc(O)c(O)c(O)c1)Cc1ccccc12 ZINC001279682548 1043460265 /nfs/dbraw/zinc/46/02/65/1043460265.db2.gz SNOYQOFDBCSAEA-UHFFFAOYSA-N 2 1 354.450 2.783 20 10 FFCDMP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cc(O)c(O)c(O)c1)Cc1ccccc12 ZINC001279682548 1043460271 /nfs/dbraw/zinc/46/02/71/1043460271.db2.gz SNOYQOFDBCSAEA-UHFFFAOYSA-N 2 1 354.450 2.783 20 10 FFCDMP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001324438608 1046030732 /nfs/dbraw/zinc/03/07/32/1046030732.db2.gz NVBPVXKNBLEHQM-UHFFFAOYSA-N 3 1 350.526 2.788 20 10 FFCDMP CCCC(O)(CCC)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001324923656 1046290727 /nfs/dbraw/zinc/29/07/27/1046290727.db2.gz CCHULTHNQBCHLK-UHFFFAOYSA-N 2 1 351.510 2.998 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@](C)(CO)C3CCCCC3)cc2F)CC1 ZINC001324924417 1046291375 /nfs/dbraw/zinc/29/13/75/1046291375.db2.gz PHKJSMQRFTVMLW-NRFANRHFSA-N 2 1 363.521 2.998 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@@H]3O)cc2F)CC1 ZINC001330532988 1049192978 /nfs/dbraw/zinc/19/29/78/1049192978.db2.gz JFDZGGNLYZHSKK-QFUCXCTJSA-N 2 1 361.505 2.703 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCC[C@@H]3O)cc2F)CC1 ZINC001330532988 1049192987 /nfs/dbraw/zinc/19/29/87/1049192987.db2.gz JFDZGGNLYZHSKK-QFUCXCTJSA-N 2 1 361.505 2.703 20 10 FFCDMP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H]1n1ccnc1 ZINC001341604650 1050230889 /nfs/dbraw/zinc/23/08/89/1050230889.db2.gz LEAJPOYMRCOOFI-DYESRHJHSA-N 2 1 371.504 2.857 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H]1n1ccnc1 ZINC001341604650 1050230902 /nfs/dbraw/zinc/23/09/02/1050230902.db2.gz LEAJPOYMRCOOFI-DYESRHJHSA-N 2 1 371.504 2.857 20 10 FFCDMP CCc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000848898798 1055323760 /nfs/dbraw/zinc/32/37/60/1055323760.db2.gz YLAFFVFLBPOFDS-RTWAWAEBSA-N 2 1 354.494 2.927 20 10 FFCDMP CCc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000848898798 1055323776 /nfs/dbraw/zinc/32/37/76/1055323776.db2.gz YLAFFVFLBPOFDS-RTWAWAEBSA-N 2 1 354.494 2.927 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CCCC[NH+]2CCN(C)CC2)c1 ZINC001461057523 1061198914 /nfs/dbraw/zinc/19/89/14/1061198914.db2.gz VDEWMRBPEMKTHF-UHFFFAOYSA-N 2 1 370.335 2.580 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CSCCS3)cc2F)CC1 ZINC001474042880 1065445000 /nfs/dbraw/zinc/44/50/00/1065445000.db2.gz QDUQRQDBZXCBJC-OAHLLOKOSA-N 2 1 355.548 2.516 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)c1O ZINC000371848260 512602198 /nfs/dbraw/zinc/60/21/98/512602198.db2.gz YNVKNMGWYUUFHV-HRCADAONSA-N 2 1 354.878 2.738 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)c1O ZINC000371848260 512602202 /nfs/dbraw/zinc/60/22/02/512602202.db2.gz YNVKNMGWYUUFHV-HRCADAONSA-N 2 1 354.878 2.738 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[NH+]2CCC3(CO[C@H](C[NH3+])C3)CC2)c1O ZINC000923455691 738285543 /nfs/dbraw/zinc/28/55/43/738285543.db2.gz MIHHMYNRYNNEAG-HNNXBMFYSA-N 2 1 352.862 2.578 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3nc(NCC4CC4)cc[nH+]3)cc2)CC1 ZINC001167423015 963013104 /nfs/dbraw/zinc/01/31/04/963013104.db2.gz JZOYYKFWUKCEKK-UHFFFAOYSA-N 2 1 352.486 2.662 20 10 FFCDMP COc1ccc(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1Cn1cccn1 ZINC000873114315 1013390681 /nfs/dbraw/zinc/39/06/81/1013390681.db2.gz AGGQVLVXICVZJP-GOSISDBHSA-N 2 1 372.513 2.531 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1O ZINC001205996037 1032101064 /nfs/dbraw/zinc/10/10/64/1032101064.db2.gz UBZLOASGUMMLBV-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3cc(C)cc(C)c3O)CC2)CC1 ZINC000164312247 984348837 /nfs/dbraw/zinc/34/88/37/984348837.db2.gz UYDSGVLYTUPFQE-UHFFFAOYSA-N 2 1 373.541 2.775 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(O)cc1Br ZINC001206025647 1032112051 /nfs/dbraw/zinc/11/20/51/1032112051.db2.gz OPQHEGFPEZRGIR-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP O[C@@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921979183 987430460 /nfs/dbraw/zinc/43/04/60/987430460.db2.gz DECPIWHOVHJUAO-OAQYLSRUSA-N 2 1 352.478 2.868 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000922391157 988547286 /nfs/dbraw/zinc/54/72/86/988547286.db2.gz UCYGIXDYAVJXDK-VZHGDBGRSA-N 2 1 357.542 2.835 20 10 FFCDMP COc1ccc(C[NH2+]C[C@@H]2CN(C(=O)C[N@@H+](C)C(C)C)C[C@H]2C)cc1C ZINC001107042592 993296329 /nfs/dbraw/zinc/29/63/29/993296329.db2.gz UFANCLYMBQIMLZ-IEBWSBKVSA-N 2 1 361.530 2.528 20 10 FFCDMP Cc1cccc(C[N@@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000809694630 994571210 /nfs/dbraw/zinc/57/12/10/994571210.db2.gz RCVWSENNQFXPHC-UHFFFAOYSA-N 2 1 353.510 2.950 20 10 FFCDMP CCO[C@@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C[C@H]1C[NH3+] ZINC000844903929 998214680 /nfs/dbraw/zinc/21/46/80/998214680.db2.gz SDCXWFWBLRQAJZ-WIYYLYMNSA-N 2 1 356.466 2.767 20 10 FFCDMP CC[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CN1C(C)=O ZINC000775720211 1003786938 /nfs/dbraw/zinc/78/69/38/1003786938.db2.gz IRRJOAJGLRUHGR-LEWJYISDSA-N 2 1 372.557 2.660 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C(=O)OC(C)(C)C)cc2)CC1 ZINC000775724954 1003840116 /nfs/dbraw/zinc/84/01/16/1003840116.db2.gz OYOFSZCTHZVZST-LJQANCHMSA-N 2 1 359.514 2.745 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3C(=O)OC(C)(C)C)cc2)CC1 ZINC000775724954 1003840130 /nfs/dbraw/zinc/84/01/30/1003840130.db2.gz OYOFSZCTHZVZST-LJQANCHMSA-N 2 1 359.514 2.745 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@H]1COc2ccccc2O1 ZINC000775643575 1004909563 /nfs/dbraw/zinc/90/95/63/1004909563.db2.gz RFWNUVSRPXSWEY-FQEVSTJZSA-N 2 1 367.493 2.710 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)Cc2ccccc21 ZINC000775676347 1005071719 /nfs/dbraw/zinc/07/17/19/1005071719.db2.gz RGCGOJCUZUOLGU-UHFFFAOYSA-N 2 1 350.510 2.890 20 10 FFCDMP CCOc1ccc(O)c(C[N@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c1 ZINC000817414410 1007593033 /nfs/dbraw/zinc/59/30/33/1007593033.db2.gz YUKTUEQLUJCJLV-UHFFFAOYSA-N 2 1 361.530 2.783 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902535 1007804978 /nfs/dbraw/zinc/80/49/78/1007804978.db2.gz SPRADVLULSFUEL-SESVDKBCSA-N 2 1 374.548 2.978 20 10 FFCDMP C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NC[C@@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@H+]2C1 ZINC001180179476 1009573299 /nfs/dbraw/zinc/57/32/99/1009573299.db2.gz PDBWXWQGUNSRQV-LMQGHGSNSA-N 2 1 372.557 2.592 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167811 1032797788 /nfs/dbraw/zinc/79/77/88/1032797788.db2.gz RUZSKRXHGMSXNU-QFIPXVFZSA-N 3 1 356.558 2.842 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167516 1032800499 /nfs/dbraw/zinc/80/04/99/1032800499.db2.gz NALGAQXTMSMXER-JOCHJYFZSA-N 3 1 372.557 2.548 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)cc2)CC1 ZINC000903217559 1020746924 /nfs/dbraw/zinc/74/69/24/1020746924.db2.gz XFDTVRBYSBPULD-CZAFVFSZSA-N 3 1 354.542 2.686 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)cc2)CC1 ZINC000903217559 1020746929 /nfs/dbraw/zinc/74/69/29/1020746929.db2.gz XFDTVRBYSBPULD-CZAFVFSZSA-N 2 1 354.542 2.686 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)cc2)CC1 ZINC000903217559 1020746932 /nfs/dbraw/zinc/74/69/32/1020746932.db2.gz XFDTVRBYSBPULD-CZAFVFSZSA-N 2 1 354.542 2.686 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)cc2F)CC1 ZINC001116440663 1021217236 /nfs/dbraw/zinc/21/72/36/1021217236.db2.gz XRLGDASXQXLQIN-KRWDZBQOSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)cc2F)CC1 ZINC001116440663 1021217244 /nfs/dbraw/zinc/21/72/44/1021217244.db2.gz XRLGDASXQXLQIN-KRWDZBQOSA-N 2 1 357.477 2.680 20 10 FFCDMP CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116755296 1021397940 /nfs/dbraw/zinc/39/79/40/1021397940.db2.gz CFAFFZICTGUUAR-OAQYLSRUSA-N 2 1 363.521 2.951 20 10 FFCDMP CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116755296 1021397959 /nfs/dbraw/zinc/39/79/59/1021397959.db2.gz CFAFFZICTGUUAR-OAQYLSRUSA-N 2 1 363.521 2.951 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(O)ccc4C3)cc2F)CC1 ZINC001116824455 1021439088 /nfs/dbraw/zinc/43/90/88/1021439088.db2.gz XANDGDPKJKTATA-IBGZPJMESA-N 2 1 369.484 2.930 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4[nH]c(=O)ccc43)cc2F)CC1 ZINC001117583739 1021767577 /nfs/dbraw/zinc/76/75/77/1021767577.db2.gz WRMHJILCPAHPIB-GOSISDBHSA-N 2 1 370.472 2.845 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](CO)CC(C)(C)C ZINC001117788937 1021891067 /nfs/dbraw/zinc/89/10/67/1021891067.db2.gz CFUDYLMVUJJBEX-QGZVFWFLSA-N 2 1 351.510 2.806 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](CO)CC(C)(C)C ZINC001117788937 1021891080 /nfs/dbraw/zinc/89/10/80/1021891080.db2.gz CFUDYLMVUJJBEX-QGZVFWFLSA-N 2 1 351.510 2.806 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)cc2F)CC1 ZINC000155321478 1022240230 /nfs/dbraw/zinc/24/02/30/1022240230.db2.gz TVLNOZVBUKECAA-QGZVFWFLSA-N 2 1 362.537 2.788 20 10 FFCDMP CC[N@H+]1CC[C@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000248041127 1027371858 /nfs/dbraw/zinc/37/18/58/1027371858.db2.gz SUTAWWNUVAWWAJ-UGKGYDQZSA-N 2 1 374.573 2.527 20 10 FFCDMP c1cc(N2CCCCC2)ccc1C[NH2+]C1CCC(N2CC[NH2+]CC2)CC1 ZINC000841087734 1030027306 /nfs/dbraw/zinc/02/73/06/1030027306.db2.gz RYFWSZWZKZBGHF-UHFFFAOYSA-N 2 1 356.558 2.983 20 10 FFCDMP CC(C)C[C@@H](CN(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001203960973 1031013389 /nfs/dbraw/zinc/01/33/89/1031013389.db2.gz LAATVZPZMJSJBE-SFHVURJKSA-N 2 1 350.526 2.643 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139257103 1035030531 /nfs/dbraw/zinc/03/05/31/1035030531.db2.gz RMSJKBAFHJASKP-GOSISDBHSA-N 2 1 357.454 2.511 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139259180 1035031331 /nfs/dbraw/zinc/03/13/31/1035031331.db2.gz LPEDXHVTSWCVRZ-GOSISDBHSA-N 2 1 357.454 2.511 20 10 FFCDMP CCc1noc([C@@H]2CCC[N@@H+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)C2)n1 ZINC001139258629 1035032264 /nfs/dbraw/zinc/03/22/64/1035032264.db2.gz VFBWCCKQIDHPCB-OAHLLOKOSA-N 2 1 374.485 2.787 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@]1(O)C(F)(F)F ZINC001139408743 1035094035 /nfs/dbraw/zinc/09/40/35/1035094035.db2.gz PWFNIOSZSKAOSX-YJBOKZPZSA-N 2 1 371.447 2.574 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(C(=O)CC(C)C)CC3)cc2)CC1 ZINC001140305671 1035427671 /nfs/dbraw/zinc/42/76/71/1035427671.db2.gz FJNNUPWOQSGNJA-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000835039838 1035491799 /nfs/dbraw/zinc/49/17/99/1035491799.db2.gz KIQABTTXOFDTLO-FBQZBAQISA-N 2 1 365.521 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000835039838 1035491802 /nfs/dbraw/zinc/49/18/02/1035491802.db2.gz KIQABTTXOFDTLO-FBQZBAQISA-N 2 1 365.521 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C/C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052733 1035493519 /nfs/dbraw/zinc/49/35/19/1035493519.db2.gz HIESVNJOSZHDHE-BDNZGDGKSA-N 2 1 356.558 2.866 20 10 FFCDMP CC(C)N1CCOC[C@]2(CCC[N@@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836974 1036091226 /nfs/dbraw/zinc/09/12/26/1036091226.db2.gz XZLWSNBWMSGTTB-NRFANRHFSA-N 2 1 361.530 2.781 20 10 FFCDMP CC(C)[NH+]1CCOC[C@]2(CCC[N@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836974 1036091284 /nfs/dbraw/zinc/09/12/84/1036091284.db2.gz XZLWSNBWMSGTTB-NRFANRHFSA-N 2 1 361.530 2.781 20 10 FFCDMP CC(C)[NH+]1CCOC[C@]2(CCC[N@@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836974 1036091307 /nfs/dbraw/zinc/09/13/07/1036091307.db2.gz XZLWSNBWMSGTTB-NRFANRHFSA-N 2 1 361.530 2.781 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487294 1036655042 /nfs/dbraw/zinc/65/50/42/1036655042.db2.gz XWAHNSRBHGLXHL-AEFFLSMTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487294 1036655049 /nfs/dbraw/zinc/65/50/49/1036655049.db2.gz XWAHNSRBHGLXHL-AEFFLSMTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487294 1036655059 /nfs/dbraw/zinc/65/50/59/1036655059.db2.gz XWAHNSRBHGLXHL-AEFFLSMTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487294 1036655069 /nfs/dbraw/zinc/65/50/69/1036655069.db2.gz XWAHNSRBHGLXHL-AEFFLSMTSA-N 2 1 354.450 2.757 20 10 FFCDMP c1c(C[N@@H+]2CCOC[C@]3(CCC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001235007031 1037297939 /nfs/dbraw/zinc/29/79/39/1037297939.db2.gz JEWVZZHEFNZZBX-QFIPXVFZSA-N 2 1 355.526 2.587 20 10 FFCDMP c1c(C[N@H+]2CCOC[C@]3(CCC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001235007031 1037297954 /nfs/dbraw/zinc/29/79/54/1037297954.db2.gz JEWVZZHEFNZZBX-QFIPXVFZSA-N 2 1 355.526 2.587 20 10 FFCDMP COc1ccc(Br)c(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)c1O ZINC001231551410 1037674396 /nfs/dbraw/zinc/67/43/96/1037674396.db2.gz YVUAQPJIYVJDEJ-NEPJUHHUSA-N 2 1 355.276 2.547 20 10 FFCDMP COc1ccc(Br)c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c1O ZINC001231551410 1037674402 /nfs/dbraw/zinc/67/44/02/1037674402.db2.gz YVUAQPJIYVJDEJ-NEPJUHHUSA-N 2 1 355.276 2.547 20 10 FFCDMP c1ccc(CO[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688110 1037682546 /nfs/dbraw/zinc/68/25/46/1037682546.db2.gz NJJVQDQFDDAASI-JOCHJYFZSA-N 2 1 351.494 2.887 20 10 FFCDMP CCOC(=O)C1CC[NH+](C2CC[NH+](Cc3cccc(C)c3O)CC2)CC1 ZINC001231591801 1037712628 /nfs/dbraw/zinc/71/26/28/1037712628.db2.gz KYJQZKLEFWTMHT-UHFFFAOYSA-N 2 1 360.498 2.940 20 10 FFCDMP CN(CC[N@@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1)Cc1ccccc1 ZINC001236306706 1038035694 /nfs/dbraw/zinc/03/56/94/1038035694.db2.gz BKCJILACBOSMIC-UHFFFAOYSA-N 2 1 352.526 2.660 20 10 FFCDMP CN(CC[N@H+](C)Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236306706 1038035705 /nfs/dbraw/zinc/03/57/05/1038035705.db2.gz BKCJILACBOSMIC-UHFFFAOYSA-N 2 1 352.526 2.660 20 10 FFCDMP CN(CC[N@@H+](C)Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236306706 1038035724 /nfs/dbraw/zinc/03/57/24/1038035724.db2.gz BKCJILACBOSMIC-UHFFFAOYSA-N 2 1 352.526 2.660 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)cc1Br ZINC001236321087 1038044285 /nfs/dbraw/zinc/04/42/85/1038044285.db2.gz OVKHNTDBQZNYDU-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP CO[C@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C[C@@H]21 ZINC001236937752 1038367289 /nfs/dbraw/zinc/36/72/89/1038367289.db2.gz DUKQBXFOJXJIEL-PBEJRMEISA-N 2 1 361.505 2.824 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4ccccn4)C3)c(F)c2)CC1 ZINC001236944090 1038372933 /nfs/dbraw/zinc/37/29/33/1038372933.db2.gz ZNZQMKCQBQXEEN-IBGZPJMESA-N 2 1 370.472 2.626 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]4(CC[NH+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552038 /nfs/dbraw/zinc/55/20/38/1039552038.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC[C@]4(CC[N@H+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552054 /nfs/dbraw/zinc/55/20/54/1039552054.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC[C@]4(CC[N@@H+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552065 /nfs/dbraw/zinc/55/20/65/1039552065.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@]4(CC[N@H+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552081 /nfs/dbraw/zinc/55/20/81/1039552081.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 2 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@]4(CC[N@@H+](C)C4)C3)cc2)CC1 ZINC001278474462 1039552100 /nfs/dbraw/zinc/55/21/00/1039552100.db2.gz JHDWNJDBOKDHAB-JOCHJYFZSA-N 2 1 356.558 2.746 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001249201221 1040625727 /nfs/dbraw/zinc/62/57/27/1040625727.db2.gz LBDDXYPMAOKXEI-IBGZPJMESA-N 2 1 360.498 2.948 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC12C[NH2+]C2 ZINC001237428551 1043154364 /nfs/dbraw/zinc/15/43/64/1043154364.db2.gz AYHJIOROMQVLAD-LBPRGKRZSA-N 2 1 373.280 2.674 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC12C[NH2+]C2 ZINC001237428551 1043154369 /nfs/dbraw/zinc/15/43/69/1043154369.db2.gz AYHJIOROMQVLAD-LBPRGKRZSA-N 2 1 373.280 2.674 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)cc2F)CC1 ZINC001318724658 1044839732 /nfs/dbraw/zinc/83/97/32/1044839732.db2.gz RMPANCDQNUSZPX-AHRSYUTCSA-N 2 1 361.505 2.871 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)cc2F)CC1 ZINC001327006134 1047159211 /nfs/dbraw/zinc/15/92/11/1047159211.db2.gz XBBMUOXBSRLWRR-UHFFFAOYSA-N 2 1 360.521 2.543 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)cc2F)CC1 ZINC001327006134 1047159215 /nfs/dbraw/zinc/15/92/15/1047159215.db2.gz XBBMUOXBSRLWRR-UHFFFAOYSA-N 3 1 360.521 2.543 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)cc2F)CC1 ZINC001327006134 1047159223 /nfs/dbraw/zinc/15/92/23/1047159223.db2.gz XBBMUOXBSRLWRR-UHFFFAOYSA-N 3 1 360.521 2.543 20 10 FFCDMP Cn1ncc2ccc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)cc21 ZINC001343633769 1052347833 /nfs/dbraw/zinc/34/78/33/1052347833.db2.gz CKYBCJSCCSTBCQ-UHFFFAOYSA-N 2 1 367.472 2.754 20 10 FFCDMP CC(C)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1cnn(C)c1 ZINC001352034999 1055141415 /nfs/dbraw/zinc/14/14/15/1055141415.db2.gz YXGOYXCHTOXCTE-FQEVSTJZSA-N 2 1 359.493 2.798 20 10 FFCDMP COC(=O)c1c(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c2cc(F)ccc2n1C ZINC001462327274 1061585908 /nfs/dbraw/zinc/58/59/08/1061585908.db2.gz OPWVZXVUXUJQJQ-CQSZACIVSA-N 2 1 361.461 2.926 20 10 FFCDMP CC[C@](C)(C[NH3+])C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948325 1078288755 /nfs/dbraw/zinc/28/87/55/1078288755.db2.gz IXVHPRVBRMPKRH-MAUKXSAKSA-N 2 1 353.894 2.501 20 10 FFCDMP CC(C)C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)N(C)C ZINC001560258960 1076257377 /nfs/dbraw/zinc/25/73/77/1076257377.db2.gz PPUHAGXUMFNDPJ-GOSISDBHSA-N 2 1 350.526 2.643 20 10 FFCDMP CC[C@@H]1[C@@H](C(=O)N(C)C[C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@H+]1C ZINC001571388426 1077249740 /nfs/dbraw/zinc/24/97/40/1077249740.db2.gz PYBNYYMDMXOBTH-YTQUADARSA-N 2 1 361.530 2.670 20 10 FFCDMP C[N@@H+](CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)Cc1ccccc1O ZINC000109828559 507990827 /nfs/dbraw/zinc/99/08/27/507990827.db2.gz DNTFMFBLZXKHSM-UHFFFAOYSA-N 2 1 367.493 2.736 20 10 FFCDMP Cc1cc(Br)cc([C@@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)c1O ZINC000187050448 510028175 /nfs/dbraw/zinc/02/81/75/510028175.db2.gz KHSVGZWRKNEJJG-CYBMUJFWSA-N 2 1 371.319 2.961 20 10 FFCDMP C[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cc(Br)ccc1O ZINC000282357495 510944032 /nfs/dbraw/zinc/94/40/32/510944032.db2.gz PNJQHGLLYOCJKZ-CYBMUJFWSA-N 2 1 370.335 2.831 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391141 738135980 /nfs/dbraw/zinc/13/59/80/738135980.db2.gz SWKFEMZFDMTBCV-UWIFEVILSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391141 738135982 /nfs/dbraw/zinc/13/59/82/738135982.db2.gz SWKFEMZFDMTBCV-UWIFEVILSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391141 738135983 /nfs/dbraw/zinc/13/59/83/738135983.db2.gz SWKFEMZFDMTBCV-UWIFEVILSA-N 2 1 356.869 2.754 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000799345978 740411140 /nfs/dbraw/zinc/41/11/40/740411140.db2.gz CTJKPRQMWXZPES-UHFFFAOYSA-N 2 1 370.335 2.579 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c1 ZINC000799345978 740411142 /nfs/dbraw/zinc/41/11/42/740411142.db2.gz CTJKPRQMWXZPES-UHFFFAOYSA-N 2 1 370.335 2.579 20 10 FFCDMP CN(CC[N@H+](C)Cc1cccc(Br)c1O)C1CC[NH+](C)CC1 ZINC000809734843 741337856 /nfs/dbraw/zinc/33/78/56/741337856.db2.gz ROPIICSTMUHKPK-UHFFFAOYSA-N 2 1 370.335 2.613 20 10 FFCDMP CN(CC[N@@H+](C)Cc1cccc(Br)c1O)C1CC[NH+](C)CC1 ZINC000809734843 741337858 /nfs/dbraw/zinc/33/78/58/741337858.db2.gz ROPIICSTMUHKPK-UHFFFAOYSA-N 2 1 370.335 2.613 20 10 FFCDMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H](C)C1 ZINC000839144703 746787539 /nfs/dbraw/zinc/78/75/39/746787539.db2.gz JRKPGYMCMFAHKT-KBXCAEBGSA-N 2 1 353.457 2.621 20 10 FFCDMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H](C)C1 ZINC000839144703 746787545 /nfs/dbraw/zinc/78/75/45/746787545.db2.gz JRKPGYMCMFAHKT-KBXCAEBGSA-N 2 1 353.457 2.621 20 10 FFCDMP Cc1cc(Br)cc(C[N@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c1O ZINC000843125510 747777405 /nfs/dbraw/zinc/77/74/05/747777405.db2.gz XLQKPDYSNUOYFO-AWEZNQCLSA-N 2 1 369.303 2.650 20 10 FFCDMP CC(C)C[N@H+](CC(=O)NCc1ccc(N(C)C)cc1)CC1CC[NH+](C)CC1 ZINC001175601276 1013508235 /nfs/dbraw/zinc/50/82/35/1013508235.db2.gz ITZPTEKFLJIMEX-UHFFFAOYSA-N 2 1 374.573 2.669 20 10 FFCDMP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH+](Cc4c(O)cc(O)cc4O)C[C@@H]3C2)cc1 ZINC001144509680 998622692 /nfs/dbraw/zinc/62/26/92/998622692.db2.gz IAHCBODPQHNKNR-CALCHBBNSA-N 2 1 354.450 2.676 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3C[N@@H+](Cc4c(O)cc(O)cc4O)C[C@@H]3C2)cc1 ZINC001144509680 998622695 /nfs/dbraw/zinc/62/26/95/998622695.db2.gz IAHCBODPQHNKNR-CALCHBBNSA-N 2 1 354.450 2.676 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+](Cc4c(O)cc(O)cc4O)C[C@@H]3C2)cc1 ZINC001144509680 998622699 /nfs/dbraw/zinc/62/26/99/998622699.db2.gz IAHCBODPQHNKNR-CALCHBBNSA-N 2 1 354.450 2.676 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712916 1003758514 /nfs/dbraw/zinc/75/85/14/1003758514.db2.gz RZABXNCDNMCAIT-NRFANRHFSA-N 3 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@H]([NH+]4CCCC4)CC3)cc2)CC1 ZINC000775712916 1003758522 /nfs/dbraw/zinc/75/85/22/1003758522.db2.gz RZABXNCDNMCAIT-NRFANRHFSA-N 2 1 356.558 2.889 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc([S@](C)=O)cc1 ZINC000775726557 1003860107 /nfs/dbraw/zinc/86/01/07/1003860107.db2.gz VLHXEIWTYJRMOU-SANMLTNESA-N 2 1 371.550 2.808 20 10 FFCDMP C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775659058 1004974795 /nfs/dbraw/zinc/97/47/95/1004974795.db2.gz UNCODFSCEAXNJW-IBGZPJMESA-N 2 1 353.510 2.821 20 10 FFCDMP CCOc1cccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850357402 1005810561 /nfs/dbraw/zinc/81/05/61/1005810561.db2.gz IMIAPLGRRACHLQ-LJQANCHMSA-N 2 1 356.466 2.647 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000853093068 1006292704 /nfs/dbraw/zinc/29/27/04/1006292704.db2.gz AUEFUQKXLMOKAT-NRFANRHFSA-N 3 1 356.558 2.650 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC[C@@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000853093068 1006292714 /nfs/dbraw/zinc/29/27/14/1006292714.db2.gz AUEFUQKXLMOKAT-NRFANRHFSA-N 2 1 356.558 2.650 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC[C@@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000853093068 1006292723 /nfs/dbraw/zinc/29/27/23/1006292723.db2.gz AUEFUQKXLMOKAT-NRFANRHFSA-N 2 1 356.558 2.650 20 10 FFCDMP COCC[NH+](CCOC)C1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000815117148 1006514561 /nfs/dbraw/zinc/51/45/61/1006514561.db2.gz LWHUFHSZEUQVCR-UHFFFAOYSA-N 2 1 363.546 2.620 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[N@@H+](C)Cc4ccccc43)cc2)CC1 ZINC000816618506 1007139201 /nfs/dbraw/zinc/13/92/01/1007139201.db2.gz ZMUOAVQSGBJHJK-UHFFFAOYSA-N 2 1 350.510 2.890 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940262 1007818279 /nfs/dbraw/zinc/81/82/79/1007818279.db2.gz FCBMLSRKQWZQFB-YHYVQYDKSA-N 2 1 367.541 2.648 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1c(O)cccc1F ZINC000886549074 1008733290 /nfs/dbraw/zinc/73/32/90/1008733290.db2.gz BEXMBBHYCZRDRT-AWEZNQCLSA-N 2 1 359.445 2.674 20 10 FFCDMP COc1cc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)c(O)c(C(C)(C)C)c1 ZINC000827698697 1018618906 /nfs/dbraw/zinc/61/89/06/1018618906.db2.gz AXZILOJZUJYIAW-KRWDZBQOSA-N 2 1 362.514 2.729 20 10 FFCDMP COc1ccc2c(c1)OCC[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000802659412 1020300049 /nfs/dbraw/zinc/30/00/49/1020300049.db2.gz NLTGJGKWCDHHLI-UHFFFAOYSA-N 2 1 367.493 2.842 20 10 FFCDMP COc1ccc2c(c1)OCC[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000802659412 1020300060 /nfs/dbraw/zinc/30/00/60/1020300060.db2.gz NLTGJGKWCDHHLI-UHFFFAOYSA-N 2 1 367.493 2.842 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)cc2F)CC1 ZINC001116440687 1021218021 /nfs/dbraw/zinc/21/80/21/1021218021.db2.gz XRLGDASXQXLQIN-QGZVFWFLSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)cc2F)CC1 ZINC001116440687 1021218026 /nfs/dbraw/zinc/21/80/26/1021218026.db2.gz XRLGDASXQXLQIN-QGZVFWFLSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C(C)(C)C)[C@H](O)C3)cc2F)CC1 ZINC001116502390 1021250222 /nfs/dbraw/zinc/25/02/22/1021250222.db2.gz UVNYUMLBKKFQSY-YLJYHZDGSA-N 2 1 363.521 2.806 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C(C)(C)C)[C@H](O)C3)cc2F)CC1 ZINC001116502390 1021250227 /nfs/dbraw/zinc/25/02/27/1021250227.db2.gz UVNYUMLBKKFQSY-YLJYHZDGSA-N 2 1 363.521 2.806 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c2c1c(F)ccc2O ZINC000756561696 1023729603 /nfs/dbraw/zinc/72/96/03/1023729603.db2.gz HCGOTFIXGBXMRC-CJNGLKHVSA-N 2 1 363.477 2.612 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203931611 1030990063 /nfs/dbraw/zinc/99/00/63/1030990063.db2.gz KCPBLWKKBSFOFZ-IRLDBZIGSA-N 2 1 357.542 2.933 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203931611 1030990082 /nfs/dbraw/zinc/99/00/82/1030990082.db2.gz KCPBLWKKBSFOFZ-IRLDBZIGSA-N 2 1 357.542 2.933 20 10 FFCDMP CC(C)[N@@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3ccc(O)cc3O)CC[C@@H]21 ZINC001204273501 1031198623 /nfs/dbraw/zinc/19/86/23/1031198623.db2.gz COVLSRSMCKDPQO-HBFSDRIKSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3ccc(O)cc3O)CC[C@@H]21 ZINC001204273501 1031198632 /nfs/dbraw/zinc/19/86/32/1031198632.db2.gz COVLSRSMCKDPQO-HBFSDRIKSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@H+](Cc3ccc(O)cc3O)CC[C@@H]21 ZINC001204273501 1031198639 /nfs/dbraw/zinc/19/86/39/1031198639.db2.gz COVLSRSMCKDPQO-HBFSDRIKSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@@H+](Cc3ccc(O)cc3O)CC[C@@H]21 ZINC001204273501 1031198648 /nfs/dbraw/zinc/19/86/48/1031198648.db2.gz COVLSRSMCKDPQO-HBFSDRIKSA-N 2 1 370.497 2.668 20 10 FFCDMP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H](c2cccc(Cl)c2)[NH+](C)C)cc1 ZINC000832273561 1034694416 /nfs/dbraw/zinc/69/44/16/1034694416.db2.gz OTMPAECTTGMCST-MOPGFXCFSA-N 2 1 374.916 2.825 20 10 FFCDMP CCOC(=O)C[C@@H]1CCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139254572 1035030157 /nfs/dbraw/zinc/03/01/57/1035030157.db2.gz ITPOGJBQPQAHMO-HNNXBMFYSA-N 2 1 364.486 2.628 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cnc(C5CC5)nc4C3)cc2)CC1 ZINC001139411227 1035095860 /nfs/dbraw/zinc/09/58/60/1035095860.db2.gz AMCWWKSTKNGEBH-UHFFFAOYSA-N 2 1 363.509 2.664 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4cnc(C5CC5)nc4C3)cc2)CC1 ZINC001139411227 1035095868 /nfs/dbraw/zinc/09/58/68/1035095868.db2.gz AMCWWKSTKNGEBH-UHFFFAOYSA-N 2 1 363.509 2.664 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@](CO)(C(F)(F)F)C3)cc2)CC1 ZINC001140302102 1035424845 /nfs/dbraw/zinc/42/48/45/1035424845.db2.gz JTZUEJKWKIVBOY-SFHVURJKSA-N 2 1 371.447 2.575 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3cnccn3)cc2)CC1 ZINC001140303791 1035426303 /nfs/dbraw/zinc/42/63/03/1035426303.db2.gz ASBIMFYEYSEKLE-OAQYLSRUSA-N 2 1 351.498 2.956 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]4(CCC(=O)O4)C3)cc2)CC1 ZINC001140305576 1035427324 /nfs/dbraw/zinc/42/73/24/1035427324.db2.gz CRCDAOWSIKOWSF-NRFANRHFSA-N 2 1 357.498 2.500 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](CC(=O)OC)C3CCCC3)cc2)CC1 ZINC001140305593 1035427679 /nfs/dbraw/zinc/42/76/79/1035427679.db2.gz DEEMDVWDWCMBSK-UHFFFAOYSA-N 2 1 359.514 2.746 20 10 FFCDMP CC[C@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306584 1035428353 /nfs/dbraw/zinc/42/83/53/1035428353.db2.gz USNGDZJAJWOMKE-PXNSSMCTSA-N 2 1 361.530 2.848 20 10 FFCDMP CC[C@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306584 1035428355 /nfs/dbraw/zinc/42/83/55/1035428355.db2.gz USNGDZJAJWOMKE-PXNSSMCTSA-N 2 1 361.530 2.848 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](CCC[NH+](C)C)CCC(=O)OC)c(O)c1 ZINC001140855002 1036290607 /nfs/dbraw/zinc/29/06/07/1036290607.db2.gz JOPWNPCLADDOJR-UHFFFAOYSA-N 2 1 365.518 2.555 20 10 FFCDMP CC(C)(C)c1ccc(C[NH+]2CCC([NH+]3CCC(C(N)=O)CC3)CC2)c(O)c1 ZINC001235678746 1037676859 /nfs/dbraw/zinc/67/68/59/1037676859.db2.gz MKNJYDWJYRJNLW-UHFFFAOYSA-N 2 1 373.541 2.851 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[NH+](Cc4ccc(C)cc4)C[C@@H]3C2)c(O)cc1O ZINC001231634434 1037756634 /nfs/dbraw/zinc/75/66/34/1037756634.db2.gz IUAMOVAUNJWKFZ-RTBURBONSA-N 2 1 368.477 2.979 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3cc4ccccc4cc3O)C[C@H]1C[NH2+]CC2 ZINC001236041980 1037906659 /nfs/dbraw/zinc/90/66/59/1037906659.db2.gz ZAROASVSQZTOID-WIYYLYMNSA-N 2 1 354.450 2.520 20 10 FFCDMP Cc1cc(C)c(C[NH+]2C[C@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001231844403 1037942955 /nfs/dbraw/zinc/94/29/55/1037942955.db2.gz HXZWKQLZEDFLKU-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[NH+]2C[C@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001231844403 1037942967 /nfs/dbraw/zinc/94/29/67/1037942967.db2.gz HXZWKQLZEDFLKU-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[N@@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001231844403 1037942979 /nfs/dbraw/zinc/94/29/79/1037942979.db2.gz HXZWKQLZEDFLKU-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[N@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001231844403 1037942984 /nfs/dbraw/zinc/94/29/84/1037942984.db2.gz HXZWKQLZEDFLKU-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP COc1ccc(N2CC[NH+](C[C@@H]3[C@@H](C)C[NH2+]CC3(F)F)CC2)c(C)c1 ZINC001236368902 1038061327 /nfs/dbraw/zinc/06/13/27/1038061327.db2.gz WMPZGWYYEYPGKT-DOTOQJQBSA-N 2 1 353.457 2.616 20 10 FFCDMP COc1ccc(N2CC[NH+](C[C@H]3[C@H](C)C[NH2+]CC3(F)F)CC2)c(C)c1 ZINC001236368932 1038062171 /nfs/dbraw/zinc/06/21/71/1038062171.db2.gz WMPZGWYYEYPGKT-WBVHZDCISA-N 2 1 353.457 2.616 20 10 FFCDMP COc1cc(C)c(C[N@@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c(O)c1 ZINC001236809456 1038284180 /nfs/dbraw/zinc/28/41/80/1038284180.db2.gz RYWNZWCEEIULCT-HDICACEKSA-N 2 1 353.466 2.668 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4ccccn4)C3)c(F)c2)CC1 ZINC001236938783 1038369383 /nfs/dbraw/zinc/36/93/83/1038369383.db2.gz NHAHSUMEXZFHDR-GOSISDBHSA-N 2 1 354.473 2.962 20 10 FFCDMP CCOc1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001237043039 1038420545 /nfs/dbraw/zinc/42/05/45/1038420545.db2.gz MZHLWSGOBWTGKA-UHFFFAOYSA-N 2 1 370.497 2.642 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C3CCC4(CCC[NH2+]C4)CC3)cc2)CC1 ZINC001246185163 1039268336 /nfs/dbraw/zinc/26/83/36/1039268336.db2.gz SZZNCTOFBHHISM-UHFFFAOYSA-N 2 1 356.558 2.840 20 10 FFCDMP COc1ccc(N2CCOC[C@@]3(CCC[N@H+]([C@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701976 1039441737 /nfs/dbraw/zinc/44/17/37/1039441737.db2.gz JQPWEGGSBQMSNI-KAGYGMCKSA-N 2 1 373.541 2.755 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490137 1039840948 /nfs/dbraw/zinc/84/09/48/1039840948.db2.gz APFKDYLWNFBJKT-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490137 1039840968 /nfs/dbraw/zinc/84/09/68/1039840968.db2.gz APFKDYLWNFBJKT-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490137 1039840988 /nfs/dbraw/zinc/84/09/88/1039840988.db2.gz APFKDYLWNFBJKT-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP Oc1ccc([C@H](O)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1O ZINC001255122683 1041157812 /nfs/dbraw/zinc/15/78/12/1041157812.db2.gz IUXLKTFVRDREAA-NXWNEQKCSA-N 2 1 368.477 2.916 20 10 FFCDMP CCOc1cccc(C[NH+]2CCC3(C[NH+](Cc4cn[nH]c4)C3)CC2)c1O ZINC001278577063 1041236954 /nfs/dbraw/zinc/23/69/54/1041236954.db2.gz MOZLMULXGVNIOC-UHFFFAOYSA-N 2 1 356.470 2.612 20 10 FFCDMP Cn1ccc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001262375291 1041664830 /nfs/dbraw/zinc/66/48/30/1041664830.db2.gz FIGDNCFILLXDGK-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1ccc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001262375291 1041664837 /nfs/dbraw/zinc/66/48/37/1041664837.db2.gz FIGDNCFILLXDGK-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP O=c1cccc(C[NH+]2CC3(C2)CC[NH+](Cc2cc(F)ccc2O)CC3)[nH]1 ZINC001279197403 1042941635 /nfs/dbraw/zinc/94/16/35/1042941635.db2.gz UXFSUOLNZJPKKA-UHFFFAOYSA-N 2 1 357.429 2.730 20 10 FFCDMP Cc1cccc(C[N@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c1O ZINC001279290440 1042985845 /nfs/dbraw/zinc/98/58/45/1042985845.db2.gz OPMHYLOZLAVPTD-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1cccc(C[NH+]2CCC[C@]3(CC[N@H+](CCn4ccnc4)C3)C2)c1O ZINC001279290440 1042985847 /nfs/dbraw/zinc/98/58/47/1042985847.db2.gz OPMHYLOZLAVPTD-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1cccc(C[NH+]2CCC[C@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c1O ZINC001279290440 1042985851 /nfs/dbraw/zinc/98/58/51/1042985851.db2.gz OPMHYLOZLAVPTD-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)c3ccccc3)cc2F)CC1 ZINC001318553423 1044745823 /nfs/dbraw/zinc/74/58/23/1044745823.db2.gz YCPUXSXFOKEXMW-NRFANRHFSA-N 2 1 357.473 2.575 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+](CCCO)CC(C)(C)C)cc2F)CC1 ZINC001319822972 1045278782 /nfs/dbraw/zinc/27/87/82/1045278782.db2.gz JGFRULFKAHGJQI-UHFFFAOYSA-N 2 1 351.510 2.808 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+](CCCO)CC(C)(C)C)cc2F)CC1 ZINC001319822972 1045278786 /nfs/dbraw/zinc/27/87/86/1045278786.db2.gz JGFRULFKAHGJQI-UHFFFAOYSA-N 2 1 351.510 2.808 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCCO)CC(C)(C)C)cc2F)CC1 ZINC001319822972 1045278792 /nfs/dbraw/zinc/27/87/92/1045278792.db2.gz JGFRULFKAHGJQI-UHFFFAOYSA-N 2 1 351.510 2.808 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@@H]3C[NH+]3CCCC3)cc2F)CC1 ZINC001319947361 1045309967 /nfs/dbraw/zinc/30/99/67/1045309967.db2.gz KPENFXVUESWVKD-LJQANCHMSA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@](C)(CO)c3ccccc3)cc2F)CC1 ZINC001324311358 1045965163 /nfs/dbraw/zinc/96/51/63/1045965163.db2.gz ALINEWUXAIADNK-NRFANRHFSA-N 2 1 357.473 2.575 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104159 1052259959 /nfs/dbraw/zinc/25/99/59/1052259959.db2.gz KCGOBNANNGNAKD-UYAOXDASSA-N 2 1 360.521 2.542 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](O)Cc1ccccc1 ZINC001461363659 1061299774 /nfs/dbraw/zinc/29/97/74/1061299774.db2.gz JSQRHKHKHVNPNO-VGSWGCGISA-N 2 1 371.500 2.659 20 10 FFCDMP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(F)cc1O ZINC000185322115 510804545 /nfs/dbraw/zinc/80/45/45/510804545.db2.gz WPFPCYONZBVAFN-AWEZNQCLSA-N 2 1 359.445 2.674 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]Cc3cc(Cl)c(F)cc3[O-])cn2)CC1 ZINC000294253263 729722045 /nfs/dbraw/zinc/72/20/45/729722045.db2.gz NKBVOQHEILPINR-UHFFFAOYSA-N 2 1 364.852 2.621 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1O ZINC000858245389 730420750 /nfs/dbraw/zinc/42/07/50/730420750.db2.gz RVZDVVLCJROWEA-GFCCVEGCSA-N 2 1 357.292 2.985 20 10 FFCDMP C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc(N2CCOCC2)cc1 ZINC000873200599 731889917 /nfs/dbraw/zinc/88/99/17/731889917.db2.gz HDXRHRVEQBHIFF-UHFFFAOYSA-N 2 1 357.523 2.862 20 10 FFCDMP Cn1c(Cl)nc(Cl)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283838 733359958 /nfs/dbraw/zinc/35/99/58/733359958.db2.gz VGQXLIHHZJESFQ-UHFFFAOYSA-N 2 1 368.312 2.769 20 10 FFCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c1O ZINC000808693097 741252460 /nfs/dbraw/zinc/25/24/60/741252460.db2.gz WAPVYKFEGHJBID-KGLIPLIRSA-N 2 1 353.894 2.592 20 10 FFCDMP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@](C)(C(F)F)O1 ZINC000827955260 745007398 /nfs/dbraw/zinc/00/73/98/745007398.db2.gz CMUWLJAUHCKPJG-BEFAXECRSA-N 2 1 353.457 2.683 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@](C)(C(F)F)O1 ZINC000827955260 745007403 /nfs/dbraw/zinc/00/74/03/745007403.db2.gz CMUWLJAUHCKPJG-BEFAXECRSA-N 2 1 353.457 2.683 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902497 748132306 /nfs/dbraw/zinc/13/23/06/748132306.db2.gz OABNKSZPCOYCAH-VBNZEHGJSA-N 2 1 354.878 2.773 20 10 FFCDMP C[C@@H](c1ccccc1)[N@@H+](CC(=O)N1CCN(C)CC1)Cc1ccccc1O ZINC000176680290 966597592 /nfs/dbraw/zinc/59/75/92/966597592.db2.gz QWXNIIDKNZQXCS-SFHVURJKSA-N 2 1 367.493 2.729 20 10 FFCDMP C[C@@H](c1ccccc1)N(CC(=O)N1CCN(C)CC1)Cc1ccccc1O ZINC000176680290 966597596 /nfs/dbraw/zinc/59/75/96/966597596.db2.gz QWXNIIDKNZQXCS-SFHVURJKSA-N 2 1 367.493 2.729 20 10 FFCDMP COCCOC[N@@H+]1CCC2(C1)CC[NH+](Cc1c(C)ccc(C)c1O)CC2 ZINC001279234899 967063926 /nfs/dbraw/zinc/06/39/26/967063926.db2.gz IEHJBXYFCYVPME-UHFFFAOYSA-N 2 1 362.514 2.917 20 10 FFCDMP COCCOC[N@H+]1CCC2(C1)CC[NH+](Cc1c(C)ccc(C)c1O)CC2 ZINC001279234899 967063938 /nfs/dbraw/zinc/06/39/38/967063938.db2.gz IEHJBXYFCYVPME-UHFFFAOYSA-N 2 1 362.514 2.917 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@H](C(F)(F)F)O1 ZINC000877824054 1014743309 /nfs/dbraw/zinc/74/33/09/1014743309.db2.gz ONVKVJNICKYFIE-MAUKXSAKSA-N 2 1 371.447 2.980 20 10 FFCDMP C[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728548 983998875 /nfs/dbraw/zinc/99/88/75/983998875.db2.gz MVRNXXBHSGEHLT-PKOBYXMFSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728548 983998878 /nfs/dbraw/zinc/99/88/78/983998878.db2.gz MVRNXXBHSGEHLT-PKOBYXMFSA-N 2 1 372.557 2.611 20 10 FFCDMP CN(CCC[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccco1 ZINC000809717885 994592587 /nfs/dbraw/zinc/59/25/87/994592587.db2.gz CAGMBTVCQBBLFW-UHFFFAOYSA-N 2 1 370.541 2.985 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCC4)[C@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811518197 995162073 /nfs/dbraw/zinc/16/20/73/995162073.db2.gz GSDMGGMAYZBFTC-NHCUHLMSSA-N 2 1 355.526 2.972 20 10 FFCDMP Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719174 1016149861 /nfs/dbraw/zinc/14/98/61/1016149861.db2.gz WJRCFTNDNHXMLX-MOPGFXCFSA-N 2 1 360.498 2.532 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)cc1 ZINC000734058569 999186583 /nfs/dbraw/zinc/18/65/83/999186583.db2.gz SCDKVYWWCQVOGY-UHFFFAOYSA-N 2 1 374.573 2.954 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)CC(=O)NC2CC[NH+](C(C)C)CC2)cc1 ZINC000734058569 999186584 /nfs/dbraw/zinc/18/65/84/999186584.db2.gz SCDKVYWWCQVOGY-UHFFFAOYSA-N 2 1 374.573 2.954 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)[C@H](C)C2)C1 ZINC000767951270 1000164492 /nfs/dbraw/zinc/16/44/92/1000164492.db2.gz XJOSZLJXUDBETN-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)[C@H](C)C2)C1 ZINC000767951270 1000164493 /nfs/dbraw/zinc/16/44/93/1000164493.db2.gz XJOSZLJXUDBETN-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@H+](C)[C@H](C)C2)C1 ZINC000767951270 1000164495 /nfs/dbraw/zinc/16/44/95/1000164495.db2.gz XJOSZLJXUDBETN-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@@H+](C)[C@H](C)C2)C1 ZINC000767951270 1000164496 /nfs/dbraw/zinc/16/44/96/1000164496.db2.gz XJOSZLJXUDBETN-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP C[C@@H]1C[N@H+](Cc2cccc(I)c2O)CCC[C@H]1C[NH3+] ZINC001206028297 1000501367 /nfs/dbraw/zinc/50/13/67/1000501367.db2.gz YBFHTXPVXJIAAD-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2cccc(I)c2O)CCC[C@H]1C[NH3+] ZINC001206028297 1000501373 /nfs/dbraw/zinc/50/13/73/1000501373.db2.gz YBFHTXPVXJIAAD-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP Cc1cccc(C[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c1O ZINC000775681274 1003635460 /nfs/dbraw/zinc/63/54/60/1003635460.db2.gz OJRRCDFAHHRQON-UHFFFAOYSA-N 2 1 353.510 2.950 20 10 FFCDMP C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677365 1005003643 /nfs/dbraw/zinc/00/36/43/1005003643.db2.gz ALYUPMOOZROXIG-HSALFYBXSA-N 2 1 358.574 2.894 20 10 FFCDMP C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677365 1005003644 /nfs/dbraw/zinc/00/36/44/1005003644.db2.gz ALYUPMOOZROXIG-HSALFYBXSA-N 2 1 358.574 2.894 20 10 FFCDMP C[C@@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+](C)Cc1ccccc1O ZINC000111235260 1006363463 /nfs/dbraw/zinc/36/34/63/1006363463.db2.gz WFDKFFHSEQJUSC-PXNSSMCTSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235260 1006363475 /nfs/dbraw/zinc/36/34/75/1006363475.db2.gz WFDKFFHSEQJUSC-PXNSSMCTSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235260 1006363488 /nfs/dbraw/zinc/36/34/88/1006363488.db2.gz WFDKFFHSEQJUSC-PXNSSMCTSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@H+]1C ZINC000773145611 1009667879 /nfs/dbraw/zinc/66/78/79/1009667879.db2.gz KELGADJYXUYIDH-NQIIRXRSSA-N 3 1 356.558 2.791 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCN1C ZINC000773145611 1009667890 /nfs/dbraw/zinc/66/78/90/1009667890.db2.gz KELGADJYXUYIDH-NQIIRXRSSA-N 2 1 356.558 2.791 20 10 FFCDMP CC[NH+]1CCC(NC(=O)C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000015571651 1010756693 /nfs/dbraw/zinc/75/66/93/1010756693.db2.gz OZFHJXLAQXAFPK-UHFFFAOYSA-N 2 1 372.557 2.709 20 10 FFCDMP CC[NH+]1CCC(NC(=O)C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000015571651 1010756701 /nfs/dbraw/zinc/75/67/01/1010756701.db2.gz OZFHJXLAQXAFPK-UHFFFAOYSA-N 2 1 372.557 2.709 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC(C4CC4)(C4CC4)C3)cc2)CC1 ZINC000827537665 1018447550 /nfs/dbraw/zinc/44/75/50/1018447550.db2.gz GROBCXFZHYUAAE-UHFFFAOYSA-N 2 1 355.526 2.829 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)cc2)CC1 ZINC001222314084 1032887008 /nfs/dbraw/zinc/88/70/08/1032887008.db2.gz BXHGMCQMWCXYDA-JOCHJYFZSA-N 3 1 356.558 2.937 20 10 FFCDMP C[C@@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116409871 1021203461 /nfs/dbraw/zinc/20/34/61/1021203461.db2.gz ICLOUYYIKIYAKQ-KXBFYZLASA-N 2 1 361.461 2.772 20 10 FFCDMP COC(=O)c1sccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001120064929 1023225938 /nfs/dbraw/zinc/22/59/38/1023225938.db2.gz ZLZVKOXKCAVWMW-UHFFFAOYSA-N 2 1 359.495 2.576 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3nc(N4CCCCC4)cc[nH+]3)cc2)CC1 ZINC001156658205 1029294408 /nfs/dbraw/zinc/29/44/08/1029294408.db2.gz VCKFAXIUWQUVOQ-UHFFFAOYSA-N 2 1 366.513 2.831 20 10 FFCDMP COc1ccc([C@H](C[NH3+])C[NH+]2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000842476296 1030749064 /nfs/dbraw/zinc/74/90/64/1030749064.db2.gz LFXMXZNTDTWKCJ-GOSISDBHSA-N 2 1 355.482 2.568 20 10 FFCDMP COc1cccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001203592205 1030774206 /nfs/dbraw/zinc/77/42/06/1030774206.db2.gz QYDQORLRIAGJRH-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1cccc(C[N@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001203592205 1030774220 /nfs/dbraw/zinc/77/42/20/1030774220.db2.gz QYDQORLRIAGJRH-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1cccc(C[NH+]2C[C@H]3CC[N@H+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001203592205 1030774233 /nfs/dbraw/zinc/77/42/33/1030774233.db2.gz QYDQORLRIAGJRH-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1cccc(C[NH+]2C[C@H]3CC[N@@H+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001203592205 1030774247 /nfs/dbraw/zinc/77/42/47/1030774247.db2.gz QYDQORLRIAGJRH-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COC(=O)CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001139409953 1035094394 /nfs/dbraw/zinc/09/43/94/1035094394.db2.gz WYKSJDIDVRJATE-UHFFFAOYSA-N 2 1 359.514 2.746 20 10 FFCDMP CCOC(=O)[C@@H]1CCCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140305832 1035427654 /nfs/dbraw/zinc/42/76/54/1035427654.db2.gz IAEXHPGHFAUBCV-HXUWFJFHSA-N 2 1 373.541 2.994 20 10 FFCDMP COc1ccc2ccc(O)c(C[N@H+]3CCOC[C@]4(CCC[NH2+]C4)C3)c2c1 ZINC001235021754 1037310169 /nfs/dbraw/zinc/31/01/69/1037310169.db2.gz JJKGDKSOBKOULP-NRFANRHFSA-N 2 1 356.466 2.756 20 10 FFCDMP Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235423695 1037541555 /nfs/dbraw/zinc/54/15/55/1037541555.db2.gz GJFKMRLIVCSYRZ-QZTJIDSGSA-N 2 1 361.505 2.874 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001235676700 1037676516 /nfs/dbraw/zinc/67/65/16/1037676516.db2.gz DFMYWBJLJTWXRO-NRFANRHFSA-N 3 1 356.558 2.937 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1CN1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001235676700 1037676519 /nfs/dbraw/zinc/67/65/19/1037676519.db2.gz DFMYWBJLJTWXRO-NRFANRHFSA-N 2 1 356.558 2.937 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001235676704 1037677963 /nfs/dbraw/zinc/67/79/63/1037677963.db2.gz DFMYWBJLJTWXRO-OAQYLSRUSA-N 3 1 356.558 2.937 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1CN1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001235676704 1037677978 /nfs/dbraw/zinc/67/79/78/1037677978.db2.gz DFMYWBJLJTWXRO-OAQYLSRUSA-N 2 1 356.558 2.937 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC[NH+](C)C)c(O)c1 ZINC001277976881 1037861638 /nfs/dbraw/zinc/86/16/38/1037861638.db2.gz ZIFYJRYEXVHXRU-RTBURBONSA-N 2 1 359.514 2.643 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCSc2ccccc2C1 ZINC001236240583 1037999839 /nfs/dbraw/zinc/99/98/39/1037999839.db2.gz NGFQXXVGKUGPTE-UHFFFAOYSA-N 2 1 355.507 2.910 20 10 FFCDMP CCOc1ccc(N2CC[NH+](C[C@@H]3[C@@H](C)C[NH2+]CC3(F)F)CC2)cc1 ZINC001236433835 1038086767 /nfs/dbraw/zinc/08/67/67/1038086767.db2.gz MIEVKOVIJAWAIU-MAUKXSAKSA-N 2 1 353.457 2.698 20 10 FFCDMP CCOC(=O)N1CCC([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001256235203 1038444379 /nfs/dbraw/zinc/44/43/79/1038444379.db2.gz IGJHNNGZCJYDTJ-UHFFFAOYSA-N 2 1 361.486 2.567 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001279313695 1042996396 /nfs/dbraw/zinc/99/63/96/1042996396.db2.gz PMJADAWZUXWTRW-NRFANRHFSA-N 2 1 361.530 2.646 20 10 FFCDMP CCOc1ccc(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279672003 1043441595 /nfs/dbraw/zinc/44/15/95/1043441595.db2.gz KGBBRRZAKPHSSW-OAQYLSRUSA-N 2 1 361.530 2.640 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC001319717849 1045250905 /nfs/dbraw/zinc/25/09/05/1045250905.db2.gz LTHHCIHSRLCCRA-UGKGYDQZSA-N 2 1 356.558 2.745 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCOC4)CC3)cc2F)CC1 ZINC001320967417 1045503630 /nfs/dbraw/zinc/50/36/30/1045503630.db2.gz GPCPMQUSCGMXSL-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnn4ccccc34)cc2F)CC1 ZINC001323560986 1045640120 /nfs/dbraw/zinc/64/01/20/1045640120.db2.gz PRTKFMXOFJHACK-UHFFFAOYSA-N 2 1 353.445 2.515 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@](C)(CO)C3CCCCC3)cc2F)CC1 ZINC001324924418 1046291363 /nfs/dbraw/zinc/29/13/63/1046291363.db2.gz PHKJSMQRFTVMLW-OAQYLSRUSA-N 2 1 363.521 2.998 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCCOC3)cc2F)CC1 ZINC001327121412 1047196353 /nfs/dbraw/zinc/19/63/53/1047196353.db2.gz QMFHTJYYUTVJET-AZUAARDMSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCOC3)cc2F)CC1 ZINC001327121412 1047196358 /nfs/dbraw/zinc/19/63/58/1047196358.db2.gz QMFHTJYYUTVJET-AZUAARDMSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349778 1056835631 /nfs/dbraw/zinc/83/56/31/1056835631.db2.gz HBPZKGIWRRGIII-OAQYLSRUSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349778 1056835640 /nfs/dbraw/zinc/83/56/40/1056835640.db2.gz HBPZKGIWRRGIII-OAQYLSRUSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349778 1056835644 /nfs/dbraw/zinc/83/56/44/1056835644.db2.gz HBPZKGIWRRGIII-OAQYLSRUSA-N 2 1 356.558 2.650 20 10 FFCDMP O[C@H](CNCc1ccc(N2CCCC2)cc1)C[N@@H+]1CCc2ccccc2C1 ZINC000775974010 1062141218 /nfs/dbraw/zinc/14/12/18/1062141218.db2.gz SVCCWAAGLGKBQK-HSZRJFAPSA-N 2 1 365.521 2.796 20 10 FFCDMP O[C@H](CNCc1ccc(N2CCCC2)cc1)C[N@H+]1CCc2ccccc2C1 ZINC000775974010 1062141233 /nfs/dbraw/zinc/14/12/33/1062141233.db2.gz SVCCWAAGLGKBQK-HSZRJFAPSA-N 2 1 365.521 2.796 20 10 FFCDMP CC[C@@](C)(C[NH3+])C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001576948327 1078288501 /nfs/dbraw/zinc/28/85/01/1078288501.db2.gz IXVHPRVBRMPKRH-QAPCUYQASA-N 2 1 353.894 2.501 20 10 FFCDMP COC(=O)c1c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c2cc(F)ccc2n1C ZINC001578850318 1078533999 /nfs/dbraw/zinc/53/39/99/1078533999.db2.gz DNYXCWDNNLPLLS-MJEQTWJJSA-N 2 1 359.445 2.663 20 10 FFCDMP COC(=O)c1c(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c2cc(F)ccc2n1C ZINC001578850318 1078534007 /nfs/dbraw/zinc/53/40/07/1078534007.db2.gz DNYXCWDNNLPLLS-MJEQTWJJSA-N 2 1 359.445 2.663 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c(O)c1 ZINC001560751240 1076295994 /nfs/dbraw/zinc/29/59/94/1076295994.db2.gz QIZBKAMYTXKAFP-GOSISDBHSA-N 2 1 356.466 2.566 20 10 FFCDMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000278899766 511013172 /nfs/dbraw/zinc/01/31/72/511013172.db2.gz FOSIPLKSOCAYSR-JKSUJKDBSA-N 2 1 358.461 2.772 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCCCC[NH+](C)C)C1 ZINC000444239189 514163246 /nfs/dbraw/zinc/16/32/46/514163246.db2.gz LTAGCHNTPBFTFZ-UHFFFAOYSA-N 2 1 370.541 2.866 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH2+]C(C)(C)C2)C1 ZINC000444286269 514181421 /nfs/dbraw/zinc/18/14/21/514181421.db2.gz ZPRIUZYPSHNQCK-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@]2(CC[NH2+]C2)CO1 ZINC000903732239 736161421 /nfs/dbraw/zinc/16/14/21/736161421.db2.gz DLZILQSMORGGCX-WBVHZDCISA-N 2 1 369.303 2.745 20 10 FFCDMP Fc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146281 746788083 /nfs/dbraw/zinc/78/80/83/746788083.db2.gz BFAXQTOIVUOZCF-HZPDHXFCSA-N 2 1 351.441 2.518 20 10 FFCDMP Fc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146281 746788089 /nfs/dbraw/zinc/78/80/89/746788089.db2.gz BFAXQTOIVUOZCF-HZPDHXFCSA-N 2 1 351.441 2.518 20 10 FFCDMP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000841099533 747268965 /nfs/dbraw/zinc/26/89/65/747268965.db2.gz LGIWARDQFRQSGB-WBVHZDCISA-N 2 1 369.303 2.873 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)CN(C)CCC[NH+](C)C)c1 ZINC000850353551 749350708 /nfs/dbraw/zinc/35/07/08/749350708.db2.gz GTLJWRWZQQMTJX-AWEZNQCLSA-N 2 1 372.351 2.825 20 10 FFCDMP CN(C)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1cc(F)c(F)cc1O)CC2 ZINC001279106798 960383094 /nfs/dbraw/zinc/38/30/94/960383094.db2.gz FJLIVNPCGJCJKN-UHFFFAOYSA-N 2 1 353.457 2.520 20 10 FFCDMP CN(C)CC[N@H+]1CCC2(C1)CC[NH+](Cc1cc(F)c(F)cc1O)CC2 ZINC001279106798 960383101 /nfs/dbraw/zinc/38/31/01/960383101.db2.gz FJLIVNPCGJCJKN-UHFFFAOYSA-N 2 1 353.457 2.520 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000840759666 972960177 /nfs/dbraw/zinc/96/01/77/972960177.db2.gz ZTVNWQMKRAVLJQ-MNEFBYGVSA-N 2 1 365.468 2.764 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000840759668 972960654 /nfs/dbraw/zinc/96/06/54/972960654.db2.gz ZTVNWQMKRAVLJQ-ZYSHUDEJSA-N 2 1 365.468 2.764 20 10 FFCDMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c(O)c1 ZINC000877028373 1014454978 /nfs/dbraw/zinc/45/49/78/1014454978.db2.gz VYBQPSARJOWPFI-FQEVSTJZSA-N 2 1 367.493 2.688 20 10 FFCDMP CN(C)CC[N@H+]1CCCC2(CC[NH+](Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001279149871 980691911 /nfs/dbraw/zinc/69/19/11/980691911.db2.gz NFACKMLAYNXMOU-UHFFFAOYSA-N 2 1 358.574 2.992 20 10 FFCDMP CN(C)c1ccc(C[NH+]2CCC3(CCCN(CC[NH+](C)C)C3)CC2)cc1 ZINC001279149871 980691912 /nfs/dbraw/zinc/69/19/12/980691912.db2.gz NFACKMLAYNXMOU-UHFFFAOYSA-N 2 1 358.574 2.992 20 10 FFCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)cc1 ZINC000765882360 986806728 /nfs/dbraw/zinc/80/67/28/986806728.db2.gz BRIWAQWZHOESSR-QGZVFWFLSA-N 2 1 360.546 2.736 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1 ZINC000922391237 988549229 /nfs/dbraw/zinc/54/92/29/988549229.db2.gz AEVNPGIDRYPAOH-AYWYSENESA-N 2 1 362.514 2.750 20 10 FFCDMP Oc1cc2c(cc1C[NH+]1CCC(c3[nH+]cc4n3CCCC4)CC1)[C@@H](O)CO2 ZINC000788381044 1001797032 /nfs/dbraw/zinc/79/70/32/1001797032.db2.gz BCDBUYPGMUCDAW-IBGZPJMESA-N 2 1 369.465 2.730 20 10 FFCDMP C[C@H]1CC[N@H+](Cc2cccc(I)c2O)CC[C@H]1C[NH3+] ZINC001205651463 1004637475 /nfs/dbraw/zinc/63/74/75/1004637475.db2.gz FLNPOUKSSJBKHF-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2cccc(I)c2O)CC[C@H]1C[NH3+] ZINC001205651463 1004637476 /nfs/dbraw/zinc/63/74/76/1004637476.db2.gz FLNPOUKSSJBKHF-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc2c1CC[NH2+]C2 ZINC000852746182 1006167060 /nfs/dbraw/zinc/16/70/60/1006167060.db2.gz JIDNEQRLOAKBGN-UHFFFAOYSA-N 2 1 351.494 2.801 20 10 FFCDMP NC(=O)[C@@H]1CCCN(c2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000817888152 1007784920 /nfs/dbraw/zinc/78/49/20/1007784920.db2.gz BZYRKDACVCGZJM-CZAAIQMYSA-N 2 1 364.493 2.623 20 10 FFCDMP NC(=O)[C@@H]1CCCN(c2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000817888153 1007785099 /nfs/dbraw/zinc/78/50/99/1007785099.db2.gz BZYRKDACVCGZJM-HBGVWJBISA-N 2 1 364.493 2.623 20 10 FFCDMP NC(=O)[C@@H]1CCCN(c2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000817888155 1007785699 /nfs/dbraw/zinc/78/56/99/1007785699.db2.gz BZYRKDACVCGZJM-TYCQWZJGSA-N 2 1 364.493 2.623 20 10 FFCDMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001206372325 1032257324 /nfs/dbraw/zinc/25/73/24/1032257324.db2.gz ZVYRJKCEWVAMFP-HNNXBMFYSA-N 2 1 350.356 2.986 20 10 FFCDMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001206372325 1032257336 /nfs/dbraw/zinc/25/73/36/1032257336.db2.gz ZVYRJKCEWVAMFP-HNNXBMFYSA-N 2 1 350.356 2.986 20 10 FFCDMP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1c(O)cccc1F ZINC000886536686 1008723304 /nfs/dbraw/zinc/72/33/04/1008723304.db2.gz NAXDVBPZZHNSGD-CQSZACIVSA-N 2 1 365.493 2.809 20 10 FFCDMP CN(C)c1ccc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)c(C(F)(F)F)c1 ZINC000794715821 1010564321 /nfs/dbraw/zinc/56/43/21/1010564321.db2.gz YMCOKCZTHCJISW-UHFFFAOYSA-N 2 1 372.479 2.889 20 10 FFCDMP Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116449602 1021223301 /nfs/dbraw/zinc/22/33/01/1021223301.db2.gz RKFYZAHRQAPPMJ-HXUWFJFHSA-N 2 1 371.504 2.957 20 10 FFCDMP Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116449602 1021223312 /nfs/dbraw/zinc/22/33/12/1021223312.db2.gz RKFYZAHRQAPPMJ-HXUWFJFHSA-N 2 1 371.504 2.957 20 10 FFCDMP C[NH+](C)CCN(Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117643819 1021793445 /nfs/dbraw/zinc/79/34/45/1021793445.db2.gz UYYMVKBFSVQTNO-UHFFFAOYSA-N 2 1 374.504 2.734 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2F)CC1 ZINC001118628166 1022324615 /nfs/dbraw/zinc/32/46/15/1022324615.db2.gz JBZKDIIRYBCBFY-UHFFFAOYSA-N 3 1 374.548 2.789 20 10 FFCDMP COc1cccc(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001203592325 1030775329 /nfs/dbraw/zinc/77/53/29/1030775329.db2.gz SMFRWTDFXINPEC-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1cccc(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c1O ZINC001203592325 1030775347 /nfs/dbraw/zinc/77/53/47/1030775347.db2.gz SMFRWTDFXINPEC-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1cccc(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c1O ZINC001203592325 1030775360 /nfs/dbraw/zinc/77/53/60/1030775360.db2.gz SMFRWTDFXINPEC-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1cc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(O)cc1Br ZINC001205653039 1031907229 /nfs/dbraw/zinc/90/72/29/1031907229.db2.gz SFAHNZSWDHFGFM-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(C[N@@H+](C)C[C@H]2Cc3ccccc3O2)cc(C[NH+](C)C)c1O ZINC001139259459 1035032161 /nfs/dbraw/zinc/03/21/61/1035032161.db2.gz BUODTFOVSAVUDC-GOSISDBHSA-N 2 1 356.466 2.898 20 10 FFCDMP CCOC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139407749 1035092784 /nfs/dbraw/zinc/09/27/84/1035092784.db2.gz CLIWVYYCPDKITR-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP Oc1ccc(F)cc1C[N@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001140055524 1035325178 /nfs/dbraw/zinc/32/51/78/1035325178.db2.gz JJXMQAPWLFAVHC-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CC[C@@H]2C[N@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001140055524 1035325185 /nfs/dbraw/zinc/32/51/85/1035325185.db2.gz JJXMQAPWLFAVHC-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001140055524 1035325189 /nfs/dbraw/zinc/32/51/89/1035325189.db2.gz JJXMQAPWLFAVHC-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP CCCNC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304702 1035426276 /nfs/dbraw/zinc/42/62/76/1035426276.db2.gz YSJMIHPGFXQIKO-OAQYLSRUSA-N 2 1 372.557 2.709 20 10 FFCDMP CN(C)c1ccc(/C=C\CN2CCN(C[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028823 1035489763 /nfs/dbraw/zinc/48/97/63/1035489763.db2.gz SRTFUQUTRSVFCS-ICTHTSFCSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH+]2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028823 1035489765 /nfs/dbraw/zinc/48/97/65/1035489765.db2.gz SRTFUQUTRSVFCS-ICTHTSFCSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH+]2CCN(C[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028823 1035489767 /nfs/dbraw/zinc/48/97/67/1035489767.db2.gz SRTFUQUTRSVFCS-ICTHTSFCSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C\C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052743 1035494102 /nfs/dbraw/zinc/49/41/02/1035494102.db2.gz HIESVNJOSZHDHE-LXHZQTKUSA-N 2 1 356.558 2.866 20 10 FFCDMP COc1cc(O)c(C[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)c(OC)c1 ZINC001141034464 1036793940 /nfs/dbraw/zinc/79/39/40/1036793940.db2.gz DXXOXSYONLVICB-UHFFFAOYSA-N 2 1 357.454 2.852 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(N(CC)CC)cc3)C[C@@H]1CC[NH2+]CC2 ZINC001235350833 1037497199 /nfs/dbraw/zinc/49/71/99/1037497199.db2.gz UWCROQKUAVCXQT-UGKGYDQZSA-N 2 1 373.541 2.898 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@@H+]1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001236011003 1037886772 /nfs/dbraw/zinc/88/67/72/1037886772.db2.gz XROWHCYHPWJBOF-KNQAVFIVSA-N 2 1 351.494 2.734 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@H+]1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001236011003 1037886793 /nfs/dbraw/zinc/88/67/93/1037886793.db2.gz XROWHCYHPWJBOF-KNQAVFIVSA-N 2 1 351.494 2.734 20 10 FFCDMP CO[C@H](CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(F)(F)F ZINC001255582428 1038028911 /nfs/dbraw/zinc/02/89/11/1038028911.db2.gz XLEKNKCIVRCGPP-MRXNPFEDSA-N 2 1 363.399 2.635 20 10 FFCDMP COc1cc(C)c(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c(O)c1 ZINC001236807054 1038281274 /nfs/dbraw/zinc/28/12/74/1038281274.db2.gz BTBXXBRZSOGCMQ-UHFFFAOYSA-N 2 1 370.497 2.560 20 10 FFCDMP CCOC(=O)C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001237114165 1038447454 /nfs/dbraw/zinc/44/74/54/1038447454.db2.gz CKAKZFZITGDDBQ-IEBWSBKVSA-N 2 1 359.514 2.507 20 10 FFCDMP Oc1ccc(O)c(C[NH+]2CCC3(CCC[N@@H+](Cc4cn[nH]c4)C3)CC2)c1 ZINC001278751072 1040472754 /nfs/dbraw/zinc/47/27/54/1040472754.db2.gz SZMKXPSYPHTNEY-UHFFFAOYSA-N 2 1 356.470 2.699 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CCC2(CC[N@@H+](CCn3ccnc3)C2)CC1 ZINC001279197323 1042941540 /nfs/dbraw/zinc/94/15/40/1042941540.db2.gz QRCJKXKAXVEEPW-UHFFFAOYSA-N 2 1 358.461 2.716 20 10 FFCDMP Oc1ccc(C[NH+]2CCC3(CCC[N@@H+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001279225770 1042952951 /nfs/dbraw/zinc/95/29/51/1042952951.db2.gz RWCAFLSLIBHTRR-UHFFFAOYSA-N 2 1 356.470 2.699 20 10 FFCDMP Oc1ccc(F)c(F)c1C[N@H+]1C[C@@H]2CC[NH+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279491030 1043178416 /nfs/dbraw/zinc/17/84/16/1043178416.db2.gz UBRCMKLVSXZOKZ-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1ccc(F)c(F)c1C[N@@H+]1C[C@@H]2CC[NH+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279491030 1043178422 /nfs/dbraw/zinc/17/84/22/1043178422.db2.gz UBRCMKLVSXZOKZ-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1ccc(F)c(F)c1C[NH+]1C[C@@H]2CC[N@@H+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279491030 1043178425 /nfs/dbraw/zinc/17/84/25/1043178425.db2.gz UBRCMKLVSXZOKZ-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1ccc(F)c(F)c1C[NH+]1C[C@@H]2CC[N@H+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279491030 1043178430 /nfs/dbraw/zinc/17/84/30/1043178430.db2.gz UBRCMKLVSXZOKZ-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP COC(=O)CC1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCCC1 ZINC001322418284 1046077034 /nfs/dbraw/zinc/07/70/34/1046077034.db2.gz UGNOVSTZXSVXGG-UHFFFAOYSA-N 2 1 363.477 2.543 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202859 1046808482 /nfs/dbraw/zinc/80/84/82/1046808482.db2.gz WFSYWIFDXYJWBG-WOJBJXKFSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202859 1046808501 /nfs/dbraw/zinc/80/85/01/1046808501.db2.gz WFSYWIFDXYJWBG-WOJBJXKFSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202859 1046808520 /nfs/dbraw/zinc/80/85/20/1046808520.db2.gz WFSYWIFDXYJWBG-WOJBJXKFSA-N 3 1 374.548 2.789 20 10 FFCDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001200244512 1056140886 /nfs/dbraw/zinc/14/08/86/1056140886.db2.gz VAQVQCARGLENRS-IBGZPJMESA-N 2 1 362.537 2.788 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CC3)[C@H]3CCCOC3)cc2F)CC1 ZINC001355302705 1060093524 /nfs/dbraw/zinc/09/35/24/1060093524.db2.gz SRXUZCLSOJZXHH-RXVVDRJESA-N 2 1 361.505 2.872 20 10 FFCDMP Cc1c2ccccc2n(C)c1C[NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001560311683 1076262318 /nfs/dbraw/zinc/26/23/18/1076262318.db2.gz FVRSHTQOYVJPJT-UHFFFAOYSA-N 2 1 356.514 2.519 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000273437701 511526732 /nfs/dbraw/zinc/52/67/32/511526732.db2.gz XPYYCMVDTUQBDE-OAHLLOKOSA-N 2 1 372.465 2.970 20 10 FFCDMP C[NH+](C)CCOC1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000769384756 737522981 /nfs/dbraw/zinc/52/29/81/737522981.db2.gz VXQRSWQHRIUMKP-UHFFFAOYSA-N 2 1 357.292 2.697 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901917 748131920 /nfs/dbraw/zinc/13/19/20/748131920.db2.gz IWIDOMYMRZTBGS-VMGRFDJRSA-N 2 1 369.303 2.873 20 10 FFCDMP C[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728568 983998411 /nfs/dbraw/zinc/99/84/11/983998411.db2.gz MVRNXXBHSGEHLT-IEBWSBKVSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728568 983998414 /nfs/dbraw/zinc/99/84/14/983998414.db2.gz MVRNXXBHSGEHLT-IEBWSBKVSA-N 2 1 372.557 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C(=O)OC(C)(C)C)cc2)CC1 ZINC000775681323 1003634815 /nfs/dbraw/zinc/63/48/15/1003634815.db2.gz OYOFSZCTHZVZST-IBGZPJMESA-N 2 1 359.514 2.745 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3C(=O)OC(C)(C)C)cc2)CC1 ZINC000775681323 1003634819 /nfs/dbraw/zinc/63/48/19/1003634819.db2.gz OYOFSZCTHZVZST-IBGZPJMESA-N 2 1 359.514 2.745 20 10 FFCDMP Cc1ccc(NC(=O)C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775639079 1004897794 /nfs/dbraw/zinc/89/77/94/1004897794.db2.gz NRKOANVXFOZNQY-UHFFFAOYSA-N 2 1 366.509 2.817 20 10 FFCDMP Cc1ccc(NC(=O)C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775639079 1004897797 /nfs/dbraw/zinc/89/77/97/1004897797.db2.gz NRKOANVXFOZNQY-UHFFFAOYSA-N 2 1 366.509 2.817 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850357367 1005810925 /nfs/dbraw/zinc/81/09/25/1005810925.db2.gz HDEGZZWSKRHNIU-LJQANCHMSA-N 2 1 356.466 2.647 20 10 FFCDMP CCN(C)c1ccc(C[NH+]2CCC(CC(=O)N3CC[NH+](C)CC3)CC2)cc1 ZINC000773774889 1009143828 /nfs/dbraw/zinc/14/38/28/1009143828.db2.gz VPNPZTBNNNJGEO-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP C[C@@H]1C[C@@H]2CC[C@H](C(=O)NC[C@@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@H+]2C1 ZINC001180179475 1009573172 /nfs/dbraw/zinc/57/31/72/1009573172.db2.gz PDBWXWQGUNSRQV-LGYWMIHWSA-N 2 1 372.557 2.592 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c2ncnn21 ZINC000925677199 1017813924 /nfs/dbraw/zinc/81/39/24/1017813924.db2.gz ORXZDSWFDHHEAO-OXJNMPFZSA-N 2 1 366.513 2.606 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272428 1032861151 /nfs/dbraw/zinc/86/11/51/1032861151.db2.gz UFNCIZXAKIKHST-JOCHJYFZSA-N 3 1 356.558 2.794 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272428 1032861161 /nfs/dbraw/zinc/86/11/61/1032861161.db2.gz UFNCIZXAKIKHST-JOCHJYFZSA-N 2 1 356.558 2.794 20 10 FFCDMP C[C@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000931764226 1020578305 /nfs/dbraw/zinc/57/83/05/1020578305.db2.gz OAJVCYUKXOCOTJ-SFHVURJKSA-N 2 1 352.482 2.629 20 10 FFCDMP Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)c1 ZINC001117642201 1021791454 /nfs/dbraw/zinc/79/14/54/1021791454.db2.gz VEGWVMXOLSNKNO-GOSISDBHSA-N 2 1 357.477 2.529 20 10 FFCDMP Cc1cnn([C@@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)c1 ZINC001117642201 1021791459 /nfs/dbraw/zinc/79/14/59/1021791459.db2.gz VEGWVMXOLSNKNO-GOSISDBHSA-N 2 1 357.477 2.529 20 10 FFCDMP CCOc1cccc(C[N@@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000190315056 1023614476 /nfs/dbraw/zinc/61/44/76/1023614476.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(CN(C)C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614482 /nfs/dbraw/zinc/61/44/82/1023614482.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(CN(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614488 /nfs/dbraw/zinc/61/44/88/1023614488.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[N@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614492 /nfs/dbraw/zinc/61/44/92/1023614492.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[N@@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614498 /nfs/dbraw/zinc/61/44/98/1023614498.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[NH+](C)C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614501 /nfs/dbraw/zinc/61/45/01/1023614501.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[NH+](C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000190315056 1023614506 /nfs/dbraw/zinc/61/45/06/1023614506.db2.gz NGCSQPYBFINSFR-JOCHJYFZSA-N 2 1 370.493 2.860 20 10 FFCDMP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000756640484 1023739312 /nfs/dbraw/zinc/73/93/12/1023739312.db2.gz BKXPTCLTYHONIX-CQSZACIVSA-N 2 1 365.493 2.809 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045361 1030001299 /nfs/dbraw/zinc/00/12/99/1030001299.db2.gz KGLCABMQESXADY-WTNAPCKOSA-N 2 1 352.526 2.863 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cc1Br ZINC001205638275 1031897377 /nfs/dbraw/zinc/89/73/77/1031897377.db2.gz LVAZEYYOJNZBHH-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205654155 1031908593 /nfs/dbraw/zinc/90/85/93/1031908593.db2.gz WOHLPRFDPMFMDS-HZPDHXFCSA-N 2 1 351.922 2.983 20 10 FFCDMP COc1cc(C[N@H+]2CCCN(c3cccnc3)CC2)cc(C[NH+](C)C)c1O ZINC001139260380 1035031658 /nfs/dbraw/zinc/03/16/58/1035031658.db2.gz LIYLSCOBYSFZGQ-UHFFFAOYSA-N 2 1 370.497 2.570 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745159 1036036818 /nfs/dbraw/zinc/03/68/18/1036036818.db2.gz YKKVWESVDDAGPJ-NQIIRXRSSA-N 2 1 360.498 2.587 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745159 1036036836 /nfs/dbraw/zinc/03/68/36/1036036836.db2.gz YKKVWESVDDAGPJ-NQIIRXRSSA-N 2 1 360.498 2.587 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745159 1036036855 /nfs/dbraw/zinc/03/68/55/1036036855.db2.gz YKKVWESVDDAGPJ-NQIIRXRSSA-N 2 1 360.498 2.587 20 10 FFCDMP CCOC(=O)c1c(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c2ccccc2n1C ZINC001233273157 1036479564 /nfs/dbraw/zinc/47/95/64/1036479564.db2.gz QAWXMAXSOMRGRD-OAQYLSRUSA-N 2 1 355.482 2.883 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3c(C)n(C)c4ccccc43)C[C@@H]1CC[NH2+]CC2 ZINC001235350752 1037496903 /nfs/dbraw/zinc/49/69/03/1037496903.db2.gz XPPDSMCEEKDTOR-JTSKRJEESA-N 2 1 369.509 2.851 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3c(O)ccc4ccccc43)C[C@H]1C[NH2+]CC2 ZINC001236039923 1037903673 /nfs/dbraw/zinc/90/36/73/1037903673.db2.gz BAKCRTIFOHQZKT-IIBYNOLFSA-N 2 1 354.450 2.520 20 10 FFCDMP C[NH2+]C1CCC([N@H+](C)Cc2ccc(I)cc2O)CC1 ZINC001236216268 1037988880 /nfs/dbraw/zinc/98/88/80/1037988880.db2.gz WLBBUIBSKDYFAD-UHFFFAOYSA-N 2 1 374.266 2.959 20 10 FFCDMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(I)cc2O)CC1 ZINC001236216268 1037988896 /nfs/dbraw/zinc/98/88/96/1037988896.db2.gz WLBBUIBSKDYFAD-UHFFFAOYSA-N 2 1 374.266 2.959 20 10 FFCDMP Cc1nnc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)o1 ZINC001236943476 1038370647 /nfs/dbraw/zinc/37/06/47/1038370647.db2.gz RWAQKBKHIZHAEJ-KRWDZBQOSA-N 2 1 373.476 2.649 20 10 FFCDMP CC(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C)C2)c(O)c1 ZINC001237047539 1038421262 /nfs/dbraw/zinc/42/12/62/1038421262.db2.gz AXPSVHNRKBWWHP-AABGKKOBSA-N 2 1 369.513 2.702 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C)C2)c(O)c1 ZINC001237047539 1038421265 /nfs/dbraw/zinc/42/12/65/1038421265.db2.gz AXPSVHNRKBWWHP-AABGKKOBSA-N 2 1 369.513 2.702 20 10 FFCDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3C)C2)c(O)c1 ZINC001237047539 1038421269 /nfs/dbraw/zinc/42/12/69/1038421269.db2.gz AXPSVHNRKBWWHP-AABGKKOBSA-N 2 1 369.513 2.702 20 10 FFCDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3C)C2)c(O)c1 ZINC001237047539 1038421275 /nfs/dbraw/zinc/42/12/75/1038421275.db2.gz AXPSVHNRKBWWHP-AABGKKOBSA-N 2 1 369.513 2.702 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001256528274 1038544431 /nfs/dbraw/zinc/54/44/31/1038544431.db2.gz YOBKHFXZKXQDSY-MAUKXSAKSA-N 2 1 356.466 2.989 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@H+]1Cc1ccccc1 ZINC001256528274 1038544437 /nfs/dbraw/zinc/54/44/37/1038544437.db2.gz YOBKHFXZKXQDSY-MAUKXSAKSA-N 2 1 356.466 2.989 20 10 FFCDMP Cc1ccc(O)c(C[N@@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c1 ZINC001278617164 1038844109 /nfs/dbraw/zinc/84/41/09/1038844109.db2.gz UBHOTKQBSDGFNQ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2C[C@@H]3CC[N@@H+](CCn4ccnc4)CC[C@@H]3C2)c1 ZINC001278617164 1038844119 /nfs/dbraw/zinc/84/41/19/1038844119.db2.gz UBHOTKQBSDGFNQ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2C[C@@H]3CC[N@H+](CCn4ccnc4)CC[C@@H]3C2)c1 ZINC001278617164 1038844142 /nfs/dbraw/zinc/84/41/42/1038844142.db2.gz UBHOTKQBSDGFNQ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)cc2F)CC1 ZINC001318419096 1045296186 /nfs/dbraw/zinc/29/61/86/1045296186.db2.gz FBIUNVKYZTXFGE-UHFFFAOYSA-N 2 1 372.444 2.818 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCCN3C3CC3)cc2F)CC1 ZINC001320798265 1045470925 /nfs/dbraw/zinc/47/09/25/1045470925.db2.gz AYBVVYFFHIZFCN-LJQANCHMSA-N 2 1 360.521 2.684 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH2+]Cc4ccccc43)cc2F)CC1 ZINC001326076916 1046755982 /nfs/dbraw/zinc/75/59/82/1046755982.db2.gz SARRZJHKELICOM-UHFFFAOYSA-N 2 1 354.473 2.687 20 10 FFCDMP CN1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCc4cccc(O)c43)c2)CC1 ZINC001326623255 1047005948 /nfs/dbraw/zinc/00/59/48/1047005948.db2.gz OCPCFRWVFQPGRV-FQEVSTJZSA-N 2 1 351.494 2.917 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCCOC3)cc2F)CC1 ZINC001327121415 1047196641 /nfs/dbraw/zinc/19/66/41/1047196641.db2.gz QMFHTJYYUTVJET-UYAOXDASSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCOC3)cc2F)CC1 ZINC001327121415 1047196644 /nfs/dbraw/zinc/19/66/44/1047196644.db2.gz QMFHTJYYUTVJET-UYAOXDASSA-N 2 1 361.505 2.969 20 10 FFCDMP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)OC(C)(C)C ZINC001329940807 1048977844 /nfs/dbraw/zinc/97/78/44/1048977844.db2.gz MPCQPRHTVVAKBI-OAHLLOKOSA-N 2 1 365.493 2.645 20 10 FFCDMP C[C@@H](O)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001330315403 1049129978 /nfs/dbraw/zinc/12/99/78/1049129978.db2.gz ISUIUMHVZJZQLZ-IIBYNOLFSA-N 2 1 357.473 2.789 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@](C)(O)c1ccccc1 ZINC001349568111 1055343640 /nfs/dbraw/zinc/34/36/40/1055343640.db2.gz FCEIPOMJQJLNCK-VGSWGCGISA-N 2 1 371.500 2.963 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349777 1056835413 /nfs/dbraw/zinc/83/54/13/1056835413.db2.gz HBPZKGIWRRGIII-NRFANRHFSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349777 1056835417 /nfs/dbraw/zinc/83/54/17/1056835417.db2.gz HBPZKGIWRRGIII-NRFANRHFSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2)CC1 ZINC000849349777 1056835429 /nfs/dbraw/zinc/83/54/29/1056835429.db2.gz HBPZKGIWRRGIII-NRFANRHFSA-N 2 1 356.558 2.650 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)ccc1N1CCOCC1 ZINC000849349681 1056835942 /nfs/dbraw/zinc/83/59/42/1056835942.db2.gz DUEATMBAGDBGBD-LJQANCHMSA-N 2 1 361.505 2.874 20 10 FFCDMP NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)ccc3O)c2)C1 ZINC000180704591 510063628 /nfs/dbraw/zinc/06/36/28/510063628.db2.gz ZBNQOYQLEXCTJV-KRWDZBQOSA-N 2 1 371.456 2.518 20 10 FFCDMP CN1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000295938884 511561789 /nfs/dbraw/zinc/56/17/89/511561789.db2.gz KSVIWDQRCONHPN-HXUWFJFHSA-N 2 1 351.494 2.917 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1c(O)cccc1Br ZINC000862252511 730682421 /nfs/dbraw/zinc/68/24/21/730682421.db2.gz DAQVQXYQHQWNRR-VMGRFDJRSA-N 2 1 369.303 2.838 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1c(O)cccc1Br ZINC000862252511 730682423 /nfs/dbraw/zinc/68/24/23/730682423.db2.gz DAQVQXYQHQWNRR-VMGRFDJRSA-N 2 1 369.303 2.838 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+]CCCN2CCC[N@H+](C)CC2)c1O ZINC000894378956 734849006 /nfs/dbraw/zinc/84/90/06/734849006.db2.gz ZDKQKWSQIGKYGI-UHFFFAOYSA-N 2 1 370.335 2.580 20 10 FFCDMP COc1ccc(O)c(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)c1 ZINC000775779701 738124022 /nfs/dbraw/zinc/12/40/22/738124022.db2.gz FAPBJSKVNFMTEU-KRWDZBQOSA-N 2 1 361.511 2.541 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C2(CCO)CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000793079647 739737845 /nfs/dbraw/zinc/73/78/45/739737845.db2.gz PDSOPULJAYTVHQ-UHFFFAOYSA-N 2 1 359.436 2.708 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](n4cc(Cl)cn4)C3)cc2)CC1 ZINC000811520146 741533263 /nfs/dbraw/zinc/53/32/63/741533263.db2.gz KILMKNHTZDESNI-LJQANCHMSA-N 2 1 359.905 2.735 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1O ZINC000827549825 743599015 /nfs/dbraw/zinc/59/90/15/743599015.db2.gz VJJLOBHLAJEACV-MRXNPFEDSA-N 2 1 369.303 2.806 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902494 748132031 /nfs/dbraw/zinc/13/20/31/748132031.db2.gz OABNKSZPCOYCAH-APHBMKBZSA-N 2 1 354.878 2.773 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903448 748133268 /nfs/dbraw/zinc/13/32/68/748133268.db2.gz ZFPLKQRMWHSFTQ-JGGQBBKZSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903448 748133272 /nfs/dbraw/zinc/13/32/72/748133272.db2.gz ZFPLKQRMWHSFTQ-JGGQBBKZSA-N 2 1 369.303 2.873 20 10 FFCDMP COCC[NH+]1CCC([NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850078143 749297890 /nfs/dbraw/zinc/29/78/90/749297890.db2.gz UYLCAEGLWFEROZ-UHFFFAOYSA-N 2 1 350.503 2.899 20 10 FFCDMP COc1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c(O)c1OC ZINC000892510246 969229660 /nfs/dbraw/zinc/22/96/60/969229660.db2.gz VMMRJRCZKZAMIW-UHFFFAOYSA-N 2 1 356.466 2.947 20 10 FFCDMP COc1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c(O)c1OC ZINC000892510246 969229671 /nfs/dbraw/zinc/22/96/71/969229671.db2.gz VMMRJRCZKZAMIW-UHFFFAOYSA-N 2 1 356.466 2.947 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000702604886 990009344 /nfs/dbraw/zinc/00/93/44/990009344.db2.gz ZZTRKCLVZWJFPC-KKSFZXQISA-N 2 1 356.466 2.688 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000702604886 990009349 /nfs/dbraw/zinc/00/93/49/990009349.db2.gz ZZTRKCLVZWJFPC-KKSFZXQISA-N 2 1 356.466 2.688 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+](C)Cc2cnnn2[C@@H]2CCC[NH2+]C2)cc1 ZINC000903876791 1016281715 /nfs/dbraw/zinc/28/17/15/1016281715.db2.gz ISVFGCGRXNBUQI-LJQANCHMSA-N 2 1 356.518 2.681 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)Cc2cnnn2[C@@H]2CCC[NH2+]C2)cc1 ZINC000903876791 1016281718 /nfs/dbraw/zinc/28/17/18/1016281718.db2.gz ISVFGCGRXNBUQI-LJQANCHMSA-N 2 1 356.518 2.681 20 10 FFCDMP Cc1c(C[C@@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cnn1C ZINC000903873802 1016280416 /nfs/dbraw/zinc/28/04/16/1016280416.db2.gz MFBFZAMCNDABAQ-FQEVSTJZSA-N 2 1 369.557 2.968 20 10 FFCDMP Cc1cc(O)c(C[NH+]2CCN(C(=O)C[NH+]3CCCC3)CC2)cc1C(C)C ZINC000738162087 999622368 /nfs/dbraw/zinc/62/23/68/999622368.db2.gz WVQXWJBVVSWVHK-UHFFFAOYSA-N 2 1 359.514 2.564 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846144558 1000218765 /nfs/dbraw/zinc/21/87/65/1000218765.db2.gz LFUIFQMOXYZWAO-IERDGZPVSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000846144558 1000218772 /nfs/dbraw/zinc/21/87/72/1000218772.db2.gz LFUIFQMOXYZWAO-IERDGZPVSA-N 2 1 356.466 2.688 20 10 FFCDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768450106 1000250635 /nfs/dbraw/zinc/25/06/35/1000250635.db2.gz HVLKDBIHFQOTTF-HXUWFJFHSA-N 2 1 356.466 2.902 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1nnc2n1CCCCC2 ZINC000771822063 1001218992 /nfs/dbraw/zinc/21/89/92/1001218992.db2.gz DAJIFBKFTQSNSL-KRWDZBQOSA-N 2 1 368.529 2.607 20 10 FFCDMP Oc1cc2c(cc1C[NH+]1CCC(c3[nH+]cc4n3CCCC4)CC1)[C@H](O)CO2 ZINC000788381048 1001797440 /nfs/dbraw/zinc/79/74/40/1001797440.db2.gz BCDBUYPGMUCDAW-LJQANCHMSA-N 2 1 369.465 2.730 20 10 FFCDMP Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737499 1003899973 /nfs/dbraw/zinc/89/99/73/1003899973.db2.gz NKKVCWNCFAOSSW-OAQYLSRUSA-N 2 1 353.514 2.817 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205601773 1004166314 /nfs/dbraw/zinc/16/63/14/1004166314.db2.gz GGJUQYJJIIDQBK-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc2c(c1)OCCO2 ZINC000775641919 1004906814 /nfs/dbraw/zinc/90/68/14/1004906814.db2.gz DTDJBBOKPNHJDO-UHFFFAOYSA-N 2 1 367.493 2.842 20 10 FFCDMP CN(C(=O)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC000775653010 1004959171 /nfs/dbraw/zinc/95/91/71/1004959171.db2.gz ZIOWOSKYJQANCK-UHFFFAOYSA-N 2 1 372.557 2.661 20 10 FFCDMP CN(C(=O)C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC000775653010 1004959173 /nfs/dbraw/zinc/95/91/73/1004959173.db2.gz ZIOWOSKYJQANCK-UHFFFAOYSA-N 2 1 372.557 2.661 20 10 FFCDMP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883085423 1006635684 /nfs/dbraw/zinc/63/56/84/1006635684.db2.gz QSWDVFQSIKIGCX-GOSISDBHSA-N 2 1 362.420 2.917 20 10 FFCDMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883085423 1006635689 /nfs/dbraw/zinc/63/56/89/1006635689.db2.gz QSWDVFQSIKIGCX-GOSISDBHSA-N 2 1 362.420 2.917 20 10 FFCDMP COc1ccc(N2CCN(CC[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)CC2)cc1 ZINC000817894944 1007802381 /nfs/dbraw/zinc/80/23/81/1007802381.db2.gz PJNFEJFEUHLDKL-FGZHOGPDSA-N 2 1 366.509 2.552 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902533 1007804010 /nfs/dbraw/zinc/80/40/10/1007804010.db2.gz SPRADVLULSFUEL-HLAWJBBLSA-N 2 1 374.548 2.978 20 10 FFCDMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001206372327 1032257982 /nfs/dbraw/zinc/25/79/82/1032257982.db2.gz ZVYRJKCEWVAMFP-OAHLLOKOSA-N 2 1 350.356 2.986 20 10 FFCDMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)C1 ZINC001206372327 1032257990 /nfs/dbraw/zinc/25/79/90/1032257990.db2.gz ZVYRJKCEWVAMFP-OAHLLOKOSA-N 2 1 350.356 2.986 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)CC2)cc1 ZINC000858090922 1008299769 /nfs/dbraw/zinc/29/97/69/1008299769.db2.gz VPQAAGLGJVPZEJ-LJQANCHMSA-N 2 1 374.573 2.670 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc(Cl)nc3)cc2F)CC1 ZINC001177981652 1008829577 /nfs/dbraw/zinc/82/95/77/1008829577.db2.gz PMUYZHSZVRXHCV-UHFFFAOYSA-N 2 1 362.880 2.958 20 10 FFCDMP CC(C)(C)c1cc(O)c(C[N@H+]2CCNC3(CC[NH2+]CC3)C2)cc1Cl ZINC001222109896 1032764552 /nfs/dbraw/zinc/76/45/52/1032764552.db2.gz RACRIWVRUGHAIQ-UHFFFAOYSA-N 2 1 351.922 2.871 20 10 FFCDMP COCCN(CCOC)C1CC[NH+](Cc2ccc(N(C)C)cc2C)CC1 ZINC000840946593 1029939725 /nfs/dbraw/zinc/93/97/25/1029939725.db2.gz AFRZEJXFEHXEMR-UHFFFAOYSA-N 2 1 363.546 2.620 20 10 FFCDMP COCC[NH+](CCOC)C1CC[NH+](Cc2ccc(N(C)C)cc2C)CC1 ZINC000840946593 1029939742 /nfs/dbraw/zinc/93/97/42/1029939742.db2.gz AFRZEJXFEHXEMR-UHFFFAOYSA-N 2 1 363.546 2.620 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205635920 1031894769 /nfs/dbraw/zinc/89/47/69/1031894769.db2.gz BGNCFBUENKCFOY-DOTOQJQBSA-N 2 1 351.922 2.983 20 10 FFCDMP COc1cc(C[N@H+]2CCCN(c3ccccn3)CC2)cc(C[NH+](C)C)c1O ZINC001139253363 1035030202 /nfs/dbraw/zinc/03/02/02/1035030202.db2.gz SASJNODFCDMQIR-UHFFFAOYSA-N 2 1 370.497 2.570 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C)[C@H]3CCC4(C3)OCCO4)cc2)CC1 ZINC001140309730 1035429268 /nfs/dbraw/zinc/42/92/68/1035429268.db2.gz RZMVPMFNZFUDDQ-FQEVSTJZSA-N 2 1 359.514 2.556 20 10 FFCDMP Cc1cc(N2CC[NH+](Cc3ccc(N4CCOCC4)cc3F)CC2)cc[nH+]1 ZINC001140667436 1035829813 /nfs/dbraw/zinc/82/98/13/1035829813.db2.gz SLZCBQUIPJONMR-UHFFFAOYSA-N 2 1 370.472 2.688 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCC[C@H](Oc3ccccc3)C1)C[NH2+]CCO2 ZINC001235693212 1037688273 /nfs/dbraw/zinc/68/82/73/1037688273.db2.gz WCKMYSYLJFDBAM-IBGZPJMESA-N 2 1 354.450 2.918 20 10 FFCDMP [NH3+]C1CN([C@@H]2CCC[N@@H+](Cc3ccc(OCc4ccccc4)cc3O)C2)C1 ZINC001236077622 1037921036 /nfs/dbraw/zinc/92/10/36/1037921036.db2.gz JCCQJIWEADDNHT-HXUWFJFHSA-N 2 1 367.493 2.579 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4ccccn4)C3)c(F)c2)CC1 ZINC001236938784 1038369082 /nfs/dbraw/zinc/36/90/82/1038369082.db2.gz NHAHSUMEXZFHDR-SFHVURJKSA-N 2 1 354.473 2.962 20 10 FFCDMP c1ccc(C[C@@H]2C[C@H](NCc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173839 1039266272 /nfs/dbraw/zinc/26/62/72/1039266272.db2.gz MZGDPLDZJJLQDU-FGZHOGPDSA-N 2 1 364.537 2.549 20 10 FFCDMP CN(C)CC[N@H+]1CCC2(C1)CC[NH+](Cc1cc(Cl)ccc1O)CC2 ZINC001278568946 1041206408 /nfs/dbraw/zinc/20/64/08/1041206408.db2.gz KXBURGRTQLZCAR-UHFFFAOYSA-N 2 1 351.922 2.895 20 10 FFCDMP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@@H+](Cc1cc(Cl)c(O)cc1O)C2 ZINC001279573752 1043281192 /nfs/dbraw/zinc/28/11/92/1043281192.db2.gz YVTMXRPSYPVXPP-IBGZPJMESA-N 2 1 367.921 2.601 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(O)CCc4ccccc43)cc2F)CC1 ZINC001319640489 1045224967 /nfs/dbraw/zinc/22/49/67/1045224967.db2.gz QDCPDYGDALNLJM-JOCHJYFZSA-N 2 1 369.484 2.501 20 10 FFCDMP CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325337189 1046474040 /nfs/dbraw/zinc/47/40/40/1046474040.db2.gz CPMVQRMYRRJQND-IRLDBZIGSA-N 2 1 369.484 2.980 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@@](C)(O)c3ccccc3)cc2F)CC1 ZINC001325879824 1046672035 /nfs/dbraw/zinc/67/20/35/1046672035.db2.gz KEFVAEXJPABJJR-JOCHJYFZSA-N 2 1 371.500 2.965 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](O)C[C@H]3c3ccccc3)cc2F)CC1 ZINC001331397785 1047914426 /nfs/dbraw/zinc/91/44/26/1047914426.db2.gz FLLARMMAIKDCNV-UGKGYDQZSA-N 2 1 369.484 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H](O)C[C@H]3c3ccccc3)cc2F)CC1 ZINC001331397785 1047914436 /nfs/dbraw/zinc/91/44/36/1047914436.db2.gz FLLARMMAIKDCNV-UGKGYDQZSA-N 2 1 369.484 2.885 20 10 FFCDMP Cc1cc(CO)cc(C)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001352035028 1055140777 /nfs/dbraw/zinc/14/07/77/1055140777.db2.gz ZZMDWBUEQCCSLZ-UHFFFAOYSA-N 2 1 371.500 2.976 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CC3)[C@@H]3CCCOC3)cc2F)CC1 ZINC001355302703 1060091958 /nfs/dbraw/zinc/09/19/58/1060091958.db2.gz SRXUZCLSOJZXHH-NQIIRXRSSA-N 2 1 361.505 2.872 20 10 FFCDMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000278899758 511013087 /nfs/dbraw/zinc/01/30/87/511013087.db2.gz FOSIPLKSOCAYSR-CVEARBPZSA-N 2 1 358.461 2.772 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC000273617807 511552783 /nfs/dbraw/zinc/55/27/83/511552783.db2.gz YAPZPCFOJIYHGN-DJPFJPOOSA-N 2 1 370.493 2.934 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC000273617807 511552787 /nfs/dbraw/zinc/55/27/87/511552787.db2.gz YAPZPCFOJIYHGN-DJPFJPOOSA-N 2 1 370.493 2.934 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](C(F)(F)F)CC3)cc2)CC1 ZINC000877819685 732440970 /nfs/dbraw/zinc/44/09/70/732440970.db2.gz IBKHZBVYVPXPER-QGZVFWFLSA-N 2 1 357.420 2.592 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1O ZINC000843125307 747777920 /nfs/dbraw/zinc/77/79/20/747777920.db2.gz RUHHKOOHCFBBLU-OLZOCXBDSA-N 2 1 369.303 2.985 20 10 FFCDMP c1cc(N2CCSCC2)ccc1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000848521336 748948554 /nfs/dbraw/zinc/94/85/54/748948554.db2.gz MSPDXDPZGJWAEF-FQEVSTJZSA-N 2 1 361.555 2.583 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000127941295 975553828 /nfs/dbraw/zinc/55/38/28/975553828.db2.gz CCPZFBYICSNTBH-ICSRJNTNSA-N 2 1 372.557 2.915 20 10 FFCDMP COc1ccc(N2CCC([NH2+]C3CC[NH+](C[C@H]4CCCO4)CC3)CC2)cc1 ZINC000765978134 988226797 /nfs/dbraw/zinc/22/67/97/988226797.db2.gz SSUCHMUNJPAVJQ-JOCHJYFZSA-N 2 1 373.541 2.897 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000922391155 988547363 /nfs/dbraw/zinc/54/73/63/988547363.db2.gz UCYGIXDYAVJXDK-NQPKCUPCSA-N 2 1 357.542 2.835 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515481 998627731 /nfs/dbraw/zinc/62/77/31/998627731.db2.gz PZLQAGGYENWKOX-IRXDYDNUSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515481 998627737 /nfs/dbraw/zinc/62/77/37/998627737.db2.gz PZLQAGGYENWKOX-IRXDYDNUSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515481 998627740 /nfs/dbraw/zinc/62/77/40/998627740.db2.gz PZLQAGGYENWKOX-IRXDYDNUSA-N 2 1 354.450 2.757 20 10 FFCDMP CC(C)[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775725810 1003825429 /nfs/dbraw/zinc/82/54/29/1003825429.db2.gz SXVSXIKQUNNZQO-UHFFFAOYSA-N 2 1 361.530 2.991 20 10 FFCDMP CC(C)[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775725810 1003825443 /nfs/dbraw/zinc/82/54/43/1003825443.db2.gz SXVSXIKQUNNZQO-UHFFFAOYSA-N 2 1 361.530 2.991 20 10 FFCDMP CCOc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c(O)c1 ZINC000850357473 1005810663 /nfs/dbraw/zinc/81/06/63/1005810663.db2.gz KPEVXRLUHVQXHT-IBGZPJMESA-N 2 1 356.466 2.647 20 10 FFCDMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817895339 1007802511 /nfs/dbraw/zinc/80/25/11/1007802511.db2.gz SZYOHPSGCZFUMB-KKSFZXQISA-N 2 1 371.500 2.835 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1c[nH+]ccc1N ZINC000817916901 1007807885 /nfs/dbraw/zinc/80/78/85/1007807885.db2.gz MHHXPVWIXZQNLO-KRWDZBQOSA-N 3 1 365.525 2.877 20 10 FFCDMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817940512 1007818920 /nfs/dbraw/zinc/81/89/20/1007818920.db2.gz NPVQNSBEFYNBER-QGZVFWFLSA-N 2 1 372.488 2.888 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000773147593 1009747298 /nfs/dbraw/zinc/74/72/98/1009747298.db2.gz SZDVCTHQCDGANH-GGAORHGYSA-N 3 1 368.569 2.935 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000773147593 1009747312 /nfs/dbraw/zinc/74/73/12/1009747312.db2.gz SZDVCTHQCDGANH-GGAORHGYSA-N 2 1 368.569 2.935 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000773147593 1009747326 /nfs/dbraw/zinc/74/73/26/1009747326.db2.gz SZDVCTHQCDGANH-GGAORHGYSA-N 2 1 368.569 2.935 20 10 FFCDMP NC(=O)C1CCN(c2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000925776229 1017847095 /nfs/dbraw/zinc/84/70/95/1017847095.db2.gz FNFUJPJFSVIKCV-RTWAWAEBSA-N 2 1 364.493 2.623 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](OCC4CC4)C3)cc2F)CC1 ZINC001116695307 1021359537 /nfs/dbraw/zinc/35/95/37/1021359537.db2.gz BGSAXMYTQXHSAV-LJQANCHMSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](OCC4CC4)C3)cc2F)CC1 ZINC001116695307 1021359551 /nfs/dbraw/zinc/35/95/51/1021359551.db2.gz BGSAXMYTQXHSAV-LJQANCHMSA-N 2 1 361.505 2.969 20 10 FFCDMP CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116755295 1021397140 /nfs/dbraw/zinc/39/71/40/1021397140.db2.gz CFAFFZICTGUUAR-NRFANRHFSA-N 2 1 363.521 2.951 20 10 FFCDMP CC(C)C[C@]1(CO)CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116755295 1021397158 /nfs/dbraw/zinc/39/71/58/1021397158.db2.gz CFAFFZICTGUUAR-NRFANRHFSA-N 2 1 363.521 2.951 20 10 FFCDMP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(F)cc1O ZINC000756532982 1023723967 /nfs/dbraw/zinc/72/39/67/1023723967.db2.gz HEXUSARBWLGCFL-MRXNPFEDSA-N 2 1 373.476 2.574 20 10 FFCDMP Oc1ccc(O)c(C[NH+]2CCC3(CC2)C[N@@H+](Cc2ccccc2)CCO3)c1 ZINC001141158852 1025540792 /nfs/dbraw/zinc/54/07/92/1025540792.db2.gz PDWCGFAPRRVQBE-UHFFFAOYSA-N 2 1 368.477 2.965 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCCC[C@H](C[NH3+])C2)c(O)c1 ZINC001206649706 1027983550 /nfs/dbraw/zinc/98/35/50/1027983550.db2.gz YBUUFSSMPXXJNZ-MRXNPFEDSA-N 2 1 364.486 2.675 20 10 FFCDMP CN(C)c1ccc([C@@H](N)C[NH2+]Cc2cnn(-c3ccc(F)cc3)c2)cc1 ZINC000841041911 1029995833 /nfs/dbraw/zinc/99/58/33/1029995833.db2.gz GDTYYMMSIRCRFM-FQEVSTJZSA-N 2 1 353.445 2.867 20 10 FFCDMP Cc1ccc(C[N@H+](CCO)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000783603210 1030178372 /nfs/dbraw/zinc/17/83/72/1030178372.db2.gz MSPGVMZXOJEUJT-UHFFFAOYSA-N 2 1 353.510 2.741 20 10 FFCDMP COc1ccc(O)c(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1 ZINC001203673290 1030822478 /nfs/dbraw/zinc/82/24/78/1030822478.db2.gz UIEGZWDNHYTABB-UHFFFAOYSA-N 2 1 370.497 2.642 20 10 FFCDMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000798956819 1031595451 /nfs/dbraw/zinc/59/54/51/1031595451.db2.gz BKSYQKQTHDJFDN-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)c(Br)c1 ZINC001205592314 1031859189 /nfs/dbraw/zinc/85/91/89/1031859189.db2.gz SKRKVZJTKXJKLM-HNNXBMFYSA-N 2 1 361.255 2.816 20 10 FFCDMP CCOC(=O)[C@@]1(C)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139410969 1035094789 /nfs/dbraw/zinc/09/47/89/1035094789.db2.gz OAZBNVKWSPQZMG-NRFANRHFSA-N 2 1 359.514 2.604 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c1 ZINC001140620422 1035744406 /nfs/dbraw/zinc/74/44/06/1035744406.db2.gz NQSCZEZPJIHYRK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccncc4)CCO[C@@H]3C2)c1 ZINC001140620422 1035744412 /nfs/dbraw/zinc/74/44/12/1035744412.db2.gz NQSCZEZPJIHYRK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccncc4)CCO[C@@H]3C2)c1 ZINC001140620422 1035744416 /nfs/dbraw/zinc/74/44/16/1035744416.db2.gz NQSCZEZPJIHYRK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CCC3(CCC[N@H+]3Cc3cnn(C)c3)CC2)c1O ZINC001140744563 1036032620 /nfs/dbraw/zinc/03/26/20/1036032620.db2.gz CBUAFQARKSROKZ-UHFFFAOYSA-N 2 1 370.497 2.770 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CCC3(CCC[N@@H+]3Cc3cnn(C)c3)CC2)c1O ZINC001140744563 1036032629 /nfs/dbraw/zinc/03/26/29/1036032629.db2.gz CBUAFQARKSROKZ-UHFFFAOYSA-N 2 1 370.497 2.770 20 10 FFCDMP Cc1ccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c(O)c1 ZINC001140949557 1036546514 /nfs/dbraw/zinc/54/65/14/1036546514.db2.gz DRTGDTMEEPECDN-WOJBJXKFSA-N 2 1 371.525 2.608 20 10 FFCDMP c1c(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)cc2c3c1CCCN3CCC2 ZINC001141077947 1036929192 /nfs/dbraw/zinc/92/91/92/1036929192.db2.gz GCFHDSJNILWHRS-UHFFFAOYSA-N 2 1 368.569 2.599 20 10 FFCDMP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C(F)(F)F)C1 ZINC001235231941 1037426943 /nfs/dbraw/zinc/42/69/43/1037426943.db2.gz QZWDRYPZLLCBIV-AAEUAGOBSA-N 2 1 354.294 2.995 20 10 FFCDMP Oc1cc(C(F)(F)F)ccc1C[N@H+]1C[C@@H]2C[NH2+]C[C@]2(C(F)(F)F)C1 ZINC001235231941 1037426950 /nfs/dbraw/zinc/42/69/50/1037426950.db2.gz QZWDRYPZLLCBIV-AAEUAGOBSA-N 2 1 354.294 2.995 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3c(O)ccc4ccccc43)C[C@@H]1CC[NH2+]CC2 ZINC001235351661 1037498029 /nfs/dbraw/zinc/49/80/29/1037498029.db2.gz HFYCRJNGDKUYFX-JTSKRJEESA-N 2 1 368.477 2.910 20 10 FFCDMP Cc1cc(Br)c([O-])c(CN2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)c1 ZINC001235409299 1037531276 /nfs/dbraw/zinc/53/12/76/1037531276.db2.gz WAXLTEJTGROOEA-HOCLYGCPSA-N 2 1 357.267 2.987 20 10 FFCDMP Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235423694 1037541623 /nfs/dbraw/zinc/54/16/23/1037541623.db2.gz GJFKMRLIVCSYRZ-MSOLQXFVSA-N 2 1 361.505 2.874 20 10 FFCDMP CCOc1ccc(N2CC[NH+](C[C@H]3[C@H](C)C[NH2+]CC3(F)F)CC2)cc1 ZINC001236433838 1038087467 /nfs/dbraw/zinc/08/74/67/1038087467.db2.gz MIEVKOVIJAWAIU-QAPCUYQASA-N 2 1 353.457 2.698 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc4ccccc4cc3O)CC[C@@H]2C1 ZINC001236832379 1038294431 /nfs/dbraw/zinc/29/44/31/1038294431.db2.gz LSCASPSXHGPHOK-DENIHFKCSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc4ccccc4cc3O)CC[C@@H]2C1 ZINC001236832379 1038294440 /nfs/dbraw/zinc/29/44/40/1038294440.db2.gz LSCASPSXHGPHOK-DENIHFKCSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc4ccccc4cc3O)CC[C@@H]2C1 ZINC001236832379 1038294452 /nfs/dbraw/zinc/29/44/52/1038294452.db2.gz LSCASPSXHGPHOK-DENIHFKCSA-N 2 1 370.493 2.715 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)c(F)c2)CC1 ZINC001236942641 1038370329 /nfs/dbraw/zinc/37/03/29/1038370329.db2.gz LEMVPLMHCJHDGF-HXUWFJFHSA-N 2 1 370.472 2.626 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](COCC4CC4)C3)c(F)c2)CC1 ZINC001236943152 1038371450 /nfs/dbraw/zinc/37/14/50/1038371450.db2.gz QAPUYRQGMCIOSS-SFHVURJKSA-N 2 1 361.505 2.826 20 10 FFCDMP CN(C)CC[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557138 1041146318 /nfs/dbraw/zinc/14/63/18/1041146318.db2.gz FRNSCGQBWOBXBV-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP CN(C)CC[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557138 1041146324 /nfs/dbraw/zinc/14/63/24/1041146324.db2.gz FRNSCGQBWOBXBV-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP CN(C)CC[NH+]1CC[C@H]2C[N@H+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557138 1041146328 /nfs/dbraw/zinc/14/63/28/1041146328.db2.gz FRNSCGQBWOBXBV-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)cc3O)C[C@H]2CC1 ZINC001278557601 1041146949 /nfs/dbraw/zinc/14/69/49/1041146949.db2.gz LTCMFBGCPJJXSG-IYBDPMFKSA-N 2 1 368.905 2.810 20 10 FFCDMP Oc1ccc([C@H](O)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1O ZINC001255122684 1041157023 /nfs/dbraw/zinc/15/70/23/1041157023.db2.gz IUXLKTFVRDREAA-VQQMMKBISA-N 2 1 368.477 2.916 20 10 FFCDMP COc1ccc(C[N@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001278565447 1041190431 /nfs/dbraw/zinc/19/04/31/1041190431.db2.gz MIAFKSNYBSYWTP-NRFANRHFSA-N 2 1 361.530 2.640 20 10 FFCDMP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c(O)c1 ZINC001279338710 1043011382 /nfs/dbraw/zinc/01/13/82/1043011382.db2.gz PFZRLRXCDVWPON-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3CC[N@@H+](CCn4ccnc4)CC[C@@H]3C2)c(O)c1 ZINC001279338710 1043011386 /nfs/dbraw/zinc/01/13/86/1043011386.db2.gz PFZRLRXCDVWPON-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3CC[N@H+](CCn4ccnc4)CC[C@@H]3C2)c(O)c1 ZINC001279338710 1043011390 /nfs/dbraw/zinc/01/13/90/1043011390.db2.gz PFZRLRXCDVWPON-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001279523528 1043221460 /nfs/dbraw/zinc/22/14/60/1043221460.db2.gz YYSKPSIAPSWVQQ-GASCZTMLSA-N 2 1 373.419 2.501 20 10 FFCDMP Cc1cc(F)cc(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)c1O ZINC001238059800 1043506529 /nfs/dbraw/zinc/50/65/29/1043506529.db2.gz DPZCUGWJDYIXSH-UHFFFAOYSA-N 2 1 358.461 2.690 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3cc(F)cc(C)c3O)C[C@H]2CC1 ZINC001280027761 1044102750 /nfs/dbraw/zinc/10/27/50/1044102750.db2.gz IQWNCEMMUNBRDB-CALCHBBNSA-N 2 1 366.477 2.604 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3cc(F)cc(C)c3O)C[C@H]2CC1 ZINC001280027761 1044102755 /nfs/dbraw/zinc/10/27/55/1044102755.db2.gz IQWNCEMMUNBRDB-CALCHBBNSA-N 2 1 366.477 2.604 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3cc(F)cc(C)c3O)C[C@H]2CC1 ZINC001280027761 1044102759 /nfs/dbraw/zinc/10/27/59/1044102759.db2.gz IQWNCEMMUNBRDB-CALCHBBNSA-N 2 1 366.477 2.604 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)CCO[C@H]3C3CC3)cc2F)CC1 ZINC001320413565 1045403895 /nfs/dbraw/zinc/40/38/95/1045403895.db2.gz CMGUSLZYRVMVEI-LEWJYISDSA-N 2 1 361.505 2.872 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC3(O)CCC(F)(F)CC3)cc2F)CC1 ZINC001327210231 1047235862 /nfs/dbraw/zinc/23/58/62/1047235862.db2.gz NPWIFRYNPUIXTF-UHFFFAOYSA-N 2 1 371.447 2.608 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@@H]3c3ccccc3)cc2F)CC1 ZINC001345103094 1052258917 /nfs/dbraw/zinc/25/89/17/1052258917.db2.gz BBMLDTPZELLBET-JOCHJYFZSA-N 2 1 368.500 2.724 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)ccc1N1CCOCC1 ZINC000849349680 1056836215 /nfs/dbraw/zinc/83/62/15/1056836215.db2.gz DUEATMBAGDBGBD-IBGZPJMESA-N 2 1 361.505 2.874 20 10 FFCDMP COC(=O)c1c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c2cc(F)ccc2n1C ZINC001578850320 1078534037 /nfs/dbraw/zinc/53/40/37/1078534037.db2.gz DNYXCWDNNLPLLS-XGWLTEMNSA-N 2 1 359.445 2.663 20 10 FFCDMP COC(=O)c1c(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c2cc(F)ccc2n1C ZINC001578850320 1078534041 /nfs/dbraw/zinc/53/40/41/1078534041.db2.gz DNYXCWDNNLPLLS-XGWLTEMNSA-N 2 1 359.445 2.663 20 10 FFCDMP CC[NH+]1CCN(C(=O)CC2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)CC1 ZINC000093141426 508124810 /nfs/dbraw/zinc/12/48/10/508124810.db2.gz DNHGONLBLZHTSI-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP CN(CC[N@@H+](C)Cc1cc(Br)ccc1O)C1CC[NH+](C)CC1 ZINC000289428222 511100743 /nfs/dbraw/zinc/10/07/43/511100743.db2.gz KHCGAIFUFOEHNI-UHFFFAOYSA-N 2 1 370.335 2.613 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCC(C(=O)N3CC[NH+](C)CC3)CC2)cc1 ZINC000289970952 511123016 /nfs/dbraw/zinc/12/30/16/511123016.db2.gz ZEMLUUOFJQKOEO-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)c1O ZINC000371848258 512601138 /nfs/dbraw/zinc/60/11/38/512601138.db2.gz YNVKNMGWYUUFHV-ARFHVFGLSA-N 2 1 354.878 2.738 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)c1O ZINC000371848258 512601142 /nfs/dbraw/zinc/60/11/42/512601142.db2.gz YNVKNMGWYUUFHV-ARFHVFGLSA-N 2 1 354.878 2.738 20 10 FFCDMP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)c(F)c1 ZINC000925781707 738529346 /nfs/dbraw/zinc/52/93/46/738529346.db2.gz ZTGNVJVZWFESPA-HIFRSBDPSA-N 2 1 357.420 2.558 20 10 FFCDMP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)cc(F)c1O ZINC000756779224 736360901 /nfs/dbraw/zinc/36/09/01/736360901.db2.gz RMGIJFZXJCORHS-LBPRGKRZSA-N 2 1 351.397 2.857 20 10 FFCDMP CC[NH+](CC)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000774834143 738031207 /nfs/dbraw/zinc/03/12/07/738031207.db2.gz BWCJPGQXBDVBDY-UHFFFAOYSA-N 2 1 351.447 2.863 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000844910433 748134686 /nfs/dbraw/zinc/13/46/86/748134686.db2.gz IBKRXVCHAFMWRK-ARFHVFGLSA-N 2 1 354.878 2.915 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c(Cl)c1 ZINC001279665572 968026170 /nfs/dbraw/zinc/02/61/70/968026170.db2.gz OAFUXBSTNAZRAU-UHFFFAOYSA-N 2 1 367.921 2.514 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126118 986556757 /nfs/dbraw/zinc/55/67/57/986556757.db2.gz GRVUJYMCZHRKFT-LEWJYISDSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126118 986556763 /nfs/dbraw/zinc/55/67/63/986556763.db2.gz GRVUJYMCZHRKFT-LEWJYISDSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126118 986556770 /nfs/dbraw/zinc/55/67/70/986556770.db2.gz GRVUJYMCZHRKFT-LEWJYISDSA-N 2 1 356.558 2.650 20 10 FFCDMP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 ZINC000765973791 987922789 /nfs/dbraw/zinc/92/27/89/987922789.db2.gz FRLSUVXROBFPBN-AVRDEDQJSA-N 2 1 373.541 2.817 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)cc2)CC1 ZINC000824695650 997059204 /nfs/dbraw/zinc/05/92/04/997059204.db2.gz AGEIYAZUZNJBDX-BHDDXSALSA-N 2 1 357.542 2.954 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)[C@@H](C)C2)C1 ZINC000767951269 1000164672 /nfs/dbraw/zinc/16/46/72/1000164672.db2.gz XJOSZLJXUDBETN-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)[C@@H](C)C2)C1 ZINC000767951269 1000164673 /nfs/dbraw/zinc/16/46/73/1000164673.db2.gz XJOSZLJXUDBETN-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000767951269 1000164674 /nfs/dbraw/zinc/16/46/74/1000164674.db2.gz XJOSZLJXUDBETN-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@@H+](C)[C@@H](C)C2)C1 ZINC000767951269 1000164676 /nfs/dbraw/zinc/16/46/76/1000164676.db2.gz XJOSZLJXUDBETN-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768530143 1000285041 /nfs/dbraw/zinc/28/50/41/1000285041.db2.gz ZGIYUOASMPLVEI-FQEVSTJZSA-N 2 1 373.541 2.992 20 10 FFCDMP Oc1cc2c(cc1CN1C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C1)OCO2 ZINC000793243142 1003317347 /nfs/dbraw/zinc/31/73/47/1003317347.db2.gz VBWHIKCWSRODKF-HDICACEKSA-N 2 1 352.434 2.685 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)OCO2 ZINC000793243142 1003317352 /nfs/dbraw/zinc/31/73/52/1003317352.db2.gz VBWHIKCWSRODKF-HDICACEKSA-N 2 1 352.434 2.685 20 10 FFCDMP Oc1cc2c(cc1C[N@@H+]1C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)OCO2 ZINC000793243142 1003317359 /nfs/dbraw/zinc/31/73/59/1003317359.db2.gz VBWHIKCWSRODKF-HDICACEKSA-N 2 1 352.434 2.685 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860627 /nfs/dbraw/zinc/86/06/27/1003860627.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 3 1 356.558 2.602 20 10 FFCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860640 /nfs/dbraw/zinc/86/06/40/1003860640.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 3 1 356.558 2.602 20 10 FFCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860655 /nfs/dbraw/zinc/86/06/55/1003860655.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 3 1 356.558 2.602 20 10 FFCDMP C[N@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860670 /nfs/dbraw/zinc/86/06/70/1003860670.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 2 1 356.558 2.602 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726703 1003860688 /nfs/dbraw/zinc/86/06/88/1003860688.db2.gz XMUXAYQTTFJGBJ-NRFANRHFSA-N 2 1 356.558 2.602 20 10 FFCDMP COc1cc(F)cc(OC)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283147 1006730019 /nfs/dbraw/zinc/73/00/19/1006730019.db2.gz RXXZCMQXACCSFH-UHFFFAOYSA-N 2 1 373.472 2.885 20 10 FFCDMP CC(C)(C)[NH2+]CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001116407594 1021202204 /nfs/dbraw/zinc/20/22/04/1021202204.db2.gz PKZXBWBCNJEEBQ-OAHLLOKOSA-N 2 1 353.894 2.514 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222609294 1033071781 /nfs/dbraw/zinc/07/17/81/1033071781.db2.gz MPZMLUAWJBJNKD-HXUWFJFHSA-N 2 1 351.494 2.950 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222609294 1033071794 /nfs/dbraw/zinc/07/17/94/1033071794.db2.gz MPZMLUAWJBJNKD-HXUWFJFHSA-N 2 1 351.494 2.950 20 10 FFCDMP CCOC(=O)c1c(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c2ccccc2n1C ZINC001222629426 1033081956 /nfs/dbraw/zinc/08/19/56/1033081956.db2.gz GIAGQFMKCPTROE-IYBDPMFKSA-N 2 1 355.482 2.786 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNc3cccn4c[nH+]cc34)CC2)cc1 ZINC001164336349 1029250069 /nfs/dbraw/zinc/25/00/69/1029250069.db2.gz YSGMZPFHUZSUHV-UHFFFAOYSA-N 2 1 365.481 2.967 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000840932593 1029931974 /nfs/dbraw/zinc/93/19/74/1029931974.db2.gz BCCYTPTYYHFJEG-QFIPXVFZSA-N 2 1 353.510 2.788 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000840932593 1029931984 /nfs/dbraw/zinc/93/19/84/1029931984.db2.gz BCCYTPTYYHFJEG-QFIPXVFZSA-N 2 1 353.510 2.788 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cc(OC)ccc1O)C2 ZINC001203673451 1030822356 /nfs/dbraw/zinc/82/23/56/1030822356.db2.gz ZCLDCUMSQQPOCR-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1cc(OC)ccc1O)C2 ZINC001203673451 1030822368 /nfs/dbraw/zinc/82/23/68/1030822368.db2.gz ZCLDCUMSQQPOCR-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1cc(OC)ccc1O)C2 ZINC001203673451 1030822379 /nfs/dbraw/zinc/82/23/79/1030822379.db2.gz ZCLDCUMSQQPOCR-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@H](CNC(=O)[C@H]3CCC[NH2+]3)C2)cc1 ZINC000843058451 1031165076 /nfs/dbraw/zinc/16/50/76/1031165076.db2.gz SLJCAKOKHUPWLK-TZIWHRDSSA-N 2 1 372.557 2.613 20 10 FFCDMP [NH3+]C[C@]1(O)CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001205240358 1031620707 /nfs/dbraw/zinc/62/07/07/1031620707.db2.gz JGRGHBMBXWOXTN-NRFANRHFSA-N 2 1 356.466 2.647 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139256458 1035029677 /nfs/dbraw/zinc/02/96/77/1035029677.db2.gz CFIPPKQLPXTETM-LJQANCHMSA-N 2 1 371.481 2.901 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3cccc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139261109 1035033135 /nfs/dbraw/zinc/03/31/35/1035033135.db2.gz UTJWCAXESBDPTQ-GOSISDBHSA-N 2 1 371.481 2.819 20 10 FFCDMP Cc1cccc(O[C@@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC001139411636 1035094692 /nfs/dbraw/zinc/09/46/92/1035094692.db2.gz WCRYMMYYJGEDFN-OAQYLSRUSA-N 2 1 366.509 2.795 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(Cc4ccco4)CC3)cc2)CC1 ZINC001140304209 1035426257 /nfs/dbraw/zinc/42/62/57/1035426257.db2.gz ISSXTZWGVBHCKO-UHFFFAOYSA-N 2 1 368.525 2.739 20 10 FFCDMP CN(C)c1ccc(/C=C/CN2CCN(C[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028827 1035489730 /nfs/dbraw/zinc/48/97/30/1035489730.db2.gz SRTFUQUTRSVFCS-XYXUZSOXSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH+]2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028827 1035489732 /nfs/dbraw/zinc/48/97/32/1035489732.db2.gz SRTFUQUTRSVFCS-XYXUZSOXSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH+]2CCN(C[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028827 1035489735 /nfs/dbraw/zinc/48/97/35/1035489735.db2.gz SRTFUQUTRSVFCS-XYXUZSOXSA-N 2 1 356.558 2.868 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235236205 1037426684 /nfs/dbraw/zinc/42/66/84/1037426684.db2.gz CSQUGXBTDNWLCA-QFIPXVFZSA-N 2 1 374.548 2.932 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3c(O)ccc4ccccc43)CC[C@@H]2C1 ZINC001231587071 1037706164 /nfs/dbraw/zinc/70/61/64/1037706164.db2.gz JLYDXZKGKSHWOR-XMSQKQJNSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3c(O)ccc4ccccc43)CC[C@@H]2C1 ZINC001231587071 1037706179 /nfs/dbraw/zinc/70/61/79/1037706179.db2.gz JLYDXZKGKSHWOR-XMSQKQJNSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3c(O)ccc4ccccc43)CC[C@@H]2C1 ZINC001231587071 1037706198 /nfs/dbraw/zinc/70/61/98/1037706198.db2.gz JLYDXZKGKSHWOR-XMSQKQJNSA-N 2 1 370.493 2.715 20 10 FFCDMP COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236110596 1037935183 /nfs/dbraw/zinc/93/51/83/1037935183.db2.gz BWBPHUYCHFMNOQ-HNNXBMFYSA-N 2 1 356.466 2.946 20 10 FFCDMP COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236114069 1037937612 /nfs/dbraw/zinc/93/76/12/1037937612.db2.gz ZLTZQYYMMLKOHV-QGZVFWFLSA-N 2 1 369.509 2.873 20 10 FFCDMP C[N@@H+](C1CC1)C1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236941891 1038370759 /nfs/dbraw/zinc/37/07/59/1038370759.db2.gz GPPACBZVBIPNGI-UHFFFAOYSA-N 2 1 360.521 2.636 20 10 FFCDMP Cc1ccc(C[NH+]2CCC3(CC[N@@H+](CCn4ccnc4)C3)CC2)c(O)c1 ZINC001279338761 1043011224 /nfs/dbraw/zinc/01/12/24/1043011224.db2.gz PVTFZMPVDPEHSH-UHFFFAOYSA-N 2 1 354.498 2.885 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCC12C[NH2+]C2 ZINC001237431297 1043156601 /nfs/dbraw/zinc/15/66/01/1043156601.db2.gz QODJLVGUVNOQHJ-FQEVSTJZSA-N 2 1 371.525 2.652 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCSC(F)(F)F)cc2F)CC1 ZINC001319829194 1045281328 /nfs/dbraw/zinc/28/13/28/1045281328.db2.gz QEWRUNMTIJTUNX-UHFFFAOYSA-N 2 1 351.413 2.920 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CC[C@@H](C4CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001324455114 1046039965 /nfs/dbraw/zinc/03/99/65/1046039965.db2.gz IDELTXAIZLIDIP-HXUWFJFHSA-N 3 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)CC1 ZINC001324455114 1046039975 /nfs/dbraw/zinc/03/99/75/1046039975.db2.gz IDELTXAIZLIDIP-HXUWFJFHSA-N 3 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)CC1 ZINC001324455114 1046039989 /nfs/dbraw/zinc/03/99/89/1046039989.db2.gz IDELTXAIZLIDIP-HXUWFJFHSA-N 3 1 374.548 2.741 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CC[C@H](C4CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001324455099 1046040159 /nfs/dbraw/zinc/04/01/59/1046040159.db2.gz IDELTXAIZLIDIP-FQEVSTJZSA-N 3 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)CC1 ZINC001324455099 1046040162 /nfs/dbraw/zinc/04/01/62/1046040162.db2.gz IDELTXAIZLIDIP-FQEVSTJZSA-N 3 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)CC1 ZINC001324455099 1046040166 /nfs/dbraw/zinc/04/01/66/1046040166.db2.gz IDELTXAIZLIDIP-FQEVSTJZSA-N 3 1 374.548 2.741 20 10 FFCDMP Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001326130819 1046779077 /nfs/dbraw/zinc/77/90/77/1046779077.db2.gz WPGGTGAAHWBQKS-FQEVSTJZSA-N 2 1 371.500 2.579 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202856 1046809190 /nfs/dbraw/zinc/80/91/90/1046809190.db2.gz WFSYWIFDXYJWBG-PMACEKPBSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202856 1046809206 /nfs/dbraw/zinc/80/92/06/1046809206.db2.gz WFSYWIFDXYJWBG-PMACEKPBSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202856 1046809218 /nfs/dbraw/zinc/80/92/18/1046809218.db2.gz WFSYWIFDXYJWBG-PMACEKPBSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC([NH2+]C4CCC4)CC3)cc2F)CC1 ZINC001343317432 1052157784 /nfs/dbraw/zinc/15/77/84/1052157784.db2.gz BGNITAKORWHMAB-UHFFFAOYSA-N 2 1 360.521 2.684 20 10 FFCDMP CCc1cccc(C[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1O ZINC001346540787 1053088056 /nfs/dbraw/zinc/08/80/56/1053088056.db2.gz PXPRMNXDXSVJLJ-UHFFFAOYSA-N 2 1 353.510 2.992 20 10 FFCDMP CN(CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001473924204 1065420306 /nfs/dbraw/zinc/42/03/06/1065420306.db2.gz NTIVXMWHFJUWOM-UHFFFAOYSA-N 2 1 356.489 2.804 20 10 FFCDMP CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722858 1076063220 /nfs/dbraw/zinc/06/32/20/1076063220.db2.gz DFEIEGXJVXGLSG-QUCCMNQESA-N 2 1 360.546 2.594 20 10 FFCDMP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001560354830 1076267400 /nfs/dbraw/zinc/26/74/00/1076267400.db2.gz DPSANRHRMGPDFH-UHFFFAOYSA-N 3 1 362.537 2.789 20 10 FFCDMP C[N@@H+](CCC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC001589178401 1080397931 /nfs/dbraw/zinc/39/79/31/1080397931.db2.gz BVFYDFXGCQUGQN-UHFFFAOYSA-N 2 1 372.557 2.709 20 10 FFCDMP Cc1ccc(O)c(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000113339855 508261682 /nfs/dbraw/zinc/26/16/82/508261682.db2.gz DSZJKXYOSCRYQO-IBGZPJMESA-N 2 1 367.493 2.688 20 10 FFCDMP C[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1O ZINC000183503988 509830307 /nfs/dbraw/zinc/83/03/07/509830307.db2.gz OPKVOEGOMNDLBM-APWZRJJASA-N 2 1 367.493 2.940 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c1 ZINC000843125070 747777534 /nfs/dbraw/zinc/77/75/34/747777534.db2.gz MWOFPRPKYOIZMS-AWEZNQCLSA-N 2 1 369.303 2.650 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@H+]2C[C@H](C[NH3+])C3(C2)CCOCC3)c1 ZINC000843125070 747777551 /nfs/dbraw/zinc/77/75/51/747777551.db2.gz MWOFPRPKYOIZMS-AWEZNQCLSA-N 2 1 369.303 2.650 20 10 FFCDMP C[NH+](C)CCC[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCO1 ZINC000853625822 750117790 /nfs/dbraw/zinc/11/77/90/750117790.db2.gz ZCVOTJSJCZRPRK-QGZVFWFLSA-N 2 1 350.503 2.938 20 10 FFCDMP C[NH+](C)CCC[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCO1 ZINC000853625822 750117794 /nfs/dbraw/zinc/11/77/94/750117794.db2.gz ZCVOTJSJCZRPRK-QGZVFWFLSA-N 2 1 350.503 2.938 20 10 FFCDMP CC[N@H+]1CC[C@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000162800561 972135769 /nfs/dbraw/zinc/13/57/69/972135769.db2.gz SUTAWWNUVAWWAJ-KNQAVFIVSA-N 2 1 374.573 2.527 20 10 FFCDMP C[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728610 983998939 /nfs/dbraw/zinc/99/89/39/983998939.db2.gz MVRNXXBHSGEHLT-MJGOQNOKSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728610 983998942 /nfs/dbraw/zinc/99/89/42/983998942.db2.gz MVRNXXBHSGEHLT-MJGOQNOKSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728610 983998943 /nfs/dbraw/zinc/99/89/43/983998943.db2.gz MVRNXXBHSGEHLT-MJGOQNOKSA-N 2 1 372.557 2.611 20 10 FFCDMP CCC[N@@H+](C)CC(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1 ZINC001106910876 991535533 /nfs/dbraw/zinc/53/55/33/991535533.db2.gz SUWQCJNPZNZXED-IEBWSBKVSA-N 2 1 361.530 2.530 20 10 FFCDMP COc1ccc([C@H](C[NH3+])C[NH+]2CCN(c3ccc(OC)c(F)c3)CC2)cc1 ZINC000844221295 997711592 /nfs/dbraw/zinc/71/15/92/997711592.db2.gz MGWVINMYQTVKKI-QGZVFWFLSA-N 2 1 373.472 2.707 20 10 FFCDMP Cc1c(C[C@@H](C[NH3+])C[N@@H+](Cc2ccccc2O)C2CCCC2)cnn1C ZINC000903892676 1016291311 /nfs/dbraw/zinc/29/13/11/1016291311.db2.gz LEBQDJSUJQLPGY-KRWDZBQOSA-N 2 1 356.514 2.996 20 10 FFCDMP C[N@H+]1CCCC[C@H]1CN1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738170223 999622668 /nfs/dbraw/zinc/62/26/68/999622668.db2.gz OCWKWMUYKCTVOT-SFHVURJKSA-N 2 1 354.498 2.542 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCCC3)CC[C@H]1N1CC[NH+](C)CC1 ZINC000768465732 1000263703 /nfs/dbraw/zinc/26/37/03/1000263703.db2.gz RLNXPYWOWKHKCA-LAUBAEHRSA-N 2 1 357.542 2.729 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](OCC(F)(F)F)C3)cc2)CC1 ZINC000771824644 1001220574 /nfs/dbraw/zinc/22/05/74/1001220574.db2.gz OZEAUIHTBOADEO-SFHVURJKSA-N 2 1 371.447 2.982 20 10 FFCDMP Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732927 1003895299 /nfs/dbraw/zinc/89/52/99/1003895299.db2.gz RTXHYLMBNCSOKA-FQEVSTJZSA-N 2 1 353.514 2.681 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc2n(n1)CCCC2 ZINC000883290701 1006736498 /nfs/dbraw/zinc/73/64/98/1006736498.db2.gz CRUXHAMUCYLKCE-QGZVFWFLSA-N 2 1 353.514 2.822 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc4c(c3)CCO4)cc2F)CC1 ZINC001178482544 1009004881 /nfs/dbraw/zinc/00/48/81/1009004881.db2.gz GOURXKGHPOHETO-UHFFFAOYSA-N 2 1 369.484 2.845 20 10 FFCDMP COc1ccc(N2CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c(OC)c1 ZINC001172122413 1011659050 /nfs/dbraw/zinc/65/90/50/1011659050.db2.gz ASDOEECQWSCYLA-PIIMJCKOSA-N 2 1 359.514 2.841 20 10 FFCDMP COc1ccc(N2CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c(OC)c1 ZINC001172122413 1011659059 /nfs/dbraw/zinc/65/90/59/1011659059.db2.gz ASDOEECQWSCYLA-PIIMJCKOSA-N 2 1 359.514 2.841 20 10 FFCDMP CC[NH+]1CCC([NH+]2CCC(C(=O)N[C@H](C)c3ccccc3O)CC2)CC1 ZINC000827946312 1019394881 /nfs/dbraw/zinc/39/48/81/1019394881.db2.gz DGMZEJINQMDCHX-MRXNPFEDSA-N 2 1 359.514 2.766 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNc3[nH+]cnc4[nH]ccc43)CC2)cc1 ZINC000726965455 1020559261 /nfs/dbraw/zinc/55/92/61/1020559261.db2.gz DIXUGHZWAXJKQH-UHFFFAOYSA-N 2 1 366.469 2.542 20 10 FFCDMP C[C@@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116409870 1021203833 /nfs/dbraw/zinc/20/38/33/1021203833.db2.gz ICLOUYYIKIYAKQ-HNAYVOBHSA-N 2 1 361.461 2.772 20 10 FFCDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000159848116 1022817622 /nfs/dbraw/zinc/81/76/22/1022817622.db2.gz ROMXLXKODXBLPJ-UHFFFAOYSA-N 2 1 364.486 2.691 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218484562 1033176733 /nfs/dbraw/zinc/17/67/33/1033176733.db2.gz HQUJLKBKXNEUKX-AVRDEDQJSA-N 2 1 351.494 2.996 20 10 FFCDMP CC(C)[N@@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3cc(O)ccc3O)CC[C@@H]21 ZINC001141160322 1025544183 /nfs/dbraw/zinc/54/41/83/1025544183.db2.gz VQRPZWJTNSRDPG-KPFFTGBYSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3cc(O)ccc3O)CC[C@@H]21 ZINC001141160322 1025544192 /nfs/dbraw/zinc/54/41/92/1025544192.db2.gz VQRPZWJTNSRDPG-KPFFTGBYSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@H+](Cc3cc(O)ccc3O)CC[C@@H]21 ZINC001141160322 1025544206 /nfs/dbraw/zinc/54/42/06/1025544206.db2.gz VQRPZWJTNSRDPG-KPFFTGBYSA-N 2 1 370.497 2.668 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@@H+](Cc3cc(O)ccc3O)CC[C@@H]21 ZINC001141160322 1025544223 /nfs/dbraw/zinc/54/42/23/1025544223.db2.gz VQRPZWJTNSRDPG-KPFFTGBYSA-N 2 1 370.497 2.668 20 10 FFCDMP Cc1c[nH+]c(NCc2ccc(N3CC[NH+](C)CC3)cc2)nc1NCC1CC1 ZINC001156650640 1029287827 /nfs/dbraw/zinc/28/78/27/1029287827.db2.gz AYMRIDANVXDUGM-UHFFFAOYSA-N 2 1 366.513 2.971 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCN(c4cccnc4)CC3)cc2)CC1 ZINC001139411085 1035094818 /nfs/dbraw/zinc/09/48/18/1035094818.db2.gz UDTAINZWQABJMI-UHFFFAOYSA-N 2 1 365.525 2.546 20 10 FFCDMP CCOC(=O)[C@H]1CCCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139413543 1035096442 /nfs/dbraw/zinc/09/64/42/1035096442.db2.gz WCHLLTWWZUGVRB-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cnc(OC)cc4C3)cc2)CC1 ZINC001140309717 1035429883 /nfs/dbraw/zinc/42/98/83/1035429883.db2.gz RVNUMCXTIPXKNJ-UHFFFAOYSA-N 2 1 366.509 2.790 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4cnc(OC)cc4C3)cc2)CC1 ZINC001140309717 1035429886 /nfs/dbraw/zinc/42/98/86/1035429886.db2.gz RVNUMCXTIPXKNJ-UHFFFAOYSA-N 2 1 366.509 2.790 20 10 FFCDMP Oc1c(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)cccc1OC(F)(F)F ZINC001233768697 1036752193 /nfs/dbraw/zinc/75/21/93/1036752193.db2.gz XCAUADOPAROYJQ-UHFFFAOYSA-N 2 1 373.419 2.504 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158841 1037389884 /nfs/dbraw/zinc/38/98/84/1037389884.db2.gz WGFGCXMJKSNBFY-JOCHJYFZSA-N 3 1 374.548 2.932 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158841 1037389896 /nfs/dbraw/zinc/38/98/96/1037389896.db2.gz WGFGCXMJKSNBFY-JOCHJYFZSA-N 2 1 374.548 2.932 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158841 1037389908 /nfs/dbraw/zinc/38/99/08/1037389908.db2.gz WGFGCXMJKSNBFY-JOCHJYFZSA-N 2 1 374.548 2.932 20 10 FFCDMP COc1ccccc1O[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235689515 1037684627 /nfs/dbraw/zinc/68/46/27/1037684627.db2.gz ZYFXOUKGQLOWDI-HXUWFJFHSA-N 2 1 367.493 2.758 20 10 FFCDMP Cc1cccc(C[NH+]2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1O ZINC001231591456 1037709092 /nfs/dbraw/zinc/70/90/92/1037709092.db2.gz CYCPZVHFBHDVLE-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1cccc(C[NH+]2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)c1O ZINC001231591456 1037709105 /nfs/dbraw/zinc/70/91/05/1037709105.db2.gz CYCPZVHFBHDVLE-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1cccc(C[N@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c1O ZINC001231591456 1037709117 /nfs/dbraw/zinc/70/91/17/1037709117.db2.gz CYCPZVHFBHDVLE-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1cccc(C[N@@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c1O ZINC001231591456 1037709133 /nfs/dbraw/zinc/70/91/33/1037709133.db2.gz CYCPZVHFBHDVLE-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236213009 1037989286 /nfs/dbraw/zinc/98/92/86/1037989286.db2.gz ARPCUUVPIPKOCI-ROUUACIJSA-N 2 1 364.486 2.816 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236213009 1037989297 /nfs/dbraw/zinc/98/92/97/1037989297.db2.gz ARPCUUVPIPKOCI-ROUUACIJSA-N 2 1 364.486 2.816 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4c(N)cccc4C3)cc2)CC1 ZINC001236361964 1038057749 /nfs/dbraw/zinc/05/77/49/1038057749.db2.gz CMGBRWYGORHXJK-UHFFFAOYSA-N 2 1 350.510 2.969 20 10 FFCDMP COc1cc(C)c(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001236808003 1038282137 /nfs/dbraw/zinc/28/21/37/1038282137.db2.gz JNURIHAMGNFUNJ-XMSQKQJNSA-N 2 1 374.525 2.890 20 10 FFCDMP COc1cc(C)c(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001236808003 1038282144 /nfs/dbraw/zinc/28/21/44/1038282144.db2.gz JNURIHAMGNFUNJ-XMSQKQJNSA-N 2 1 374.525 2.890 20 10 FFCDMP COc1cc(C)c(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001236808003 1038282152 /nfs/dbraw/zinc/28/21/52/1038282152.db2.gz JNURIHAMGNFUNJ-XMSQKQJNSA-N 2 1 374.525 2.890 20 10 FFCDMP C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943535 1038370120 /nfs/dbraw/zinc/37/01/20/1038370120.db2.gz SKPDGNDGZNKAQE-UHFFFAOYSA-N 2 1 371.456 2.938 20 10 FFCDMP C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236943535 1038370134 /nfs/dbraw/zinc/37/01/34/1038370134.db2.gz SKPDGNDGZNKAQE-UHFFFAOYSA-N 2 1 371.456 2.938 20 10 FFCDMP CCOC(=O)C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001237114168 1038446928 /nfs/dbraw/zinc/44/69/28/1038446928.db2.gz CKAKZFZITGDDBQ-PKOBYXMFSA-N 2 1 359.514 2.507 20 10 FFCDMP C[C@H]1C[C@H]([NH+]2CCCC2)CN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001261182125 1041052854 /nfs/dbraw/zinc/05/28/54/1041052854.db2.gz KKHJKDCSXKZSDN-HKUYNNGSSA-N 2 1 360.521 2.636 20 10 FFCDMP Cc1cc(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc(C)[nH+]1 ZINC001215828306 1041892506 /nfs/dbraw/zinc/89/25/06/1041892506.db2.gz FRQKALNDYBCIHS-IBGZPJMESA-N 2 1 355.486 2.611 20 10 FFCDMP COCCOC[N@@H+]1CCC2(C1)CC[NH+](Cc1c(C)cc(C)cc1O)CC2 ZINC001279433193 1043107411 /nfs/dbraw/zinc/10/74/11/1043107411.db2.gz SIOQNJOMTMRNJL-UHFFFAOYSA-N 2 1 362.514 2.917 20 10 FFCDMP COCCOC[N@H+]1CCC2(C1)CC[NH+](Cc1c(C)cc(C)cc1O)CC2 ZINC001279433193 1043107414 /nfs/dbraw/zinc/10/74/14/1043107414.db2.gz SIOQNJOMTMRNJL-UHFFFAOYSA-N 2 1 362.514 2.917 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCC12C[NH2+]C2 ZINC001237431301 1043156920 /nfs/dbraw/zinc/15/69/20/1043156920.db2.gz QODJLVGUVNOQHJ-HXUWFJFHSA-N 2 1 371.525 2.652 20 10 FFCDMP COc1cc(CN2CC3(CC[N@H+]3C3CCCC3)C2)cc(C[NH+](C)C)c1O ZINC001279698511 1043490633 /nfs/dbraw/zinc/49/06/33/1043490633.db2.gz MWJDVJXBIPWTAT-UHFFFAOYSA-N 2 1 359.514 2.665 20 10 FFCDMP Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001320203248 1045368076 /nfs/dbraw/zinc/36/80/76/1045368076.db2.gz PVFKJMITBHQIDS-FQEVSTJZSA-N 2 1 367.541 2.627 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3Cc4cccc(O)c4C3)cc2F)CC1 ZINC001324592870 1046117757 /nfs/dbraw/zinc/11/77/57/1046117757.db2.gz RXJNEWSBCXGTOU-KRWDZBQOSA-N 2 1 355.457 2.540 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCCO[C@H]3CCCCO3)cc2F)CC1 ZINC001332782676 1048560372 /nfs/dbraw/zinc/56/03/72/1048560372.db2.gz IMALAFIZBRWWGM-FQEVSTJZSA-N 2 1 365.493 2.600 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN(CC[NH3+])CCc3ccccc3)cc2F)CC1 ZINC001329433444 1048717858 /nfs/dbraw/zinc/71/78/58/1048717858.db2.gz OVPLKVDAYNJACK-UHFFFAOYSA-N 2 1 370.516 2.581 20 10 FFCDMP CC[NH+]1CCC([NH+]2CCC(C(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 ZINC000847297045 1055412500 /nfs/dbraw/zinc/41/25/00/1055412500.db2.gz YJYSDTVFENTXJG-UHFFFAOYSA-N 2 1 372.557 2.565 20 10 FFCDMP Cc1ccccc1[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001560327271 1076264769 /nfs/dbraw/zinc/26/47/69/1076264769.db2.gz DDAQQQYYWAYZAZ-NRFANRHFSA-N 2 1 357.473 2.709 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CO)CCc3ccccc3)cc2F)CC1 ZINC001560594233 1076282682 /nfs/dbraw/zinc/28/26/82/1076282682.db2.gz GMSNQTYWCGAJBA-FQEVSTJZSA-N 2 1 371.500 2.661 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)[NH+](C)C)C1 ZINC000443921900 514072705 /nfs/dbraw/zinc/07/27/05/514072705.db2.gz PJAADYKXCBCBIL-UHFFFAOYSA-N 2 1 370.541 2.864 20 10 FFCDMP CCN1CC[NH+](CCCC[NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000858096934 730416457 /nfs/dbraw/zinc/41/64/57/730416457.db2.gz UAHIXGLQBYJEQH-UHFFFAOYSA-N 2 1 354.489 2.538 20 10 FFCDMP COCC[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 ZINC000792942761 739721017 /nfs/dbraw/zinc/72/10/17/739721017.db2.gz OOELTEDDFFMFMR-UHFFFAOYSA-N 2 1 359.436 2.972 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1O ZINC000843059184 747757550 /nfs/dbraw/zinc/75/75/50/747757550.db2.gz FNXMXIARYOLRTI-ZLKJLUDKSA-N 2 1 355.276 2.723 20 10 FFCDMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877495828 1014600355 /nfs/dbraw/zinc/60/03/55/1014600355.db2.gz HHCWKCVVMLCEGN-UHFFFAOYSA-N 2 1 357.542 2.956 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1O ZINC001205996036 1032100588 /nfs/dbraw/zinc/10/05/88/1032100588.db2.gz UBZLOASGUMMLBV-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP O[C@H]1CC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2)C1 ZINC000922240859 988234080 /nfs/dbraw/zinc/23/40/80/988234080.db2.gz SBESXTKSERYFON-NRFANRHFSA-N 2 1 352.478 2.868 20 10 FFCDMP CCOc1ccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC000769191530 1000448130 /nfs/dbraw/zinc/44/81/30/1000448130.db2.gz DCOWLOZNARJSPS-ROUUACIJSA-N 2 1 361.530 2.781 20 10 FFCDMP CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775738528 1003927489 /nfs/dbraw/zinc/92/74/89/1003927489.db2.gz GUFKRTFQWWEXMI-LJQANCHMSA-N 2 1 373.541 2.994 20 10 FFCDMP [NH3+][C@H]1CCCCC[C@H]1NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918324 1007810919 /nfs/dbraw/zinc/81/09/19/1007810919.db2.gz YRSHSKREEJTCKF-FCHUYYIVSA-N 2 1 356.558 2.968 20 10 FFCDMP Oc1ccc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1 ZINC001141158709 1025540967 /nfs/dbraw/zinc/54/09/67/1025540967.db2.gz KPMFFEDDQJEKQJ-UHFFFAOYSA-N 2 1 353.466 2.981 20 10 FFCDMP c1nc(C2C[NH2+]C2)cc(N2CCCC3=C[C@H]4C[C@H](C[N@H+]5CCCC[C@H]45)[C@@H]32)n1 ZINC001155645727 1028832128 /nfs/dbraw/zinc/83/21/28/1028832128.db2.gz LNXMMBHYWLIIPZ-VTAPXXACSA-N 2 1 365.525 2.563 20 10 FFCDMP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001205725001 1031956819 /nfs/dbraw/zinc/95/68/19/1031956819.db2.gz BYCDHNHYOXWQQM-NRFANRHFSA-N 2 1 356.466 2.647 20 10 FFCDMP COc1cc(C[N@@H+](C)CCc2noc(C(C)C)n2)cc(C[NH+](C)C)c1O ZINC001139256327 1035029617 /nfs/dbraw/zinc/02/96/17/1035029617.db2.gz YRSPRBXNNVIWQL-UHFFFAOYSA-N 2 1 362.474 2.643 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)[C@@H]1C ZINC001140303768 1035426177 /nfs/dbraw/zinc/42/61/77/1035426177.db2.gz AEWFGTDUVQKLJP-NQIIRXRSSA-N 2 1 373.541 2.992 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C(=O)OC)[C@@H]3C)cc2)CC1 ZINC001140304288 1035426406 /nfs/dbraw/zinc/42/64/06/1035426406.db2.gz LXQWSJNGFMMIEU-PXNSSMCTSA-N 2 1 359.514 2.602 20 10 FFCDMP C[NH+](C)CCN1CC[N@@H+](Cc2cccc(-c3ccccc3)c2O)CCC1=O ZINC001234997072 1037288897 /nfs/dbraw/zinc/28/88/97/1037288897.db2.gz QQEKEOWVMUKVDO-UHFFFAOYSA-N 2 1 367.493 2.655 20 10 FFCDMP COC(=O)[C@]12C[C@@H]3C[NH2+]C[C@@H]3[C@H]1C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001235334288 1037486605 /nfs/dbraw/zinc/48/66/05/1037486605.db2.gz KRCFBTSFPGJJRA-WHEACTPUSA-N 2 1 372.509 2.520 20 10 FFCDMP Cc1ccc(CN2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235690406 1037687200 /nfs/dbraw/zinc/68/72/00/1037687200.db2.gz GEXJBZAITQUGFD-UHFFFAOYSA-N 2 1 364.537 2.722 20 10 FFCDMP C[C@@H](c1ccccc1)N1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235864382 1037803715 /nfs/dbraw/zinc/80/37/15/1037803715.db2.gz QDQJQHSJMYGMIA-KRWDZBQOSA-N 2 1 367.493 2.753 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CCC[C@]23CCN(CC[NH+](C)C)C3=O)c(O)c1 ZINC001277975421 1037808117 /nfs/dbraw/zinc/80/81/17/1037808117.db2.gz FLUWXDXKSMYQPJ-OAQYLSRUSA-N 2 1 359.514 2.644 20 10 FFCDMP Cn1ncc2c1CCC[C@H]2[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254018098 1040521539 /nfs/dbraw/zinc/52/15/39/1040521539.db2.gz DBSPLCMABASLJF-LJQANCHMSA-N 2 1 371.504 2.820 20 10 FFCDMP Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254018098 1040521555 /nfs/dbraw/zinc/52/15/55/1040521555.db2.gz DBSPLCMABASLJF-LJQANCHMSA-N 2 1 371.504 2.820 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(O)c1 ZINC001249208636 1040629165 /nfs/dbraw/zinc/62/91/65/1040629165.db2.gz ZNFDMJOUIHSPRQ-OALUTQOASA-N 2 1 360.498 2.947 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)c(O)c1 ZINC001249208636 1040629179 /nfs/dbraw/zinc/62/91/79/1040629179.db2.gz ZNFDMJOUIHSPRQ-OALUTQOASA-N 2 1 360.498 2.947 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)c(O)c1 ZINC001249208636 1040629188 /nfs/dbraw/zinc/62/91/88/1040629188.db2.gz ZNFDMJOUIHSPRQ-OALUTQOASA-N 2 1 360.498 2.947 20 10 FFCDMP COc1cc(C)c(C[NH2+][C@@]23CC[C@@]([NH2+]CCN(C)C)(C2)CCC3)c(O)c1 ZINC001279666542 1043431870 /nfs/dbraw/zinc/43/18/70/1043431870.db2.gz DFVXWKNRWCXQHV-RTWAWAEBSA-N 2 1 361.530 2.795 20 10 FFCDMP COc1cc(C[NH+]2C[C@@H]3CC[N@@H+](C)CC[C@@H]3C2)c(O)cc1Br ZINC001279671664 1043441248 /nfs/dbraw/zinc/44/12/48/1043441248.db2.gz CPBBHEWMELHUNV-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP COc1cc(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)c(O)cc1Br ZINC001279671664 1043441257 /nfs/dbraw/zinc/44/12/57/1043441257.db2.gz CPBBHEWMELHUNV-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP CC(C)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1(CO)CCC1 ZINC001324113994 1045871763 /nfs/dbraw/zinc/87/17/63/1045871763.db2.gz SSYMTRIOHWUMHB-HXUWFJFHSA-N 2 1 363.521 2.854 20 10 FFCDMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001462191194 1061531912 /nfs/dbraw/zinc/53/19/12/1061531912.db2.gz IASLJIKSPZPYQP-QGZVFWFLSA-N 2 1 368.516 2.879 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3cn4ccccc4n3)cc2F)CC1 ZINC001560258780 1076256919 /nfs/dbraw/zinc/25/69/19/1076256919.db2.gz BGUCGHZEIIIANT-UHFFFAOYSA-N 2 1 367.472 2.558 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c(O)c1 ZINC001560925638 1076309988 /nfs/dbraw/zinc/30/99/88/1076309988.db2.gz PUKQTBPFMYROCF-SFHVURJKSA-N 2 1 356.466 2.566 20 10 FFCDMP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000093132719 508123037 /nfs/dbraw/zinc/12/30/37/508123037.db2.gz UYJIKRPLYGTOQN-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1 ZINC000186520142 509750772 /nfs/dbraw/zinc/75/07/72/509750772.db2.gz JQGLKJOTEGXQKO-YJBOKZPZSA-N 2 1 356.466 2.818 20 10 FFCDMP C[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1ccc(Br)cc1O ZINC000185367385 510823937 /nfs/dbraw/zinc/82/39/37/510823937.db2.gz BJIRLGIAMCSBBR-CQSZACIVSA-N 2 1 370.335 2.833 20 10 FFCDMP COc1c(O)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000278501757 510995285 /nfs/dbraw/zinc/99/52/85/510995285.db2.gz NYPKRJLUNWKMLL-UHFFFAOYSA-N 2 1 372.425 2.710 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Cc4nccs4)C3)cc2)CC1 ZINC000898071778 735309991 /nfs/dbraw/zinc/30/99/91/735309991.db2.gz SHRGUCREXMTSNK-GOSISDBHSA-N 2 1 356.539 2.960 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@@H+](C)CCCN(C)CC[NH+](C)C)c1O ZINC000808781602 741260096 /nfs/dbraw/zinc/26/00/96/741260096.db2.gz KDJRLZIPXQJQCX-UHFFFAOYSA-N 2 1 355.910 2.564 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@H+](C)CCCN(C)CC[NH+](C)C)c1O ZINC000808781602 741260099 /nfs/dbraw/zinc/26/00/99/741260099.db2.gz KDJRLZIPXQJQCX-UHFFFAOYSA-N 2 1 355.910 2.564 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781455 1014391375 /nfs/dbraw/zinc/39/13/75/1014391375.db2.gz LTYUPTDJRWPICM-HXUWFJFHSA-N 2 1 357.542 2.811 20 10 FFCDMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781455 1014391385 /nfs/dbraw/zinc/39/13/85/1014391385.db2.gz LTYUPTDJRWPICM-HXUWFJFHSA-N 2 1 357.542 2.811 20 10 FFCDMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781455 1014391396 /nfs/dbraw/zinc/39/13/96/1014391396.db2.gz LTYUPTDJRWPICM-HXUWFJFHSA-N 2 1 357.542 2.811 20 10 FFCDMP C[C@@H](NC(=O)CC1([NH3+])CC[NH+](Cc2ccccc2)CC1)c1ccccc1O ZINC000877255413 1014529261 /nfs/dbraw/zinc/52/92/61/1014529261.db2.gz COBYMYITPWLBRO-QGZVFWFLSA-N 2 1 367.493 2.953 20 10 FFCDMP CCOc1cccc(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1O ZINC000922394146 988555962 /nfs/dbraw/zinc/55/59/62/988555962.db2.gz VNDSXXHFBSHVFO-JYWFKMLOSA-N 2 1 362.514 2.750 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCCn3cc[nH+]c3C)CC2)c(OC)c1 ZINC000879462190 1015547332 /nfs/dbraw/zinc/54/73/32/1015547332.db2.gz MGLAOGYQDGOEDP-UHFFFAOYSA-N 2 1 358.486 2.811 20 10 FFCDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)CC1 ZINC000809755205 994604122 /nfs/dbraw/zinc/60/41/22/994604122.db2.gz ICKUMBBQWLNZDD-NRFANRHFSA-N 3 1 356.558 2.602 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CC[C@H](C4CC[NH+](C)CC4)C3)cc2)CC1 ZINC000809755205 994604127 /nfs/dbraw/zinc/60/41/27/994604127.db2.gz ICKUMBBQWLNZDD-NRFANRHFSA-N 2 1 356.558 2.602 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CC[C@H](C4CC[NH+](C)CC4)C3)cc2)CC1 ZINC000809755205 994604134 /nfs/dbraw/zinc/60/41/34/994604134.db2.gz ICKUMBBQWLNZDD-NRFANRHFSA-N 2 1 356.558 2.602 20 10 FFCDMP CC(C)[N@@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC000903884136 1016287681 /nfs/dbraw/zinc/28/76/81/1016287681.db2.gz SMWUZPCIXPRRNY-LJQANCHMSA-N 2 1 356.518 2.679 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](c2ccccc2)C1 ZINC000775633243 1004883841 /nfs/dbraw/zinc/88/38/41/1004883841.db2.gz GJQTZOPOJYOGMJ-HSZRJFAPSA-N 2 1 364.537 2.927 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCN(CC(F)(F)F)CC3)cc2)CC1 ZINC000775649291 1004936794 /nfs/dbraw/zinc/93/67/94/1004936794.db2.gz NFTCNLWUMQLNJJ-UHFFFAOYSA-N 2 1 370.463 2.508 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CO)c3ccc(F)cc3F)cc2)CC1 ZINC000850410027 1005813651 /nfs/dbraw/zinc/81/36/51/1005813651.db2.gz DUTMZQAZQBDOKD-HXUWFJFHSA-N 2 1 361.436 2.540 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552188 1007881268 /nfs/dbraw/zinc/88/12/68/1007881268.db2.gz IWFBJEKQFIWTDG-HXUWFJFHSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552188 1007881274 /nfs/dbraw/zinc/88/12/74/1007881274.db2.gz IWFBJEKQFIWTDG-HXUWFJFHSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552188 1007881279 /nfs/dbraw/zinc/88/12/79/1007881279.db2.gz IWFBJEKQFIWTDG-HXUWFJFHSA-N 2 1 371.481 2.901 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc(Cl)c(C)cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136104 1032779567 /nfs/dbraw/zinc/77/95/67/1032779567.db2.gz NJABFDMFEYPTJP-KXBFYZLASA-N 2 1 366.889 2.719 20 10 FFCDMP CC(C)(C)[NH2+]CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001116407591 1021201341 /nfs/dbraw/zinc/20/13/41/1021201341.db2.gz PKZXBWBCNJEEBQ-HNNXBMFYSA-N 2 1 353.894 2.514 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4[nH]c(=O)ccc43)cc2F)CC1 ZINC001117583740 1021767608 /nfs/dbraw/zinc/76/76/08/1021767608.db2.gz WRMHJILCPAHPIB-SFHVURJKSA-N 2 1 370.472 2.845 20 10 FFCDMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccc3c(c2)OCCN3C)CC1 ZINC001141141579 1025509167 /nfs/dbraw/zinc/50/91/67/1025509167.db2.gz SODJHGSYALFPJF-UHFFFAOYSA-N 2 1 352.482 2.958 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNc3[nH+]cc(C)cc3N)CC2)cc1 ZINC001156260789 1029116387 /nfs/dbraw/zinc/11/63/87/1029116387.db2.gz LYCRKZNKFLMSDP-UHFFFAOYSA-N 2 1 355.486 2.605 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)cc1 ZINC000841041706 1029995227 /nfs/dbraw/zinc/99/52/27/1029995227.db2.gz AMKMROXPFZFPFP-OAQYLSRUSA-N 2 1 367.472 2.926 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)cc2)CC1 ZINC001204735422 1031421450 /nfs/dbraw/zinc/42/14/50/1031421450.db2.gz UKEUSYUNLIGZCR-UHFFFAOYSA-N 3 1 356.558 2.794 20 10 FFCDMP [NH3+]C[C@]1(O)CCC[N@@H+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001205247358 1031624635 /nfs/dbraw/zinc/62/46/35/1031624635.db2.gz FQHOGIGKXHWQJY-NRFANRHFSA-N 2 1 356.466 2.647 20 10 FFCDMP [NH3+]C[C@@H]1C[N@@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC1(F)F ZINC001205769782 1031983929 /nfs/dbraw/zinc/98/39/29/1031983929.db2.gz KOFZAPUQRVKJHF-OAHLLOKOSA-N 2 1 351.441 2.507 20 10 FFCDMP COC(=O)c1cccc(C[N@@H+](C)Cc2cc(C[NH+](C)C)c(O)c(OC)c2)c1 ZINC001139259341 1035031043 /nfs/dbraw/zinc/03/10/43/1035031043.db2.gz RVIZKVNNCXYPBB-UHFFFAOYSA-N 2 1 372.465 2.881 20 10 FFCDMP COc1cc(C[N@@H+](C)C[C@@H]2Cc3ccccc3O2)cc(C[NH+](C)C)c1O ZINC001139259460 1035031106 /nfs/dbraw/zinc/03/11/06/1035031106.db2.gz BUODTFOVSAVUDC-SFHVURJKSA-N 2 1 356.466 2.898 20 10 FFCDMP COc1cc(CN2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257660 1035031944 /nfs/dbraw/zinc/03/19/44/1035031944.db2.gz ZWVBASAIUOHLQJ-FQEVSTJZSA-N 2 1 369.509 2.951 20 10 FFCDMP COc1cc(C[N@@H+]2CCN(C)[C@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257660 1035031958 /nfs/dbraw/zinc/03/19/58/1035031958.db2.gz ZWVBASAIUOHLQJ-FQEVSTJZSA-N 2 1 369.509 2.951 20 10 FFCDMP COc1cc(C[N@H+]2CCN(C)[C@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257660 1035031962 /nfs/dbraw/zinc/03/19/62/1035031962.db2.gz ZWVBASAIUOHLQJ-FQEVSTJZSA-N 2 1 369.509 2.951 20 10 FFCDMP Cc1cccnc1O[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411377 1035095550 /nfs/dbraw/zinc/09/55/50/1035095550.db2.gz ITQJDZNIUIUTHE-NRFANRHFSA-N 2 1 366.509 2.795 20 10 FFCDMP C[N@H+](Cc1ccc(N2CCOCC2)c(Cl)c1)CC1CC[NH+](C)CC1 ZINC001232203070 1035498390 /nfs/dbraw/zinc/49/83/90/1035498390.db2.gz NMCXAQQWIXWEAO-UHFFFAOYSA-N 2 1 351.922 2.950 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCN[C@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789852 1037745671 /nfs/dbraw/zinc/74/56/71/1037745671.db2.gz KXHKDKLOHCTODS-SFHVURJKSA-N 2 1 373.884 2.674 20 10 FFCDMP Oc1cc2c(cc1CN1CC[NH2+][C@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789852 1037745687 /nfs/dbraw/zinc/74/56/87/1037745687.db2.gz KXHKDKLOHCTODS-SFHVURJKSA-N 2 1 373.884 2.674 20 10 FFCDMP c1nn(-c2ccccc2)c2c1C[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001235791988 1037746681 /nfs/dbraw/zinc/74/66/81/1037746681.db2.gz SZMJWLKQZKVKSF-UHFFFAOYSA-N 2 1 373.504 2.840 20 10 FFCDMP c1nn(-c2ccccc2)c2c1C[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001235791988 1037746698 /nfs/dbraw/zinc/74/66/98/1037746698.db2.gz SZMJWLKQZKVKSF-UHFFFAOYSA-N 2 1 373.504 2.840 20 10 FFCDMP CC[N@@H+](CCc1ccc(OC)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236302664 1038032967 /nfs/dbraw/zinc/03/29/67/1038032967.db2.gz AJNJWSOZWNIWCN-UHFFFAOYSA-N 2 1 369.509 2.875 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@H]3CCC[N@@H+](C4CCCC4)C3)cc2)CC1 ZINC001256898911 1038650200 /nfs/dbraw/zinc/65/02/00/1038650200.db2.gz AOHYUWKDWLSSBB-FQEVSTJZSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@H]3CCC[N@H+](C4CCCC4)C3)cc2)CC1 ZINC001256898911 1038650203 /nfs/dbraw/zinc/65/02/03/1038650203.db2.gz AOHYUWKDWLSSBB-FQEVSTJZSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH2+]CC[C@H](C)[N@H+]1CCC[C@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700987 1039441854 /nfs/dbraw/zinc/44/18/54/1039441854.db2.gz HYRWZTYYOYSABC-GHTZIAJQSA-N 2 1 361.530 2.612 20 10 FFCDMP Cc1cccc(C[N@@H+]2C[C@@H]3CC[NH+](CCn4ccnc4)CC[C@@H]3C2)c1O ZINC001279290215 1042985427 /nfs/dbraw/zinc/98/54/27/1042985427.db2.gz JBCLFSVKUNWODJ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1cccc(C[NH+]2C[C@@H]3CC[N@@H+](CCn4ccnc4)CC[C@@H]3C2)c1O ZINC001279290215 1042985430 /nfs/dbraw/zinc/98/54/30/1042985430.db2.gz JBCLFSVKUNWODJ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP Cc1cccc(C[NH+]2C[C@@H]3CC[N@H+](CCn4ccnc4)CC[C@@H]3C2)c1O ZINC001279290215 1042985434 /nfs/dbraw/zinc/98/54/34/1042985434.db2.gz JBCLFSVKUNWODJ-KDURUIRLSA-N 2 1 354.498 2.741 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(O)CCc4ccccc43)cc2F)CC1 ZINC001319640491 1045225329 /nfs/dbraw/zinc/22/53/29/1045225329.db2.gz QDCPDYGDALNLJM-QFIPXVFZSA-N 2 1 369.484 2.501 20 10 FFCDMP COc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C[C@H]4CCCO4)CC3)C2)cc1 ZINC000848552450 1060264069 /nfs/dbraw/zinc/26/40/69/1060264069.db2.gz BMDHXBSDAODKEA-XMSQKQJNSA-N 2 1 373.541 2.755 20 10 FFCDMP COc1ccc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001461001814 1061182622 /nfs/dbraw/zinc/18/26/22/1061182622.db2.gz OBRCACBBYVEEBG-UHFFFAOYSA-N 2 1 357.473 2.918 20 10 FFCDMP COc1cccc(O)c1C[NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000725841475 734395794 /nfs/dbraw/zinc/39/57/94/734395794.db2.gz JVLXVYUJSQWAAC-MRXNPFEDSA-N 2 1 361.511 2.541 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817864726 742219226 /nfs/dbraw/zinc/21/92/26/742219226.db2.gz BAYDITDTRDBMIC-GVXVVHGQSA-N 2 1 357.292 2.969 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817864726 742219224 /nfs/dbraw/zinc/21/92/24/742219224.db2.gz BAYDITDTRDBMIC-GVXVVHGQSA-N 2 1 357.292 2.969 20 10 FFCDMP CN(Cc1cccs1)c1ccc(C[NH2+]C[C@H](O)C[NH+]2CCCC2)cc1 ZINC000823697446 742963676 /nfs/dbraw/zinc/96/36/76/742963676.db2.gz KAQFNTXDFYPYAC-IBGZPJMESA-N 2 1 359.539 2.931 20 10 FFCDMP COc1cc(C[NH2+]CCC[NH+]2CCC(O)CC2)c(O)c(C(C)(C)C)c1 ZINC000850072429 749295947 /nfs/dbraw/zinc/29/59/47/749295947.db2.gz XEHIGGYZLSHCSE-UHFFFAOYSA-N 2 1 350.503 2.635 20 10 FFCDMP Cc1cccc(O)c1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000877028189 1014454375 /nfs/dbraw/zinc/45/43/75/1014454375.db2.gz VRSDFDXLNATYLN-IBGZPJMESA-N 2 1 367.493 2.688 20 10 FFCDMP Cc1noc(C[C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000897579001 982310552 /nfs/dbraw/zinc/31/05/52/982310552.db2.gz LQWVCWBTJLXYFB-LJQANCHMSA-N 2 1 369.513 2.585 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388490 988535166 /nfs/dbraw/zinc/53/51/66/988535166.db2.gz FGMYHSSWSVYOKW-LMCOJAPRSA-N 2 1 367.484 2.600 20 10 FFCDMP CC[N@@H+](C)CCC(=O)N1C[C@@H](C[NH2+]Cc2ccc(OC)c(C)c2)[C@H](C)C1 ZINC001106839670 989556513 /nfs/dbraw/zinc/55/65/13/989556513.db2.gz NHAFODJXXGBRCP-IEBWSBKVSA-N 2 1 361.530 2.530 20 10 FFCDMP CCOc1cccc(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000702601502 990009609 /nfs/dbraw/zinc/00/96/09/990009609.db2.gz IJKIOSMKGPUZJN-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1cccc(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000702601502 990009619 /nfs/dbraw/zinc/00/96/19/990009619.db2.gz IJKIOSMKGPUZJN-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP CN(C)c1ccc(C[N@@H+](C)CCCN2CC[NH+](C)CC2)c(C(F)(F)F)c1 ZINC000809742970 994601337 /nfs/dbraw/zinc/60/13/37/994601337.db2.gz OXMKBQUKBWONDI-UHFFFAOYSA-N 2 1 372.479 2.841 20 10 FFCDMP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001199219426 1004873216 /nfs/dbraw/zinc/87/32/16/1004873216.db2.gz NAKAZKGJPTWAHI-UHFFFAOYSA-N 3 1 370.516 2.929 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850508381 1005819321 /nfs/dbraw/zinc/81/93/21/1005819321.db2.gz MDKVNYWUFAYXMF-MAUKXSAKSA-N 2 1 356.466 2.818 20 10 FFCDMP Cc1cc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1N(C)C ZINC000815076032 1006508365 /nfs/dbraw/zinc/50/83/65/1006508365.db2.gz VCDWBOZSKAWHCS-WCRBZPEASA-N 2 1 356.558 2.804 20 10 FFCDMP C[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000854231890 1006734894 /nfs/dbraw/zinc/73/48/94/1006734894.db2.gz OMYWZXVWQFGVOP-CYBMUJFWSA-N 2 1 359.449 2.621 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1O ZINC001119446514 1022772328 /nfs/dbraw/zinc/77/23/28/1022772328.db2.gz ZLRVKXYWHBGFLD-IBGZPJMESA-N 2 1 356.466 2.566 20 10 FFCDMP [NH3+]Cc1cn([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)nn1 ZINC000841100082 1030038227 /nfs/dbraw/zinc/03/82/27/1030038227.db2.gz SYGGHHFETCLHKE-HXUWFJFHSA-N 2 1 354.502 2.564 20 10 FFCDMP Cc1cc(Br)cc(C[NH+]2CCN(CCC[NH+](C)C)CC2)c1O ZINC001233109855 1036356249 /nfs/dbraw/zinc/35/62/49/1036356249.db2.gz IKGUNYOIGUVPCN-UHFFFAOYSA-N 2 1 370.335 2.532 20 10 FFCDMP [NH3+]C1CN([C@@H]2CCC[N@@H+](Cc3cc(OCc4ccccc4)ccc3O)C2)C1 ZINC001236079939 1037924649 /nfs/dbraw/zinc/92/46/49/1037924649.db2.gz ULTIGUUDVBIRAJ-HXUWFJFHSA-N 2 1 367.493 2.579 20 10 FFCDMP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246175049 1039266616 /nfs/dbraw/zinc/26/66/16/1039266616.db2.gz RVPJUULFMYMCAC-IFMALSPDSA-N 3 1 350.510 2.679 20 10 FFCDMP CN(C)CC[N@@H+]1CC[C@H]2C[NH+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490681 1039865139 /nfs/dbraw/zinc/86/51/39/1039865139.db2.gz JRJRGPVXIRLBQU-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP CN(C)CC[NH+]1CC[C@H]2C[N@@H+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490681 1039865162 /nfs/dbraw/zinc/86/51/62/1039865162.db2.gz JRJRGPVXIRLBQU-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP CN(C)CC[NH+]1CC[C@H]2C[N@H+](Cc3c(O)cccc3Cl)C[C@H]2CC1 ZINC001278490681 1039865190 /nfs/dbraw/zinc/86/51/90/1039865190.db2.gz JRJRGPVXIRLBQU-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCOCC4)[C@H]3C3CC3)cc2F)CC1 ZINC001261245687 1041097079 /nfs/dbraw/zinc/09/70/79/1041097079.db2.gz LOPDRJLSQTWBBC-OAQYLSRUSA-N 2 1 373.516 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCOCC4)[C@H]3C3CC3)cc2F)CC1 ZINC001261245687 1041097098 /nfs/dbraw/zinc/09/70/98/1041097098.db2.gz LOPDRJLSQTWBBC-OAQYLSRUSA-N 2 1 373.516 2.969 20 10 FFCDMP CN(C)CC[N@@H+]1CC[C@H]2C[NH+](Cc3cc(Cl)ccc3O)C[C@H]2CC1 ZINC001278568628 1041202976 /nfs/dbraw/zinc/20/29/76/1041202976.db2.gz CHMLMZINFJXERM-IYBDPMFKSA-N 2 1 351.922 2.751 20 10 FFCDMP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC001278568972 1041207472 /nfs/dbraw/zinc/20/74/72/1041207472.db2.gz LVGJWCCHZLTJDE-IBGZPJMESA-N 2 1 351.922 2.895 20 10 FFCDMP CN(C)c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4cn[nH]c4)C3)CC2)cc1 ZINC001279149386 1042920395 /nfs/dbraw/zinc/92/03/95/1042920395.db2.gz GIMDUYFYAMCGHL-UHFFFAOYSA-N 2 1 353.514 2.964 20 10 FFCDMP COCCOC[N@@H+]1CCCC2(CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001279289957 1042985337 /nfs/dbraw/zinc/98/53/37/1042985337.db2.gz CMYYHIBHRMZRQP-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP COCCOC[N@H+]1CCCC2(CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001279289957 1042985340 /nfs/dbraw/zinc/98/53/40/1042985340.db2.gz CMYYHIBHRMZRQP-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP Cc1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338725 1043011290 /nfs/dbraw/zinc/01/12/90/1043011290.db2.gz PKKYVSAYOJSWMS-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338725 1043011292 /nfs/dbraw/zinc/01/12/92/1043011292.db2.gz PKKYVSAYOJSWMS-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338725 1043011295 /nfs/dbraw/zinc/01/12/95/1043011295.db2.gz PKKYVSAYOJSWMS-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP CCOC(=O)[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC12C[NH2+]C2 ZINC001237432175 1043158159 /nfs/dbraw/zinc/15/81/59/1043158159.db2.gz UIQPYTZCZGPPOC-GFCCVEGCSA-N 2 1 373.280 2.674 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC12C[NH2+]C2 ZINC001237432175 1043158164 /nfs/dbraw/zinc/15/81/64/1043158164.db2.gz UIQPYTZCZGPPOC-GFCCVEGCSA-N 2 1 373.280 2.674 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCC[N@@H+](C)C4)CC3)cc2)CC1 ZINC001279709758 1043509810 /nfs/dbraw/zinc/50/98/10/1043509810.db2.gz JFCCCDVOGVPORH-UHFFFAOYSA-N 3 1 356.558 2.746 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CCC[N@H+](C)C4)CC3)cc2)CC1 ZINC001279709758 1043509820 /nfs/dbraw/zinc/50/98/20/1043509820.db2.gz JFCCCDVOGVPORH-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CCC[N@@H+](C)C4)CC3)cc2)CC1 ZINC001279709758 1043509833 /nfs/dbraw/zinc/50/98/33/1043509833.db2.gz JFCCCDVOGVPORH-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH+](C)C4)C3)cc2)CC1 ZINC001279709565 1043510210 /nfs/dbraw/zinc/51/02/10/1043510210.db2.gz HKAGTLVZQSYIJM-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC[C@@]4(CCC[N@H+](C)C4)C3)cc2)CC1 ZINC001279709565 1043510221 /nfs/dbraw/zinc/51/02/21/1043510221.db2.gz HKAGTLVZQSYIJM-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC[C@@]4(CCC[N@@H+](C)C4)C3)cc2)CC1 ZINC001279709565 1043510229 /nfs/dbraw/zinc/51/02/29/1043510229.db2.gz HKAGTLVZQSYIJM-JOCHJYFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC001324398631 1046004656 /nfs/dbraw/zinc/00/46/56/1046004656.db2.gz VPTQWTZIXUJREI-JOCHJYFZSA-N 2 1 356.558 2.887 20 10 FFCDMP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CCOCC2 ZINC001326339019 1046882874 /nfs/dbraw/zinc/88/28/74/1046882874.db2.gz OBJDSCVCVLFJSS-KRWDZBQOSA-N 2 1 361.505 2.969 20 10 FFCDMP C[C@H]1CC2(C[N@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CCOCC2 ZINC001326339019 1046882890 /nfs/dbraw/zinc/88/28/90/1046882890.db2.gz OBJDSCVCVLFJSS-KRWDZBQOSA-N 2 1 361.505 2.969 20 10 FFCDMP CO[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)Cc1ccccc1 ZINC001327953840 1048108351 /nfs/dbraw/zinc/10/83/51/1048108351.db2.gz ZQDASTJSCQIFBG-FQEVSTJZSA-N 2 1 371.500 2.925 20 10 FFCDMP C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001328086416 1048171030 /nfs/dbraw/zinc/17/10/30/1048171030.db2.gz SDVBVVKEEJTOSJ-VGSWGCGISA-N 2 1 371.500 2.832 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@](C)(O)c1ccccc1 ZINC001332002239 1048204121 /nfs/dbraw/zinc/20/41/21/1048204121.db2.gz CKBYDHGIIKDDDE-QFIPXVFZSA-N 2 1 371.500 2.917 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@](C)(O)c1ccccc1 ZINC001332002239 1048204134 /nfs/dbraw/zinc/20/41/34/1048204134.db2.gz CKBYDHGIIKDDDE-QFIPXVFZSA-N 2 1 371.500 2.917 20 10 FFCDMP Cc1cccc2c1OC[C@@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)C2 ZINC001343504855 1052272210 /nfs/dbraw/zinc/27/22/10/1052272210.db2.gz ZLCXRPLZVQOXBU-IBGZPJMESA-N 2 1 369.484 2.979 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCCC(=O)OC(C)(C)C)cc2F)CC1 ZINC001345918652 1052669932 /nfs/dbraw/zinc/66/99/32/1052669932.db2.gz IFAVMWQKNUEIOB-UHFFFAOYSA-N 2 1 365.493 2.789 20 10 FFCDMP c1ccc(CN2CCc3cc(C[NH2+]C[C@H]4C[NH2+]CCCO4)ccc32)cc1 ZINC001580892697 1078887903 /nfs/dbraw/zinc/88/79/03/1078887903.db2.gz CHUGFALWRCBWPO-OAQYLSRUSA-N 2 1 351.494 2.717 20 10 FFCDMP Cc1ncc2c(n1)CCC[C@H]2[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001560328108 1076264622 /nfs/dbraw/zinc/26/46/22/1076264622.db2.gz GWKJSISAFBEGBX-LJQANCHMSA-N 2 1 369.488 2.843 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c2cc(F)ccc2n1C ZINC001560933550 1076310775 /nfs/dbraw/zinc/31/07/75/1076310775.db2.gz SDONYBVRFRSXMK-AWEZNQCLSA-N 2 1 361.461 2.926 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c2cc(F)ccc2n1C ZINC001560933550 1076310783 /nfs/dbraw/zinc/31/07/83/1076310783.db2.gz SDONYBVRFRSXMK-AWEZNQCLSA-N 2 1 361.461 2.926 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+](C)CCN(C)C2CC[NH+](C)CC2)c1O ZINC000289404877 511100521 /nfs/dbraw/zinc/10/05/21/511100521.db2.gz HAHUDQOBCCTCQC-UHFFFAOYSA-N 2 1 355.910 2.512 20 10 FFCDMP CC[C@@H]([NH2+]C[C@@]1(COC)CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817975008 742226203 /nfs/dbraw/zinc/22/62/03/742226203.db2.gz PTXXMQATVDFFQH-GDBMZVCRSA-N 2 1 357.292 2.964 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3cccc(Br)c3O)CC2)C1 ZINC000841102871 747270285 /nfs/dbraw/zinc/27/02/85/747270285.db2.gz ANJVBDXAUPZILU-ZBFHGGJFSA-N 2 1 369.303 2.873 20 10 FFCDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877528779 1014613799 /nfs/dbraw/zinc/61/37/99/1014613799.db2.gz KEHLWHOTNXHAIW-HXUWFJFHSA-N 2 1 357.542 2.811 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000702604882 990009690 /nfs/dbraw/zinc/00/96/90/990009690.db2.gz ZZTRKCLVZWJFPC-IERDGZPVSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000702604882 990009699 /nfs/dbraw/zinc/00/96/99/990009699.db2.gz ZZTRKCLVZWJFPC-IERDGZPVSA-N 2 1 356.466 2.688 20 10 FFCDMP C[N@H+]1CCCC[C@@H]1CN1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738170222 999622612 /nfs/dbraw/zinc/62/26/12/999622612.db2.gz OCWKWMUYKCTVOT-GOSISDBHSA-N 2 1 354.498 2.542 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846144564 1000218528 /nfs/dbraw/zinc/21/85/28/1000218528.db2.gz LFUIFQMOXYZWAO-KKSFZXQISA-N 2 1 356.466 2.688 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000846144564 1000218531 /nfs/dbraw/zinc/21/85/31/1000218531.db2.gz LFUIFQMOXYZWAO-KKSFZXQISA-N 2 1 356.466 2.688 20 10 FFCDMP C[C@]1(C[NH3+])CCC[N@H+](Cc2cccc(I)c2O)CC1 ZINC001206326127 1032229821 /nfs/dbraw/zinc/22/98/21/1032229821.db2.gz KLRVQKPORPWEKP-HNNXBMFYSA-N 2 1 374.266 2.948 20 10 FFCDMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(I)c2O)CC1 ZINC001206326127 1032229832 /nfs/dbraw/zinc/22/98/32/1032229832.db2.gz KLRVQKPORPWEKP-HNNXBMFYSA-N 2 1 374.266 2.948 20 10 FFCDMP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1c(O)cccc1F ZINC000886522398 1008717478 /nfs/dbraw/zinc/71/74/78/1008717478.db2.gz IGEHUVIQFSFGLG-INIZCTEOSA-N 2 1 373.476 2.574 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC001120072574 1023230247 /nfs/dbraw/zinc/23/02/47/1023230247.db2.gz XHBKQSKFQLHNEF-CEXWTWQISA-N 2 1 361.505 2.824 20 10 FFCDMP Fc1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc(F)c1N1CCOCC1 ZINC000839146626 1026605275 /nfs/dbraw/zinc/60/52/75/1026605275.db2.gz OUDOZBAUGUHBBY-UHFFFAOYSA-N 2 1 365.468 2.765 20 10 FFCDMP C[C@H](C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000839193862 1026618019 /nfs/dbraw/zinc/61/80/19/1026618019.db2.gz XAXFKBGZSJACGH-QGZVFWFLSA-N 2 1 361.530 2.848 20 10 FFCDMP COc1ccc([C@@H](C[NH3+])C[NH+]2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000842476297 1030749128 /nfs/dbraw/zinc/74/91/28/1030749128.db2.gz LFXMXZNTDTWKCJ-SFHVURJKSA-N 2 1 355.482 2.568 20 10 FFCDMP Oc1ccccc1C[N@H+]1CC[C@H]2[C@H](C[C@@H](Cn3cccn3)[NH+]2CC2CC2)C1 ZINC001203552681 1030763925 /nfs/dbraw/zinc/76/39/25/1030763925.db2.gz QEKBHKTXAGZKGM-HKBOAZHASA-N 2 1 366.509 2.964 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@H]2[C@H](C[C@@H](Cn3cccn3)[N@@H+]2CC2CC2)C1 ZINC001203552681 1030763932 /nfs/dbraw/zinc/76/39/32/1030763932.db2.gz QEKBHKTXAGZKGM-HKBOAZHASA-N 2 1 366.509 2.964 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2CC2CC2)C1 ZINC001203552681 1030763948 /nfs/dbraw/zinc/76/39/48/1030763948.db2.gz QEKBHKTXAGZKGM-HKBOAZHASA-N 2 1 366.509 2.964 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(OC)cc1O)C2 ZINC001203623530 1030790600 /nfs/dbraw/zinc/79/06/00/1030790600.db2.gz SZSHCKBGVUQCRG-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(OC)cc1O)C2 ZINC001203623530 1030790627 /nfs/dbraw/zinc/79/06/27/1030790627.db2.gz SZSHCKBGVUQCRG-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(OC)cc1O)C2 ZINC001203623530 1030790647 /nfs/dbraw/zinc/79/06/47/1030790647.db2.gz SZSHCKBGVUQCRG-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c1O ZINC001204337077 1031234585 /nfs/dbraw/zinc/23/45/85/1031234585.db2.gz BBZGRDKHAQCCJR-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(Br)cc(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)c1O ZINC001204337077 1031234597 /nfs/dbraw/zinc/23/45/97/1031234597.db2.gz BBZGRDKHAQCCJR-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(Br)cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c1O ZINC001204337077 1031234609 /nfs/dbraw/zinc/23/46/09/1031234609.db2.gz BBZGRDKHAQCCJR-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1C[C@@H]3CNc4ccccc4[C@H]3C1)C[NH2+]CCO2 ZINC001224263684 1033810225 /nfs/dbraw/zinc/81/02/25/1033810225.db2.gz XIITUJZHOCELSU-WMZOPIPTSA-N 2 1 351.450 2.515 20 10 FFCDMP CCOC(=O)[C@@]1(C)CCCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139408631 1035093034 /nfs/dbraw/zinc/09/30/34/1035093034.db2.gz NYYKMSHYQHAVOL-QFIPXVFZSA-N 2 1 373.541 2.994 20 10 FFCDMP Cc1cccnc1O[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411378 1035094746 /nfs/dbraw/zinc/09/47/46/1035094746.db2.gz ITQJDZNIUIUTHE-OAQYLSRUSA-N 2 1 366.509 2.795 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1cccc2c1OCO2 ZINC001139411386 1035095913 /nfs/dbraw/zinc/09/59/13/1035095913.db2.gz JHFHSSIFOFRWMU-UHFFFAOYSA-N 2 1 353.466 2.799 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4COC[C@H](C3)C4(F)F)cc2)CC1 ZINC001140306019 1035427573 /nfs/dbraw/zinc/42/75/73/1035427573.db2.gz KSLVDBLIQWVMMX-HDICACEKSA-N 2 1 365.468 2.542 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@]4(C3)CC(F)(F)CO4)cc2)CC1 ZINC001140306196 1035427588 /nfs/dbraw/zinc/42/75/88/1035427588.db2.gz OPHIHEUHOKBTJK-IBGZPJMESA-N 2 1 365.468 2.829 20 10 FFCDMP Cc1ccccc1O[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001235675145 1037676623 /nfs/dbraw/zinc/67/66/23/1037676623.db2.gz PGDFHDWRXLFQNA-FQEVSTJZSA-N 2 1 367.493 2.764 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CC[C@]3(CCN(CC[NH+](C)C)C3=O)C2)c(O)c1 ZINC001277976762 1037858427 /nfs/dbraw/zinc/85/84/27/1037858427.db2.gz WBZXVVKIACOFIH-NRFANRHFSA-N 2 1 359.514 2.502 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236213001 1037989475 /nfs/dbraw/zinc/98/94/75/1037989475.db2.gz ARPCUUVPIPKOCI-MSOLQXFVSA-N 2 1 364.486 2.816 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236213001 1037989481 /nfs/dbraw/zinc/98/94/81/1037989481.db2.gz ARPCUUVPIPKOCI-MSOLQXFVSA-N 2 1 364.486 2.816 20 10 FFCDMP CCC[N@@H+](Cc1ccc(I)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236841970 1038304688 /nfs/dbraw/zinc/30/46/88/1038304688.db2.gz BLTGZOAZOAIAKK-GFCCVEGCSA-N 2 1 374.266 2.818 20 10 FFCDMP CCC[N@H+](Cc1ccc(I)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236841970 1038304699 /nfs/dbraw/zinc/30/46/99/1038304699.db2.gz BLTGZOAZOAIAKK-GFCCVEGCSA-N 2 1 374.266 2.818 20 10 FFCDMP Cc1nnc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)o1 ZINC001236943480 1038370846 /nfs/dbraw/zinc/37/08/46/1038370846.db2.gz RWAQKBKHIZHAEJ-QGZVFWFLSA-N 2 1 373.476 2.649 20 10 FFCDMP FC(F)(F)Oc1ccc(N2CC[NH+]([C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC001246998491 1039569564 /nfs/dbraw/zinc/56/95/64/1039569564.db2.gz XPJRBCGYMQPNSS-FOLVSLTJSA-N 2 1 355.404 2.990 20 10 FFCDMP COc1ccc(C[NH+]2CCC3(CCC[N@@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001278565651 1041191503 /nfs/dbraw/zinc/19/15/03/1041191503.db2.gz RIAKMTRSNRJVOX-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP COc1ccc(C[NH+]2CCC3(CCCN(CC[NH+](C)C)C3)CC2)c(O)c1 ZINC001278565651 1041191506 /nfs/dbraw/zinc/19/15/06/1041191506.db2.gz RIAKMTRSNRJVOX-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2cc3ccccc3cc2O)CCC12C[NH2+]C2 ZINC001237430130 1043155116 /nfs/dbraw/zinc/15/51/16/1043155116.db2.gz IXALVDVZDKLGGV-GOSISDBHSA-N 2 1 354.450 2.520 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001279680917 1043458459 /nfs/dbraw/zinc/45/84/59/1043458459.db2.gz MOVLUSZUPVKTKK-OKILXGFUSA-N 2 1 373.419 2.501 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001279680917 1043458462 /nfs/dbraw/zinc/45/84/62/1043458462.db2.gz MOVLUSZUPVKTKK-OKILXGFUSA-N 2 1 373.419 2.501 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@H](C[NH+]4CCCCC4)C3)cc2F)CC1 ZINC001324750456 1046205601 /nfs/dbraw/zinc/20/56/01/1046205601.db2.gz ILYBZPBBJMVEBC-HXUWFJFHSA-N 2 1 374.548 2.885 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353544 1048681800 /nfs/dbraw/zinc/68/18/00/1048681800.db2.gz FZRKCYQTQLDXDM-FQEVSTJZSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353544 1048681801 /nfs/dbraw/zinc/68/18/01/1048681801.db2.gz FZRKCYQTQLDXDM-FQEVSTJZSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353544 1048681809 /nfs/dbraw/zinc/68/18/09/1048681809.db2.gz FZRKCYQTQLDXDM-FQEVSTJZSA-N 3 1 374.548 2.789 20 10 FFCDMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001341568795 1050195372 /nfs/dbraw/zinc/19/53/72/1050195372.db2.gz FUAWBHWBPOHHGC-LJQANCHMSA-N 3 1 362.537 2.884 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH2+]C[C@H]3c3ccccc3)cc2F)CC1 ZINC001345103095 1052258873 /nfs/dbraw/zinc/25/88/73/1052258873.db2.gz BBMLDTPZELLBET-QFIPXVFZSA-N 2 1 368.500 2.724 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)C3CCCCC3)cc2F)CC1 ZINC001343561679 1052308213 /nfs/dbraw/zinc/30/82/13/1052308213.db2.gz UEDLHCHCPLHDKU-NRFANRHFSA-N 2 1 363.521 2.998 20 10 FFCDMP C[C@@H]1C[C@@H](C)C[NH+](CCCNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935382 1065424501 /nfs/dbraw/zinc/42/45/01/1065424501.db2.gz CLXGXMYOORLTQB-WOJBJXKFSA-N 2 1 358.574 2.896 20 10 FFCDMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273446693 511525980 /nfs/dbraw/zinc/52/59/80/511525980.db2.gz NXIYVQLHPNALDG-KBXCAEBGSA-N 2 1 371.437 2.718 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(O)cccc1Br ZINC000862252510 730682435 /nfs/dbraw/zinc/68/24/35/730682435.db2.gz DAQVQXYQHQWNRR-SRCQZFHVSA-N 2 1 369.303 2.838 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1c(O)cccc1Br ZINC000862252510 730682437 /nfs/dbraw/zinc/68/24/37/730682437.db2.gz DAQVQXYQHQWNRR-SRCQZFHVSA-N 2 1 369.303 2.838 20 10 FFCDMP COc1ccc(O)c(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)c1 ZINC000775779706 738124140 /nfs/dbraw/zinc/12/41/40/738124140.db2.gz FAPBJSKVNFMTEU-QGZVFWFLSA-N 2 1 361.511 2.541 20 10 FFCDMP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@](C)(C(F)F)O1 ZINC000827955262 745007149 /nfs/dbraw/zinc/00/71/49/745007149.db2.gz CMUWLJAUHCKPJG-HNAYVOBHSA-N 2 1 353.457 2.683 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@](C)(C(F)F)O1 ZINC000827955262 745007154 /nfs/dbraw/zinc/00/71/54/745007154.db2.gz CMUWLJAUHCKPJG-HNAYVOBHSA-N 2 1 353.457 2.683 20 10 FFCDMP CCC[NH+]1CCC([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1 ZINC000839146246 746787972 /nfs/dbraw/zinc/78/79/72/746787972.db2.gz AISQOFRODRCDLL-UHFFFAOYSA-N 2 1 353.457 2.765 20 10 FFCDMP COC(=O)c1c(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cc(F)ccc2n1C ZINC000894911893 967092210 /nfs/dbraw/zinc/09/22/10/967092210.db2.gz NNGREQCYXZOSKR-GOOCMWNKSA-N 2 1 359.445 2.819 20 10 FFCDMP COC(=O)c1c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cc(F)ccc2n1C ZINC000894911893 967092223 /nfs/dbraw/zinc/09/22/23/967092223.db2.gz NNGREQCYXZOSKR-GOOCMWNKSA-N 2 1 359.445 2.819 20 10 FFCDMP COC(=O)c1c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cc(F)ccc2n1C ZINC000894911893 967092236 /nfs/dbraw/zinc/09/22/36/967092236.db2.gz NNGREQCYXZOSKR-GOOCMWNKSA-N 2 1 359.445 2.819 20 10 FFCDMP COC(=O)c1c(C[NH2+]C2CCN(C3CC3)CC2)c2cc(F)ccc2n1C ZINC000894162960 978034294 /nfs/dbraw/zinc/03/42/94/978034294.db2.gz CXVXLGFFBMLGIC-UHFFFAOYSA-N 2 1 359.445 2.820 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1O ZINC001205996035 1032100776 /nfs/dbraw/zinc/10/07/76/1032100776.db2.gz UBZLOASGUMMLBV-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP CCOc1ccc(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391442 988549822 /nfs/dbraw/zinc/54/98/22/988549822.db2.gz CTUJFQVXHWCNKP-WLRLJWMZSA-N 2 1 362.514 2.750 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC4(C3)Oc3ccccc3O4)cc2)CC1 ZINC000809790035 994612453 /nfs/dbraw/zinc/61/24/53/994612453.db2.gz UEGFPRACODNJFJ-UHFFFAOYSA-N 2 1 365.477 2.812 20 10 FFCDMP Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719177 1016149902 /nfs/dbraw/zinc/14/99/02/1016149902.db2.gz WJRCFTNDNHXMLX-RTBURBONSA-N 2 1 360.498 2.532 20 10 FFCDMP CCOc1ccc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC000769191528 1000447975 /nfs/dbraw/zinc/44/79/75/1000447975.db2.gz DCOWLOZNARJSPS-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP CCOc1ccc(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC000769191528 1000447978 /nfs/dbraw/zinc/44/79/78/1000447978.db2.gz DCOWLOZNARJSPS-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP CN(C)C(=O)CC[NH+]1CCC([NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816546534 1007106486 /nfs/dbraw/zinc/10/64/86/1007106486.db2.gz NBADLJZOTMJFGC-UHFFFAOYSA-N 2 1 355.482 2.578 20 10 FFCDMP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817916272 1007808595 /nfs/dbraw/zinc/80/85/95/1007808595.db2.gz DNYBJRLQOGSYTN-VXKWHMMOSA-N 3 1 356.558 2.839 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942905 1007818381 /nfs/dbraw/zinc/81/83/81/1007818381.db2.gz RMRASBAXCXJMNN-KCZVDYSFSA-N 2 1 366.509 2.598 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321204 1032891333 /nfs/dbraw/zinc/89/13/33/1032891333.db2.gz RRVTXMSPGFHVLM-NRFANRHFSA-N 2 1 360.521 2.686 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321204 1032891365 /nfs/dbraw/zinc/89/13/65/1032891365.db2.gz RRVTXMSPGFHVLM-NRFANRHFSA-N 2 1 360.521 2.686 20 10 FFCDMP Fc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)ccc1N1CCOCC1 ZINC000903071474 1020663283 /nfs/dbraw/zinc/66/32/83/1020663283.db2.gz CEIYMEWMEMAPAT-JLYLLQBASA-N 2 1 359.489 2.910 20 10 FFCDMP [NH3+]CC(=O)N1CCC[C@@H](C[N@@H+](Cc2ccccc2O)C2CCCCC2)C1 ZINC000841018697 1029980965 /nfs/dbraw/zinc/98/09/65/1029980965.db2.gz OOIKWIBMGUHTJD-QGZVFWFLSA-N 2 1 359.514 2.724 20 10 FFCDMP CCOc1cccc(C[N@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@H]3COC)C2)c1O ZINC001203608410 1030782701 /nfs/dbraw/zinc/78/27/01/1030782701.db2.gz OIHLTKXBUPVLDX-UGKGYDQZSA-N 2 1 374.525 2.971 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](c2ccccc2)C1 ZINC001204691462 1031412874 /nfs/dbraw/zinc/41/28/74/1031412874.db2.gz FYPHVGDNRCLXET-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](c2ccccc2)C1 ZINC001204691462 1031412880 /nfs/dbraw/zinc/41/28/80/1031412880.db2.gz FYPHVGDNRCLXET-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@@H](c2ccccc2)C1 ZINC001204691462 1031412887 /nfs/dbraw/zinc/41/28/87/1031412887.db2.gz FYPHVGDNRCLXET-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(-c2noc([C@@H]([NH3+])CSCC[NH3+])n2)cc1 ZINC001206630627 1031447238 /nfs/dbraw/zinc/44/72/38/1031447238.db2.gz KSXWQBIYJPJSGI-INIZCTEOSA-N 2 1 357.483 2.836 20 10 FFCDMP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000832272945 1034694376 /nfs/dbraw/zinc/69/43/76/1034694376.db2.gz KHNSLJWFNSLXCA-NHCUHLMSSA-N 2 1 366.509 2.533 20 10 FFCDMP CCOC(=O)C[C@H]1CCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139254573 1035029860 /nfs/dbraw/zinc/02/98/60/1035029860.db2.gz ITPOGJBQPQAHMO-OAHLLOKOSA-N 2 1 364.486 2.628 20 10 FFCDMP COc1cc(C[NH+]2CCN(c3ccc(F)cc3)CC2)cc(C[NH+](C)C)c1O ZINC001139252931 1035030374 /nfs/dbraw/zinc/03/03/74/1035030374.db2.gz GAWCGXAJRBLRFG-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3ccncc3C)C2)cc(C[NH+](C)C)c1O ZINC001139260016 1035031844 /nfs/dbraw/zinc/03/18/44/1035031844.db2.gz HTBLJFDGEDGUMN-GOSISDBHSA-N 2 1 371.481 2.819 20 10 FFCDMP COc1cc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc(C[NH+](C)C)c1O ZINC001139258974 1035032027 /nfs/dbraw/zinc/03/20/27/1035032027.db2.gz CQKBTFWJZQIBMB-UHFFFAOYSA-N 2 1 372.465 2.822 20 10 FFCDMP COc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(C[NH+](C)C)c1O ZINC001139258974 1035032030 /nfs/dbraw/zinc/03/20/30/1035032030.db2.gz CQKBTFWJZQIBMB-UHFFFAOYSA-N 2 1 372.465 2.822 20 10 FFCDMP CCCCOC(=O)[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411703 1035096069 /nfs/dbraw/zinc/09/60/69/1035096069.db2.gz ZNUJEZROZLHEOH-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000835039839 1035491490 /nfs/dbraw/zinc/49/14/90/1035491490.db2.gz KIQABTTXOFDTLO-KUSOGIATSA-N 2 1 365.521 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000835039839 1035491493 /nfs/dbraw/zinc/49/14/93/1035491493.db2.gz KIQABTTXOFDTLO-KUSOGIATSA-N 2 1 365.521 2.992 20 10 FFCDMP CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000835076113 1035513805 /nfs/dbraw/zinc/51/38/05/1035513805.db2.gz CWXOXTYHVQGZFX-UHFFFAOYSA-N 2 1 355.530 2.830 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001140619869 1035742905 /nfs/dbraw/zinc/74/29/05/1035742905.db2.gz SLJBQDNEFKSTCJ-QGZVFWFLSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001140619869 1035742921 /nfs/dbraw/zinc/74/29/21/1035742921.db2.gz SLJBQDNEFKSTCJ-QGZVFWFLSA-N 2 1 360.498 2.940 20 10 FFCDMP C[C@@H](c1ccccc1)N1CC[NH+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235864504 1037802983 /nfs/dbraw/zinc/80/29/83/1037802983.db2.gz RWBRPKHVWJXZIL-FQEVSTJZSA-N 2 1 364.537 2.975 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)CCN1Cc1ccccc1 ZINC001236074371 1037916612 /nfs/dbraw/zinc/91/66/12/1037916612.db2.gz YCYPSTGJMQDSAK-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC[N@@H+]1Cc1ccccc1 ZINC001236074371 1037916622 /nfs/dbraw/zinc/91/66/22/1037916622.db2.gz YCYPSTGJMQDSAK-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC[N@H+]1Cc1ccccc1 ZINC001236074371 1037916635 /nfs/dbraw/zinc/91/66/35/1037916635.db2.gz YCYPSTGJMQDSAK-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(O)cc1Br ZINC001236745128 1038231780 /nfs/dbraw/zinc/23/17/80/1038231780.db2.gz AABSCQXCCQJNNY-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c(O)cc1Br ZINC001236745128 1038231789 /nfs/dbraw/zinc/23/17/89/1038231789.db2.gz AABSCQXCCQJNNY-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)c(O)cc1Br ZINC001236745128 1038231803 /nfs/dbraw/zinc/23/18/03/1038231803.db2.gz AABSCQXCCQJNNY-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c(O)cc1Br ZINC001236745128 1038231817 /nfs/dbraw/zinc/23/18/17/1038231817.db2.gz AABSCQXCCQJNNY-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCN(C)CC1 ZINC001236944940 1038372001 /nfs/dbraw/zinc/37/20/01/1038372001.db2.gz HGKOTWOKQLFDDP-UHFFFAOYSA-N 2 1 362.537 2.882 20 10 FFCDMP COCCOC[N@@H+]1CCCC2(CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001278616732 1038835890 /nfs/dbraw/zinc/83/58/90/1038835890.db2.gz BBRRFQYVNIYYPG-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP COCCOC[N@H+]1CCCC2(CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001278616732 1038835914 /nfs/dbraw/zinc/83/59/14/1038835914.db2.gz BBRRFQYVNIYYPG-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP Oc1ccc([C@@H](O)C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1O ZINC001255122686 1041157116 /nfs/dbraw/zinc/15/71/16/1041157116.db2.gz IUXLKTFVRDREAA-WEMPKCCASA-N 2 1 368.477 2.916 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)Cn3cc[nH+]c3C)C2)cc1C ZINC001264490842 1042695032 /nfs/dbraw/zinc/69/50/32/1042695032.db2.gz CRLQCCHSIDHDKA-RBUKOAKNSA-N 2 1 370.497 2.583 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149341 1042920385 /nfs/dbraw/zinc/92/03/85/1042920385.db2.gz FNETZMYNZIBLLQ-UHFFFAOYSA-N 2 1 358.574 2.992 20 10 FFCDMP COCCOC[N@@H+]1CCCC2(CC[NH+](Cc3cc(F)ccc3O)CC2)C1 ZINC001279196964 1042941855 /nfs/dbraw/zinc/94/18/55/1042941855.db2.gz FPRMTMRQUYXLTC-UHFFFAOYSA-N 2 1 366.477 2.830 20 10 FFCDMP COCCOC[N@H+]1CCCC2(CC[NH+](Cc3cc(F)ccc3O)CC2)C1 ZINC001279196964 1042941860 /nfs/dbraw/zinc/94/18/60/1042941860.db2.gz FPRMTMRQUYXLTC-UHFFFAOYSA-N 2 1 366.477 2.830 20 10 FFCDMP C[NH+](C)CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001279231935 1042956748 /nfs/dbraw/zinc/95/67/48/1042956748.db2.gz ZKILTMQNXNVIRT-XDNSSPFJSA-N 2 1 356.558 2.933 20 10 FFCDMP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001279231935 1042956753 /nfs/dbraw/zinc/95/67/53/1042956753.db2.gz ZKILTMQNXNVIRT-XDNSSPFJSA-N 2 1 356.558 2.933 20 10 FFCDMP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001279231935 1042956758 /nfs/dbraw/zinc/95/67/58/1042956758.db2.gz ZKILTMQNXNVIRT-XDNSSPFJSA-N 2 1 356.558 2.933 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CCO)Cc3ccccc3)cc2F)CC1 ZINC001321351106 1045636824 /nfs/dbraw/zinc/63/68/24/1045636824.db2.gz XOAPIZJMNICQRY-FQEVSTJZSA-N 2 1 371.500 2.661 20 10 FFCDMP CCc1ccc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001325658654 1046598056 /nfs/dbraw/zinc/59/80/56/1046598056.db2.gz IUAQCVOLCUDIAX-JOCHJYFZSA-N 2 1 371.500 2.963 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)Cc3ccccc3)cc2F)CC1 ZINC001461101086 1061208780 /nfs/dbraw/zinc/20/87/80/1061208780.db2.gz PBEQXPXSXXLPPN-HXUWFJFHSA-N 2 1 371.500 2.518 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1 ZINC000185084857 510675540 /nfs/dbraw/zinc/67/55/40/510675540.db2.gz AUFSWBKOKKYAAK-QGZVFWFLSA-N 2 1 369.509 2.999 20 10 FFCDMP C[NH+](Cc1ccccc1O)CC1(C[N@H+](C)Cc2ccccc2O)COC1 ZINC000182334335 510851440 /nfs/dbraw/zinc/85/14/40/510851440.db2.gz QBZSSMOERQLNNT-UHFFFAOYSA-N 2 1 356.466 2.678 20 10 FFCDMP C[NH+](Cc1ccccc1O)CC1(C[N@@H+](C)Cc2ccccc2O)COC1 ZINC000182334335 510851442 /nfs/dbraw/zinc/85/14/42/510851442.db2.gz QBZSSMOERQLNNT-UHFFFAOYSA-N 2 1 356.466 2.678 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Cc4nccs4)C3)cc2)CC1 ZINC000898071779 735310174 /nfs/dbraw/zinc/31/01/74/735310174.db2.gz SHRGUCREXMTSNK-SFHVURJKSA-N 2 1 356.539 2.960 20 10 FFCDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC000093769454 728477646 /nfs/dbraw/zinc/47/76/46/728477646.db2.gz PPOTZEJFVFIIPI-UHFFFAOYSA-N 2 1 350.503 2.971 20 10 FFCDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)CC1 ZINC000877528778 1014613747 /nfs/dbraw/zinc/61/37/47/1014613747.db2.gz KEHLWHOTNXHAIW-FQEVSTJZSA-N 2 1 357.542 2.811 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cc1Br ZINC001206011583 1032108106 /nfs/dbraw/zinc/10/81/06/1032108106.db2.gz FAUTZOWZIXJFMR-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP CCN(C)c1ccc([C@H](C)[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)cc1 ZINC000765882359 986807449 /nfs/dbraw/zinc/80/74/49/986807449.db2.gz BRIWAQWZHOESSR-KRWDZBQOSA-N 2 1 360.546 2.736 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000846221745 1000233326 /nfs/dbraw/zinc/23/33/26/1000233326.db2.gz NDCXQNMJZZZCGA-UHFFFAOYSA-N 2 1 351.494 2.801 20 10 FFCDMP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CC)C(=O)OCC ZINC000792188423 1002938807 /nfs/dbraw/zinc/93/88/07/1002938807.db2.gz ONWXHGPFNLZASP-HXUWFJFHSA-N 2 1 361.530 2.992 20 10 FFCDMP Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775732931 1003893563 /nfs/dbraw/zinc/89/35/63/1003893563.db2.gz RTXHYLMBNCSOKA-HXUWFJFHSA-N 2 1 353.514 2.681 20 10 FFCDMP Fc1cc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1N1CCOCC1 ZINC000853094168 1006295200 /nfs/dbraw/zinc/29/52/00/1006295200.db2.gz ZQOLNAQGIWVEMA-LJQANCHMSA-N 2 1 361.505 2.874 20 10 FFCDMP CC[NH+]1CCC(N2CCC[N@@H+](Cc3cc(C)cc(OC)c3O)CC2)CC1 ZINC000817373958 1007567106 /nfs/dbraw/zinc/56/71/06/1007567106.db2.gz UTJXTIYLASLORI-UHFFFAOYSA-N 2 1 361.530 2.701 20 10 FFCDMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817887755 1007785194 /nfs/dbraw/zinc/78/51/94/1007785194.db2.gz DLSZPSUVHMHJJZ-UZLBHIALSA-N 2 1 357.473 2.710 20 10 FFCDMP C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NC[C@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@H+]2C1 ZINC001180179473 1009574078 /nfs/dbraw/zinc/57/40/78/1009574078.db2.gz PDBWXWQGUNSRQV-FRTACKCFSA-N 2 1 372.557 2.592 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@H+]1Cc1c(C)n(C)c3ccccc31)CC[NH2+]CC2 ZINC001222220828 1032831026 /nfs/dbraw/zinc/83/10/26/1032831026.db2.gz HQAVYXWOZNIYHA-HXUWFJFHSA-N 2 1 369.509 2.994 20 10 FFCDMP Cc1noc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)CC2)n1 ZINC001116440359 1021218121 /nfs/dbraw/zinc/21/81/21/1021218121.db2.gz RGHKMNUTCRZQAP-UHFFFAOYSA-N 2 1 373.476 2.649 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c2c1c(F)ccc2O ZINC000756561700 1023729667 /nfs/dbraw/zinc/72/96/67/1023729667.db2.gz HCGOTFIXGBXMRC-XJKSGUPXSA-N 2 1 363.477 2.612 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3cc[nH+]c(N4CCCCC4)n3)cc2)CC1 ZINC001156656891 1029292032 /nfs/dbraw/zinc/29/20/32/1029292032.db2.gz AORLSZZUPJSQFX-UHFFFAOYSA-N 2 1 366.513 2.831 20 10 FFCDMP COC(=O)c1c(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)c2ccccc2n1C ZINC001204743050 1031423367 /nfs/dbraw/zinc/42/33/67/1031423367.db2.gz YMTQHZWUAHHIMU-UHFFFAOYSA-N 2 1 355.482 2.931 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3ccccn3)C2)cc(C[NH+](C)C)c1O ZINC001139259232 1035031873 /nfs/dbraw/zinc/03/18/73/1035031873.db2.gz NRRGODSEKNPXBG-KRWDZBQOSA-N 2 1 357.454 2.511 20 10 FFCDMP Cc1nc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)no1 ZINC001139408735 1035093127 /nfs/dbraw/zinc/09/31/27/1035093127.db2.gz PVHYINXTBXCZSN-SFHVURJKSA-N 2 1 355.486 2.509 20 10 FFCDMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001139409600 1035093636 /nfs/dbraw/zinc/09/36/36/1035093636.db2.gz MXZQSOJURGPXFJ-UHFFFAOYSA-N 3 1 358.574 2.991 20 10 FFCDMP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)CC1 ZINC001139409600 1035093641 /nfs/dbraw/zinc/09/36/41/1035093641.db2.gz MXZQSOJURGPXFJ-UHFFFAOYSA-N 2 1 358.574 2.991 20 10 FFCDMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(N3CCN(C)CC3)cc2)CC1 ZINC001139409600 1035093648 /nfs/dbraw/zinc/09/36/48/1035093648.db2.gz MXZQSOJURGPXFJ-UHFFFAOYSA-N 2 1 358.574 2.991 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](CCC(=O)OC)C3)cc2)CC1 ZINC001140306601 1035428309 /nfs/dbraw/zinc/42/83/09/1035428309.db2.gz VCFVSYCLEQGCNI-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)cc1O ZINC001233484187 1036653214 /nfs/dbraw/zinc/65/32/14/1036653214.db2.gz ASRLHFXWKPDWJS-UHFFFAOYSA-N 2 1 358.438 2.885 20 10 FFCDMP COc1ccc2ccc(O)c(C[N@H+]3CCOC[C@@]4(CCC[NH2+]C4)C3)c2c1 ZINC001235021756 1037309083 /nfs/dbraw/zinc/30/90/83/1037309083.db2.gz JJKGDKSOBKOULP-OAQYLSRUSA-N 2 1 356.466 2.756 20 10 FFCDMP COC(=O)[C@]12C[C@@H]3C[NH2+]C[C@@H]3[C@H]1C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001235334535 1037485686 /nfs/dbraw/zinc/48/56/86/1037485686.db2.gz MVYRGHYTVCVCAV-WHEACTPUSA-N 2 1 372.509 2.520 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(C(C)C)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235352185 1037497756 /nfs/dbraw/zinc/49/77/56/1037497756.db2.gz LXNPQRVBIMAZKV-RXVVDRJESA-N 2 1 360.498 2.880 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429415 1037543988 /nfs/dbraw/zinc/54/39/88/1037543988.db2.gz UENRAZQRDUTYKQ-MOPGFXCFSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429415 1037544003 /nfs/dbraw/zinc/54/40/03/1037544003.db2.gz UENRAZQRDUTYKQ-MOPGFXCFSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429415 1037544014 /nfs/dbraw/zinc/54/40/14/1037544014.db2.gz UENRAZQRDUTYKQ-MOPGFXCFSA-N 2 1 374.548 2.789 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001231592829 1037712156 /nfs/dbraw/zinc/71/21/56/1037712156.db2.gz VFDNQLPQSOXMTR-GOSISDBHSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001231592829 1037712171 /nfs/dbraw/zinc/71/21/71/1037712171.db2.gz VFDNQLPQSOXMTR-GOSISDBHSA-N 2 1 360.498 2.940 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001235935349 1037845170 /nfs/dbraw/zinc/84/51/70/1037845170.db2.gz UCKJHDXUUITWRH-KRWDZBQOSA-N 2 1 355.457 2.930 20 10 FFCDMP COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236110597 1037935242 /nfs/dbraw/zinc/93/52/42/1037935242.db2.gz BWBPHUYCHFMNOQ-OAHLLOKOSA-N 2 1 356.466 2.946 20 10 FFCDMP COc1ccc(N2CC[NH+](C[C@@H]3[C@H](C)C[NH2+]CC3(F)F)CC2)c(C)c1 ZINC001236368927 1038059817 /nfs/dbraw/zinc/05/98/17/1038059817.db2.gz WMPZGWYYEYPGKT-NVXWUHKLSA-N 2 1 353.457 2.616 20 10 FFCDMP c1ccc(N2C[C@@H]3C[N@@H+](Cc4ccc(N5CC[NH2+]CC5)cc4)C[C@@H]3C2)cc1 ZINC001237036846 1038415368 /nfs/dbraw/zinc/41/53/68/1038415368.db2.gz DQGTUDPWVALXHY-OYRHEFFESA-N 2 1 362.521 2.664 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001256528273 1038544792 /nfs/dbraw/zinc/54/47/92/1038544792.db2.gz YOBKHFXZKXQDSY-CRAIPNDOSA-N 2 1 356.466 2.989 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@H+]1Cc1ccccc1 ZINC001256528273 1038544798 /nfs/dbraw/zinc/54/47/98/1038544798.db2.gz YOBKHFXZKXQDSY-CRAIPNDOSA-N 2 1 356.466 2.989 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCN[C@H]3CC[NH2+][C@@H](C(C)C)C3)CC2)cc1 ZINC001246185119 1039268831 /nfs/dbraw/zinc/26/88/31/1039268831.db2.gz SFBFQWJTAWPANX-SIKLNZKXSA-N 2 1 374.573 2.574 20 10 FFCDMP C[C@@H]1C[C@H]([NH+]2CCN(c3ccc(OCc4cccnc4)cc3)CC2)CC[NH2+]1 ZINC001246998876 1039570667 /nfs/dbraw/zinc/57/06/67/1039570667.db2.gz HFFGQHCYSOSFQI-WIYYLYMNSA-N 2 1 366.509 2.923 20 10 FFCDMP Oc1ccc([C@H](O)C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255382893 1041310678 /nfs/dbraw/zinc/31/06/78/1041310678.db2.gz YDJYRHVAUKMVSE-GHTZIAJQSA-N 2 1 356.466 2.776 20 10 FFCDMP Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001327254209 1047257457 /nfs/dbraw/zinc/25/74/57/1047257457.db2.gz KTCVDJFLCGIGRG-UHFFFAOYSA-N 2 1 371.504 2.868 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CCC3)[C@@H]3CCOC3)cc2F)CC1 ZINC001331966698 1048189819 /nfs/dbraw/zinc/18/98/19/1048189819.db2.gz UCQXRRYOOWFPRB-WIYYLYMNSA-N 2 1 361.505 2.872 20 10 FFCDMP COc1cc(C[N@H+]2CCOC3(CC[NH+](C)CC3)C2)c(O)c(C(C)(C)C)c1 ZINC001330278865 1049116721 /nfs/dbraw/zinc/11/67/21/1049116721.db2.gz ITNYLUKWGAALIL-UHFFFAOYSA-N 2 1 362.514 2.995 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1O ZINC001334359711 1049388919 /nfs/dbraw/zinc/38/89/19/1049388919.db2.gz PZAHGSGRCHEKGE-HXUWFJFHSA-N 2 1 370.493 2.956 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000377632528 512366369 /nfs/dbraw/zinc/36/63/69/512366369.db2.gz STKREOPPFMOXOC-QGZVFWFLSA-N 2 1 367.921 2.655 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809516 509306184 /nfs/dbraw/zinc/30/61/84/509306184.db2.gz DXFFJDSHGKHVET-XQBPLPMBSA-N 2 1 374.573 2.526 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](C(F)(F)F)CC3)cc2)CC1 ZINC000877819684 732440632 /nfs/dbraw/zinc/44/06/32/732440632.db2.gz IBKHZBVYVPXPER-KRWDZBQOSA-N 2 1 357.420 2.592 20 10 FFCDMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502164 738097728 /nfs/dbraw/zinc/09/77/28/738097728.db2.gz PDJPOMRMWGYCQI-XJKSGUPXSA-N 2 1 353.894 2.674 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)cc1F ZINC000799346403 740410942 /nfs/dbraw/zinc/41/09/42/740410942.db2.gz KUESHXAJIALCCS-UHFFFAOYSA-N 2 1 350.526 2.788 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125308 747777414 /nfs/dbraw/zinc/77/74/14/747777414.db2.gz RUHHKOOHCFBBLU-QWHCGFSZSA-N 2 1 369.303 2.985 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000846222141 748433313 /nfs/dbraw/zinc/43/33/13/748433313.db2.gz GPLIQQNDALUQKR-FDQGKXFDSA-N 2 1 366.889 2.967 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000846222141 748433315 /nfs/dbraw/zinc/43/33/15/748433315.db2.gz GPLIQQNDALUQKR-FDQGKXFDSA-N 2 1 366.889 2.967 20 10 FFCDMP c1ccc(N(CC[NH+]2CCOCC2)Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662261276 975387423 /nfs/dbraw/zinc/38/74/23/975387423.db2.gz WFKQPWFKCCQAGB-UHFFFAOYSA-N 2 1 351.494 2.671 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126122 986556671 /nfs/dbraw/zinc/55/66/71/986556671.db2.gz GRVUJYMCZHRKFT-SFTDATJTSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126122 986556676 /nfs/dbraw/zinc/55/66/76/986556676.db2.gz GRVUJYMCZHRKFT-SFTDATJTSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126122 986556679 /nfs/dbraw/zinc/55/66/79/986556679.db2.gz GRVUJYMCZHRKFT-SFTDATJTSA-N 2 1 356.558 2.650 20 10 FFCDMP C[N@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465835 1000262590 /nfs/dbraw/zinc/26/25/90/1000262590.db2.gz MHIJMCKXQBVYNB-UWJYYQICSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000768465835 1000262596 /nfs/dbraw/zinc/26/25/96/1000262596.db2.gz MHIJMCKXQBVYNB-UWJYYQICSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@@H]2O)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768465835 1000262599 /nfs/dbraw/zinc/26/25/99/1000262599.db2.gz MHIJMCKXQBVYNB-UWJYYQICSA-N 2 1 368.477 2.772 20 10 FFCDMP COC(=O)C1([N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000775694459 1003703330 /nfs/dbraw/zinc/70/33/30/1003703330.db2.gz KUHVOPDUOWGCDT-UHFFFAOYSA-N 2 1 359.514 2.746 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000775726536 1003859055 /nfs/dbraw/zinc/85/90/55/1003859055.db2.gz VLHXEIWTYJRMOU-AREMUKBSSA-N 2 1 371.550 2.808 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205570623 1003950348 /nfs/dbraw/zinc/95/03/48/1003950348.db2.gz MLWLTQJOSQCUGD-OAHLLOKOSA-N 2 1 361.255 2.816 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CO)c3ccc(F)cc3F)cc2)CC1 ZINC000850410025 1005813711 /nfs/dbraw/zinc/81/37/11/1005813711.db2.gz DUTMZQAZQBDOKD-FQEVSTJZSA-N 2 1 361.436 2.540 20 10 FFCDMP C[C@@H]1C[C@@H]2CC[C@H](C(=O)NC[C@H](c3ccc(N(C)C)cc3)[NH+](C)C)C[N@H+]2C1 ZINC001180179474 1009573444 /nfs/dbraw/zinc/57/34/44/1009573444.db2.gz PDBWXWQGUNSRQV-GKBFQHABSA-N 2 1 372.557 2.592 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc(Cl)cc(C)c3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136018 1032779252 /nfs/dbraw/zinc/77/92/52/1032779252.db2.gz KYFZXODOGGTADB-KXBFYZLASA-N 2 1 366.889 2.719 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc4ccccc4cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136026 1032780808 /nfs/dbraw/zinc/78/08/08/1032780808.db2.gz KZVRRXBPVSLDEU-UGKGYDQZSA-N 2 1 368.477 2.910 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1O ZINC001118246012 1022141686 /nfs/dbraw/zinc/14/16/86/1022141686.db2.gz LMUFGQLLIHVPNH-QGZVFWFLSA-N 2 1 369.509 2.999 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(F)cc3O)cn2)CC1 ZINC000756431010 1023709307 /nfs/dbraw/zinc/70/93/07/1023709307.db2.gz ATEJGTMYZSLPBR-HNNXBMFYSA-N 2 1 358.461 2.919 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548174 1023725891 /nfs/dbraw/zinc/72/58/91/1023725891.db2.gz JAXCOQHTKNZDCE-RDJZCZTQSA-N 2 1 355.482 2.783 20 10 FFCDMP Cc1cc(C[N@H+]2CCC[C@@H](NC(=O)C[NH+](C)C)C2)c(C)n1-c1ccccc1 ZINC001137858995 1033229866 /nfs/dbraw/zinc/22/98/66/1033229866.db2.gz DRGFABNGXBOVOO-HXUWFJFHSA-N 2 1 368.525 2.736 20 10 FFCDMP Cc1cc(C[N@@H+]2CCC[C@@H](NC(=O)C[NH+](C)C)C2)c(C)n1-c1ccccc1 ZINC001137858995 1033229874 /nfs/dbraw/zinc/22/98/74/1033229874.db2.gz DRGFABNGXBOVOO-HXUWFJFHSA-N 2 1 368.525 2.736 20 10 FFCDMP CCOc1cccc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1O ZINC000092665199 1027394373 /nfs/dbraw/zinc/39/43/73/1027394373.db2.gz AVTDYCBWXMIEOZ-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP CCOc1cccc(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1O ZINC000092665199 1027394393 /nfs/dbraw/zinc/39/43/93/1027394393.db2.gz AVTDYCBWXMIEOZ-HDICACEKSA-N 2 1 361.530 2.781 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753581 1030906929 /nfs/dbraw/zinc/90/69/29/1030906929.db2.gz FKYFNVLBFUAYAN-NRSPTQNISA-N 3 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753581 1030906931 /nfs/dbraw/zinc/90/69/31/1030906931.db2.gz FKYFNVLBFUAYAN-NRSPTQNISA-N 2 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753581 1030906939 /nfs/dbraw/zinc/90/69/39/1030906939.db2.gz FKYFNVLBFUAYAN-NRSPTQNISA-N 2 1 374.548 2.930 20 10 FFCDMP COc1cc(CN2CC[N@@H+](C)C[C@H]2c2ccccc2)cc(C[NH+](C)C)c1O ZINC001139252842 1035029798 /nfs/dbraw/zinc/02/97/98/1035029798.db2.gz BADCDMMYPCIWAM-FQEVSTJZSA-N 2 1 369.509 2.951 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](O)[C@@H]2Cc2ccccc2)cc(C[NH+](C)C)c1O ZINC001139255132 1035030485 /nfs/dbraw/zinc/03/04/85/1035030485.db2.gz MFWSOHSRSQEFBP-VQTJNVASSA-N 2 1 370.493 2.640 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C(F)(F)F)[C@H]3CO)cc2)CC1 ZINC001139409261 1035093971 /nfs/dbraw/zinc/09/39/71/1035093971.db2.gz YEDLTEVAXAUYGS-QZTJIDSGSA-N 2 1 371.447 2.574 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](Oc4ccncc4)C3)cc2)CC1 ZINC001139411405 1035094939 /nfs/dbraw/zinc/09/49/39/1035094939.db2.gz KAXCWEZTOZBVPI-QFIPXVFZSA-N 2 1 366.509 2.877 20 10 FFCDMP Cn1cc(C[N@H+]2CCCC23CCN(Cc2cc(F)ccc2O)CC3)cn1 ZINC001140054302 1035323393 /nfs/dbraw/zinc/32/33/93/1035323393.db2.gz PAKKOPDYJUVOLI-UHFFFAOYSA-N 2 1 358.461 2.895 20 10 FFCDMP Cn1cc(CN2CCCC23CC[NH+](Cc2cc(F)ccc2O)CC3)cn1 ZINC001140054302 1035323398 /nfs/dbraw/zinc/32/33/98/1035323398.db2.gz PAKKOPDYJUVOLI-UHFFFAOYSA-N 2 1 358.461 2.895 20 10 FFCDMP Clc1cc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)ccc1N1CCOCC1 ZINC001232198485 1035495144 /nfs/dbraw/zinc/49/51/44/1035495144.db2.gz ULOBUHOFVGILLN-UHFFFAOYSA-N 2 1 372.900 2.894 20 10 FFCDMP Cc1ccc(O)c(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c1 ZINC001140622065 1035749441 /nfs/dbraw/zinc/74/94/41/1035749441.db2.gz WVQWKCAXTSTFIO-WOJBJXKFSA-N 2 1 371.525 2.608 20 10 FFCDMP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4cc(O)c(O)cc4O)C[C@@H]3C2)cc1 ZINC001233484127 1036651872 /nfs/dbraw/zinc/65/18/72/1036651872.db2.gz ZBMPDMJWKQJCKO-HDICACEKSA-N 2 1 354.450 2.676 20 10 FFCDMP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH+](Cc4cc(O)c(O)cc4O)C[C@@H]3C2)cc1 ZINC001233484127 1036651883 /nfs/dbraw/zinc/65/18/83/1036651883.db2.gz ZBMPDMJWKQJCKO-HDICACEKSA-N 2 1 354.450 2.676 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3C[N@@H+](Cc4cc(O)c(O)cc4O)C[C@@H]3C2)cc1 ZINC001233484127 1036651893 /nfs/dbraw/zinc/65/18/93/1036651893.db2.gz ZBMPDMJWKQJCKO-HDICACEKSA-N 2 1 354.450 2.676 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+](Cc4cc(O)c(O)cc4O)C[C@@H]3C2)cc1 ZINC001233484127 1036651896 /nfs/dbraw/zinc/65/18/96/1036651896.db2.gz ZBMPDMJWKQJCKO-HDICACEKSA-N 2 1 354.450 2.676 20 10 FFCDMP COC(=O)c1cccc(C[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001236086374 1037929093 /nfs/dbraw/zinc/92/90/93/1037929093.db2.gz JHPVKIZAPMCBNF-UHFFFAOYSA-N 2 1 353.466 2.515 20 10 FFCDMP Oc1cc2c(cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376956 1038062602 /nfs/dbraw/zinc/06/26/02/1038062602.db2.gz XKMMSBXJWORDMS-MRXNPFEDSA-N 2 1 359.514 2.618 20 10 FFCDMP [O-]c1cc2c(cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376956 1038062627 /nfs/dbraw/zinc/06/26/27/1038062627.db2.gz XKMMSBXJWORDMS-MRXNPFEDSA-N 2 1 359.514 2.618 20 10 FFCDMP [O-]c1cc2c(cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)C[NH2+]CCO2 ZINC001236376956 1038062642 /nfs/dbraw/zinc/06/26/42/1038062642.db2.gz XKMMSBXJWORDMS-MRXNPFEDSA-N 2 1 359.514 2.618 20 10 FFCDMP Cc1ccnc(O[C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236532879 1038122171 /nfs/dbraw/zinc/12/21/71/1038122171.db2.gz FVUVHYUPXOWINW-OAQYLSRUSA-N 2 1 366.509 2.843 20 10 FFCDMP Cc1cccc(O[C@H]2CCC[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)n1 ZINC001236849330 1038306762 /nfs/dbraw/zinc/30/67/62/1038306762.db2.gz VRNZSYYBEVZITF-SFHVURJKSA-N 2 1 369.465 2.621 20 10 FFCDMP CN1CCN(c2ccc(CN3CCC[C@@H]3c3cnccn3)c(F)c2)CC1 ZINC001236934186 1038365458 /nfs/dbraw/zinc/36/54/58/1038365458.db2.gz DSAOSNCZPFUFGJ-HXUWFJFHSA-N 2 1 355.461 2.705 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@]4(C3)CC(F)(F)CO4)c(F)c2)CC1 ZINC001236934885 1038367847 /nfs/dbraw/zinc/36/78/47/1038367847.db2.gz AAWVMHJEMDZXPX-GOSISDBHSA-N 2 1 369.431 2.578 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CC[N@@H+](C)C4)CC3)cc2)CC1 ZINC001278473862 1039546242 /nfs/dbraw/zinc/54/62/42/1039546242.db2.gz BURTUAJBDZZPSV-UHFFFAOYSA-N 3 1 356.558 2.746 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@@H+](CC)CCC[NH+](C)C)c(O)c1 ZINC001249743308 1040972317 /nfs/dbraw/zinc/97/23/17/1040972317.db2.gz JPRTWIFJVWNQCE-UHFFFAOYSA-N 2 1 366.502 2.888 20 10 FFCDMP C[NH+](C)CCN1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(Cl)cc1O)C2 ZINC001278557127 1041144776 /nfs/dbraw/zinc/14/47/76/1041144776.db2.gz FRMWWFAQWSHSLJ-IBGZPJMESA-N 2 1 351.922 2.895 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@]45COC[C@@]4(C3)CCCC5)cc2F)CC1 ZINC001261692949 1041373703 /nfs/dbraw/zinc/37/37/03/1041373703.db2.gz BNHKPBDCZJDESG-SZPZYZBQSA-N 2 1 373.516 2.970 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)cc2F)CC1 ZINC001261692949 1041373710 /nfs/dbraw/zinc/37/37/10/1041373710.db2.gz BNHKPBDCZJDESG-SZPZYZBQSA-N 2 1 373.516 2.970 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1cccc(-c2ccccc2)c1O ZINC001279323795 1043000740 /nfs/dbraw/zinc/00/07/40/1043000740.db2.gz ILEABOAWRUUZGA-BGYRXZFFSA-N 2 1 351.494 2.879 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCC12C[NH2+]C2 ZINC001237428634 1043155367 /nfs/dbraw/zinc/15/53/67/1043155367.db2.gz BOMZFNWKSIMXQP-KRWDZBQOSA-N 2 1 360.498 2.664 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)c3ccc(F)cc3)cc2F)CC1 ZINC001326444443 1046935280 /nfs/dbraw/zinc/93/52/80/1046935280.db2.gz SQKSUTONEVTAIX-HXUWFJFHSA-N 2 1 361.436 2.540 20 10 FFCDMP CN1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCc4cccc(O)c43)c2)CC1 ZINC001326623256 1047005597 /nfs/dbraw/zinc/00/55/97/1047005597.db2.gz OCPCFRWVFQPGRV-HXUWFJFHSA-N 2 1 351.494 2.917 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@H]2C1 ZINC001333890611 1049158860 /nfs/dbraw/zinc/15/88/60/1049158860.db2.gz FGCAMXYRLNGRDJ-SFHLNBCPSA-N 2 1 357.542 2.810 20 10 FFCDMP Cc1ccccc1[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001308304251 1052444180 /nfs/dbraw/zinc/44/41/80/1052444180.db2.gz XRJQLWXJODPLGJ-HXUWFJFHSA-N 2 1 357.473 2.709 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@](C)(O)c1ccccc1 ZINC001349568105 1055342859 /nfs/dbraw/zinc/34/28/59/1055342859.db2.gz FCEIPOMJQJLNCK-HTAPYJJXSA-N 2 1 371.500 2.963 20 10 FFCDMP COc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1C ZINC001506924323 1059577582 /nfs/dbraw/zinc/57/75/82/1059577582.db2.gz VFPOUMAGVHLVSE-ZHALLVOQSA-N 2 1 361.530 2.718 20 10 FFCDMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935380 1065424211 /nfs/dbraw/zinc/42/42/11/1065424211.db2.gz CLXGXMYOORLTQB-BGYRXZFFSA-N 3 1 358.574 2.896 20 10 FFCDMP C[C@@H]1C[C@H](C)C[N@@H+](CCCNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935380 1065424218 /nfs/dbraw/zinc/42/42/18/1065424218.db2.gz CLXGXMYOORLTQB-BGYRXZFFSA-N 2 1 358.574 2.896 20 10 FFCDMP C[C@@H]1C[C@H](C)C[N@H+](CCCNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935380 1065424224 /nfs/dbraw/zinc/42/42/24/1065424224.db2.gz CLXGXMYOORLTQB-BGYRXZFFSA-N 2 1 358.574 2.896 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4c(c3)OCCO4)cc2F)CC1 ZINC001560257068 1076257249 /nfs/dbraw/zinc/25/72/49/1076257249.db2.gz YIPAJTUHBAMBBT-UHFFFAOYSA-N 2 1 371.456 2.639 20 10 FFCDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@H](C)C1 ZINC000894256428 734826019 /nfs/dbraw/zinc/82/60/19/734826019.db2.gz QIASBHGHTJGSMA-SJLPKXTDSA-N 2 1 350.503 2.936 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+][C@H](C)CCN2CC[NH+](C)CC2)c1 ZINC000769946440 737586334 /nfs/dbraw/zinc/58/63/34/737586334.db2.gz WTKLAZIIKPUQLT-CQSZACIVSA-N 2 1 370.335 2.579 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1O ZINC000824988466 743189690 /nfs/dbraw/zinc/18/96/90/743189690.db2.gz LQZYAKJJSFZDLK-AGUYFDCRSA-N 2 1 355.276 2.878 20 10 FFCDMP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000832546150 745716846 /nfs/dbraw/zinc/71/68/46/745716846.db2.gz XWPISSQKYVCXMV-UHFFFAOYSA-N 2 1 367.921 2.754 20 10 FFCDMP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3cccc(Br)c3O)CC2)C1 ZINC000841102870 747270024 /nfs/dbraw/zinc/27/00/24/747270024.db2.gz ANJVBDXAUPZILU-HOCLYGCPSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(Br)c3O)CC2)C1 ZINC000841102869 747270130 /nfs/dbraw/zinc/27/01/30/747270130.db2.gz ANJVBDXAUPZILU-GOEBONIOSA-N 2 1 369.303 2.873 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1O ZINC000843059181 747757346 /nfs/dbraw/zinc/75/73/46/747757346.db2.gz FNXMXIARYOLRTI-BPNCWPANSA-N 2 1 355.276 2.723 20 10 FFCDMP CC[N@H+]1CC[C@@H]([NH2+]CCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000162800661 972137022 /nfs/dbraw/zinc/13/70/22/972137022.db2.gz SUTAWWNUVAWWAJ-DENIHFKCSA-N 2 1 374.573 2.527 20 10 FFCDMP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1ccc(Cl)cc1O ZINC001275893367 1013149717 /nfs/dbraw/zinc/14/97/17/1013149717.db2.gz WZEQOYSJKIZYPJ-LJQANCHMSA-N 2 1 365.905 2.564 20 10 FFCDMP COc1ccc(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1Cn1cccn1 ZINC000873114316 1013391337 /nfs/dbraw/zinc/39/13/37/1013391337.db2.gz AGGQVLVXICVZJP-SFHVURJKSA-N 2 1 372.513 2.531 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc(F)ccc2n1C ZINC000894188076 978124602 /nfs/dbraw/zinc/12/46/02/978124602.db2.gz QGCCOBTVZBQEFX-CABCVRRESA-N 2 1 359.445 2.820 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2cc(F)ccc2n1C ZINC000894188076 978124606 /nfs/dbraw/zinc/12/46/06/978124606.db2.gz QGCCOBTVZBQEFX-CABCVRRESA-N 2 1 359.445 2.820 20 10 FFCDMP OC1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000877643623 1014658381 /nfs/dbraw/zinc/65/83/81/1014658381.db2.gz LKORYPVVNRFNGC-HXUWFJFHSA-N 2 1 357.542 2.859 20 10 FFCDMP CC[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000765884352 986807044 /nfs/dbraw/zinc/80/70/44/986807044.db2.gz IVWBBWWFFXXLGL-FQEVSTJZSA-N 2 1 360.546 2.736 20 10 FFCDMP CC(C)[N@@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)Cc1ccc(N(C)C)cc1 ZINC000920781270 990913021 /nfs/dbraw/zinc/91/30/21/990913021.db2.gz LTGSHBJZXYNKIQ-UHFFFAOYSA-N 2 1 372.557 2.706 20 10 FFCDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000809756533 994605887 /nfs/dbraw/zinc/60/58/87/994605887.db2.gz SCPAQUPJVNBOIV-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP COc1ccc([C@@H](C[NH3+])C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)cc1 ZINC000844221187 997714515 /nfs/dbraw/zinc/71/45/15/997714515.db2.gz AESJJIVHKPOAGR-IBGZPJMESA-N 2 1 369.509 2.958 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1O ZINC000846166538 1000215013 /nfs/dbraw/zinc/21/50/13/1000215013.db2.gz YZLRJICRDJIKTO-CRAIPNDOSA-N 2 1 356.466 2.818 20 10 FFCDMP COc1ccc([C@@H](CO)[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775701483 1003706228 /nfs/dbraw/zinc/70/62/28/1003706228.db2.gz YXCZRDBQHWVWOZ-JOCHJYFZSA-N 2 1 369.509 2.612 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1n1ccnc1 ZINC000775738146 1003930013 /nfs/dbraw/zinc/93/00/13/1003930013.db2.gz UFXMLDGXRQWLFC-NQIIRXRSSA-N 2 1 353.514 2.718 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@H]1COc2ccccc2O1 ZINC000775643576 1004910073 /nfs/dbraw/zinc/91/00/73/1004910073.db2.gz RFWNUVSRPXSWEY-HXUWFJFHSA-N 2 1 367.493 2.710 20 10 FFCDMP CC[NH+]1CCC([NH+]2CCC(C(=O)NCc3cc(C)ccc3O)CC2)CC1 ZINC000862755670 1009959253 /nfs/dbraw/zinc/95/92/53/1009959253.db2.gz JPMFXKNLGDTQBF-UHFFFAOYSA-N 2 1 359.514 2.513 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CO)c3ccc(F)cc3)cc2F)CC1 ZINC001117748073 1021857052 /nfs/dbraw/zinc/85/70/52/1021857052.db2.gz YDWHKFUQTMUOST-IBGZPJMESA-N 2 1 361.436 2.540 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CC3)C3CCOCC3)cc2F)CC1 ZINC001118248532 1022141950 /nfs/dbraw/zinc/14/19/50/1022141950.db2.gz YMZHFHQLPNGXKW-NRFANRHFSA-N 2 1 361.505 2.872 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccn(C)n1 ZINC000840733278 1027234971 /nfs/dbraw/zinc/23/49/71/1027234971.db2.gz PFXIVWDMGFLDFC-KRWDZBQOSA-N 2 1 353.514 2.803 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000840932592 1029932147 /nfs/dbraw/zinc/93/21/47/1029932147.db2.gz BCCYTPTYYHFJEG-JOCHJYFZSA-N 2 1 353.510 2.788 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000840932592 1029932167 /nfs/dbraw/zinc/93/21/67/1029932167.db2.gz BCCYTPTYYHFJEG-JOCHJYFZSA-N 2 1 353.510 2.788 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1 ZINC001203671487 1030818871 /nfs/dbraw/zinc/81/88/71/1030818871.db2.gz PPFPNALYEBASJG-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1ccc(O)c(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c1 ZINC001203671487 1030818887 /nfs/dbraw/zinc/81/88/87/1030818887.db2.gz PPFPNALYEBASJG-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1ccc(O)c(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c1 ZINC001203671487 1030818911 /nfs/dbraw/zinc/81/89/11/1030818911.db2.gz PPFPNALYEBASJG-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)cc1 ZINC000843048278 1031158185 /nfs/dbraw/zinc/15/81/85/1031158185.db2.gz WVKKZUXBHYMIIC-IBGZPJMESA-N 2 1 360.546 2.600 20 10 FFCDMP Oc1ccc(C[NH+]2CCC3(CC2)C[N@@H+](Cc2ccccc2)CCO3)c(O)c1 ZINC001204274306 1031202155 /nfs/dbraw/zinc/20/21/55/1031202155.db2.gz MYSKVYIYWJEVAZ-UHFFFAOYSA-N 2 1 368.477 2.965 20 10 FFCDMP COC(=O)c1c(C[N@@H+](C)CC2CC[NH+](C)CC2)c2cc(F)ccc2n1C ZINC001204448916 1031296170 /nfs/dbraw/zinc/29/61/70/1031296170.db2.gz GJKYQZMHMWEICO-UHFFFAOYSA-N 2 1 361.461 2.878 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4nc(C)no4)C3)cc2)CC1 ZINC001140306608 1035427974 /nfs/dbraw/zinc/42/79/74/1035427974.db2.gz VIJMFCSBPQEXKO-GOSISDBHSA-N 2 1 355.486 2.509 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C)[C@@H]3CCC4(C3)OCCO4)cc2)CC1 ZINC001140309731 1035429465 /nfs/dbraw/zinc/42/94/65/1035429465.db2.gz RZMVPMFNZFUDDQ-HXUWFJFHSA-N 2 1 359.514 2.556 20 10 FFCDMP CCCCOC(=O)[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140309319 1035429584 /nfs/dbraw/zinc/42/95/84/1035429584.db2.gz BDWRCEOIWJVUQJ-FQEVSTJZSA-N 2 1 373.541 2.994 20 10 FFCDMP COc1ccc2ccc(O)c(C[N@H+]3CC[C@H]4[C@H]3CCN4CC[NH+](C)C)c2c1 ZINC001234546083 1037080686 /nfs/dbraw/zinc/08/06/86/1037080686.db2.gz YUZOCJPBJVZEJC-LEWJYISDSA-N 2 1 369.509 2.764 20 10 FFCDMP CCCCN(CCCC)c1ccc(CN2CC[NH2+]C[C@@]23CC[NH2+]C3)c(O)c1 ZINC001234994522 1037287089 /nfs/dbraw/zinc/28/70/89/1037287089.db2.gz XYTBUCSENLIHJQ-QFIPXVFZSA-N 2 1 374.573 2.936 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715893 1037709078 /nfs/dbraw/zinc/70/90/78/1037709078.db2.gz XDLHRZVYNXXGFY-HXUWFJFHSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715893 1037709093 /nfs/dbraw/zinc/70/90/93/1037709093.db2.gz XDLHRZVYNXXGFY-HXUWFJFHSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715893 1037709107 /nfs/dbraw/zinc/70/91/07/1037709107.db2.gz XDLHRZVYNXXGFY-HXUWFJFHSA-N 2 1 364.537 2.803 20 10 FFCDMP CCC[N@H+](Cc1ccc(I)cc1O)C1CC[NH2+]CC1 ZINC001236184337 1037972850 /nfs/dbraw/zinc/97/28/50/1037972850.db2.gz ITJLBCCKNGJYRV-UHFFFAOYSA-N 2 1 374.266 2.961 20 10 FFCDMP CCC[N@@H+](Cc1ccc(I)cc1O)C1CC[NH2+]CC1 ZINC001236184337 1037972862 /nfs/dbraw/zinc/97/28/62/1037972862.db2.gz ITJLBCCKNGJYRV-UHFFFAOYSA-N 2 1 374.266 2.961 20 10 FFCDMP C[N@@H+](CCN1CC[NH+](C)CC1)Cc1cc(OCc2ccccc2)ccc1O ZINC001236790621 1038271796 /nfs/dbraw/zinc/27/17/96/1038271796.db2.gz XSAMFLIYIORVMN-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP CCOC(=O)[C@@]1(C)CCCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001209845936 1039260470 /nfs/dbraw/zinc/26/04/70/1039260470.db2.gz PNLLZHHCGKZLCR-NRFANRHFSA-N 2 1 359.514 2.652 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@H+]([C@H]4CC[NH2+][C@@H](C)C4)C3)C2)cc1 ZINC001246701986 1039441474 /nfs/dbraw/zinc/44/14/74/1039441474.db2.gz JQPWEGGSBQMSNI-VCOUNFBDSA-N 2 1 373.541 2.755 20 10 FFCDMP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465264 1039474086 /nfs/dbraw/zinc/47/40/86/1039474086.db2.gz WHNDRRZDBQZLKO-QFIPXVFZSA-N 2 1 357.542 2.956 20 10 FFCDMP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465264 1039474093 /nfs/dbraw/zinc/47/40/93/1039474093.db2.gz WHNDRRZDBQZLKO-QFIPXVFZSA-N 2 1 357.542 2.956 20 10 FFCDMP C[NH+]1CCC[C@]2(CCC[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C2)C1 ZINC001278465264 1039474101 /nfs/dbraw/zinc/47/41/01/1039474101.db2.gz WHNDRRZDBQZLKO-QFIPXVFZSA-N 2 1 357.542 2.956 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CC[NH+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552558 /nfs/dbraw/zinc/55/25/58/1039552558.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC[C@@]4(CC[N@H+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552577 /nfs/dbraw/zinc/55/25/77/1039552577.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC[C@@]4(CC[N@@H+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552590 /nfs/dbraw/zinc/55/25/90/1039552590.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CC[N@H+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552607 /nfs/dbraw/zinc/55/26/07/1039552607.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 2 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CC[N@@H+](C)C4)C3)cc2)CC1 ZINC001278474463 1039552611 /nfs/dbraw/zinc/55/26/11/1039552611.db2.gz JHDWNJDBOKDHAB-QFIPXVFZSA-N 2 1 356.558 2.746 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001279533063 1043232131 /nfs/dbraw/zinc/23/21/31/1043232131.db2.gz BXILWFYJCVWTSA-VXKWHMMOSA-N 2 1 356.558 2.887 20 10 FFCDMP C[N@@H+]1CC[C@H]2C[NH+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@H]2CC1 ZINC001279547261 1043241570 /nfs/dbraw/zinc/24/15/70/1043241570.db2.gz BOMNHCMJXVYSAK-HDICACEKSA-N 2 1 355.526 2.865 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@@H+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@H]2CC1 ZINC001279547261 1043241575 /nfs/dbraw/zinc/24/15/75/1043241575.db2.gz BOMNHCMJXVYSAK-HDICACEKSA-N 2 1 355.526 2.865 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@H+](Cc3cc4c5c(c3O)CCCN5CCC4)C[C@H]2CC1 ZINC001279547261 1043241582 /nfs/dbraw/zinc/24/15/82/1043241582.db2.gz BOMNHCMJXVYSAK-HDICACEKSA-N 2 1 355.526 2.865 20 10 FFCDMP Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001324731436 1046192739 /nfs/dbraw/zinc/19/27/39/1046192739.db2.gz LLKOGGHMSJYSEP-QGZVFWFLSA-N 2 1 373.476 2.649 20 10 FFCDMP Cc1noc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001324731436 1046192747 /nfs/dbraw/zinc/19/27/47/1046192747.db2.gz LLKOGGHMSJYSEP-QGZVFWFLSA-N 2 1 373.476 2.649 20 10 FFCDMP CCC[NH+]1CCC(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001200231506 1056102069 /nfs/dbraw/zinc/10/20/69/1056102069.db2.gz CVJDCOZBHPWNSS-UHFFFAOYSA-N 3 1 362.537 2.789 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]C2CCN(CC[NH+](C)C)CC2)c1 ZINC001461028200 1061191555 /nfs/dbraw/zinc/19/15/55/1061191555.db2.gz PURFKNZERKANMB-UHFFFAOYSA-N 2 1 370.335 2.579 20 10 FFCDMP COc1c([O-])c(C[N@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463772 1061634629 /nfs/dbraw/zinc/63/46/29/1061634629.db2.gz WHQWJVJERGETJW-UKRRQHHQSA-N 2 1 351.447 2.861 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC001558723790 1076063631 /nfs/dbraw/zinc/06/36/31/1076063631.db2.gz VMWIDNNSTMDKFG-OAQYLSRUSA-N 2 1 368.525 2.604 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC001558723790 1076063637 /nfs/dbraw/zinc/06/36/37/1076063637.db2.gz VMWIDNNSTMDKFG-OAQYLSRUSA-N 2 1 368.525 2.604 20 10 FFCDMP CCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)c(O)c1 ZINC000179517236 509491600 /nfs/dbraw/zinc/49/16/00/509491600.db2.gz VUNSKTKDUDHJHS-MRXNPFEDSA-N 2 1 350.503 2.706 20 10 FFCDMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H](C)C1 ZINC000839144705 746787395 /nfs/dbraw/zinc/78/73/95/746787395.db2.gz JRKPGYMCMFAHKT-KDOFPFPSSA-N 2 1 353.457 2.621 20 10 FFCDMP CC[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H](C)C1 ZINC000839144705 746787400 /nfs/dbraw/zinc/78/74/00/746787400.db2.gz JRKPGYMCMFAHKT-KDOFPFPSSA-N 2 1 353.457 2.621 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902495 748131955 /nfs/dbraw/zinc/13/19/55/748131955.db2.gz OABNKSZPCOYCAH-MAZHCROVSA-N 2 1 354.878 2.773 20 10 FFCDMP O[C@H]1CC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921979181 987430332 /nfs/dbraw/zinc/43/03/32/987430332.db2.gz DECPIWHOVHJUAO-NRFANRHFSA-N 2 1 352.478 2.868 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)[C@@H]([NH3+])Cc2ccccc2)cc1 ZINC000844220522 997710793 /nfs/dbraw/zinc/71/07/93/997710793.db2.gz GNEANMRLVFBXBV-VXKWHMMOSA-N 2 1 355.526 2.896 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1O ZINC000846166540 1000215095 /nfs/dbraw/zinc/21/50/95/1000215095.db2.gz YZLRJICRDJIKTO-QAPCUYQASA-N 2 1 356.466 2.818 20 10 FFCDMP CN(C)c1nc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)cc[nH+]1 ZINC000768528103 1000284512 /nfs/dbraw/zinc/28/45/12/1000284512.db2.gz MZRVFCWQHRDHAK-UHFFFAOYSA-N 2 1 366.513 2.687 20 10 FFCDMP COC(=O)c1cc2ccccc2c(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)c1O ZINC000793741391 1003488754 /nfs/dbraw/zinc/48/87/54/1003488754.db2.gz CPQWZXARCIFJDX-NRFANRHFSA-N 2 1 354.450 2.860 20 10 FFCDMP COC(=O)c1cc2ccccc2c(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)c1O ZINC000793741391 1003488759 /nfs/dbraw/zinc/48/87/59/1003488759.db2.gz CPQWZXARCIFJDX-NRFANRHFSA-N 2 1 354.450 2.860 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(Br)c1 ZINC001205654895 1004669259 /nfs/dbraw/zinc/66/92/59/1004669259.db2.gz XZRQWSXLBAELNQ-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP CN(C)c1ccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000850357755 1005810944 /nfs/dbraw/zinc/81/09/44/1005810944.db2.gz ULRBINCKYKMRBP-IBGZPJMESA-N 2 1 357.473 2.748 20 10 FFCDMP Oc1c(F)cc(F)cc1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000882986955 1006588853 /nfs/dbraw/zinc/58/88/53/1006588853.db2.gz PAUZYCRDUBGLIQ-UHFFFAOYSA-N 2 1 362.420 2.917 20 10 FFCDMP CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775199887 1006734925 /nfs/dbraw/zinc/73/49/25/1006734925.db2.gz HEUBRONNNXPHRC-QFIPXVFZSA-N 2 1 373.541 2.850 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942906 1007818469 /nfs/dbraw/zinc/81/84/69/1007818469.db2.gz RMRASBAXCXJMNN-RZUBCFFCSA-N 2 1 366.509 2.598 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3c4ccccc4CC[C@H]3O)cc2F)CC1 ZINC001179665436 1009409460 /nfs/dbraw/zinc/40/94/60/1009409460.db2.gz BKLQWDPXDZOKRF-YADHBBJMSA-N 2 1 369.484 2.716 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)cc2)CC1 ZINC000777439482 1011292698 /nfs/dbraw/zinc/29/26/98/1011292698.db2.gz HZSPTAAADDUHKZ-QFIPXVFZSA-N 2 1 369.484 2.671 20 10 FFCDMP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1cc(Cl)ccc1O ZINC001275248686 1012139963 /nfs/dbraw/zinc/13/99/63/1012139963.db2.gz QSGIPYHHJQYNNV-LJQANCHMSA-N 2 1 365.905 2.564 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1cc(CO)on1 ZINC000925679179 1017814759 /nfs/dbraw/zinc/81/47/59/1017814759.db2.gz YRRNVSULQOBGNY-MRXNPFEDSA-N 2 1 370.497 2.550 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321205 1032890380 /nfs/dbraw/zinc/89/03/80/1032890380.db2.gz RRVTXMSPGFHVLM-OAQYLSRUSA-N 2 1 360.521 2.686 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)c(F)c2)CC1 ZINC001222321205 1032890406 /nfs/dbraw/zinc/89/04/06/1032890406.db2.gz RRVTXMSPGFHVLM-OAQYLSRUSA-N 2 1 360.521 2.686 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1 ZINC001116564935 1021285919 /nfs/dbraw/zinc/28/59/19/1021285919.db2.gz BMZSWVLAAJOWPD-QGZVFWFLSA-N 2 1 369.509 2.999 20 10 FFCDMP COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000779605189 1024255522 /nfs/dbraw/zinc/25/55/22/1024255522.db2.gz RLEQGCFPSNMJGN-LJQANCHMSA-N 2 1 373.541 2.850 20 10 FFCDMP CC[NH+]1CCC([NH+]2CCC(C(=O)N[C@@H](C)c3ccccc3O)CC2)CC1 ZINC000827963892 1029583154 /nfs/dbraw/zinc/58/31/54/1029583154.db2.gz DGMZEJINQMDCHX-INIZCTEOSA-N 2 1 359.514 2.766 20 10 FFCDMP CO[C@@]1(C(F)(F)F)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000783718267 1030250032 /nfs/dbraw/zinc/25/00/32/1030250032.db2.gz PUPMHLUVUUBLPL-SFHVURJKSA-N 2 1 371.447 2.982 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@H+](C2CCN(Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001203931043 1030990907 /nfs/dbraw/zinc/99/09/07/1030990907.db2.gz MJLXPJQKVZGSBP-IBGZPJMESA-N 2 1 373.541 2.992 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205635925 1031893819 /nfs/dbraw/zinc/89/38/19/1031893819.db2.gz BGNCFBUENKCFOY-NVXWUHKLSA-N 2 1 351.922 2.983 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(I)cc2O)CC[C@H]1C[NH3+] ZINC001205637831 1031894797 /nfs/dbraw/zinc/89/47/97/1031894797.db2.gz JESIJSXGXOCVFN-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@H]1C[NH3+] ZINC001205654149 1031907846 /nfs/dbraw/zinc/90/78/46/1031907846.db2.gz WOHLPRFDPMFMDS-CVEARBPZSA-N 2 1 351.922 2.983 20 10 FFCDMP CC[N@@H+](C)[C@@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281725 1034698835 /nfs/dbraw/zinc/69/88/35/1034698835.db2.gz VWJSDHRARUKKQD-WOJBJXKFSA-N 2 1 354.498 2.562 20 10 FFCDMP COc1cc(C[N@@H+](CCO)Cc2cccs2)cc(C[NH+](C)C)c1O ZINC001139256448 1035029907 /nfs/dbraw/zinc/02/99/07/1035029907.db2.gz BSKLXLVPVYUNMF-UHFFFAOYSA-N 2 1 350.484 2.518 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139257152 1035030282 /nfs/dbraw/zinc/03/02/82/1035030282.db2.gz SYUNZCBSRFSOQR-HNNXBMFYSA-N 2 1 364.486 2.626 20 10 FFCDMP CCCCOC(=O)[C@@H]1CC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259677 1035031302 /nfs/dbraw/zinc/03/13/02/1035031302.db2.gz AOJQUJQEGJVFJC-MRXNPFEDSA-N 2 1 364.486 2.628 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@]1(O)C(F)(F)F ZINC001139408739 1035092166 /nfs/dbraw/zinc/09/21/66/1035092166.db2.gz PWFNIOSZSKAOSX-CRAIPNDOSA-N 2 1 371.447 2.574 20 10 FFCDMP CCOC(=O)c1c(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c2ccccc2n1C ZINC001233273156 1036479634 /nfs/dbraw/zinc/47/96/34/1036479634.db2.gz QAWXMAXSOMRGRD-NRFANRHFSA-N 2 1 355.482 2.883 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCCC[NH2+]4)CC3)cc2)CC1 ZINC001235229162 1037424187 /nfs/dbraw/zinc/42/41/87/1037424187.db2.gz OOHWTQRGCDCUPK-QFIPXVFZSA-N 2 1 356.558 2.793 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@@H+](CC4CC[NH2+]CC4)C3)C2)cc1 ZINC001207435382 1037438125 /nfs/dbraw/zinc/43/81/25/1037438125.db2.gz MXWMAONNDUNJCI-QFIPXVFZSA-N 2 1 373.541 2.614 20 10 FFCDMP Cc1cccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3C(C)C)C2)c1O ZINC001231592974 1037711479 /nfs/dbraw/zinc/71/14/79/1037711479.db2.gz QWZDZCAPNJZTGG-AABGKKOBSA-N 2 1 369.513 2.666 20 10 FFCDMP c1c2c(nn1-c1ccccc1)CC[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001236040371 1037904498 /nfs/dbraw/zinc/90/44/98/1037904498.db2.gz BRINELQSOKETRW-UHFFFAOYSA-N 2 1 373.504 2.840 20 10 FFCDMP c1c2c(nn1-c1ccccc1)CC[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001236040371 1037904504 /nfs/dbraw/zinc/90/45/04/1037904504.db2.gz BRINELQSOKETRW-UHFFFAOYSA-N 2 1 373.504 2.840 20 10 FFCDMP [NH3+]C1CN([C@@H]2CCC[N@@H+](Cc3cc(-c4ccc(F)cc4)ccc3O)C2)C1 ZINC001236077490 1037921285 /nfs/dbraw/zinc/92/12/85/1037921285.db2.gz IFVOCQRETYESPV-HXUWFJFHSA-N 2 1 355.457 2.806 20 10 FFCDMP CN1CCN(c2ccc(CN(C[C@@H]3CCC[NH2+]C3)C3CC3)c(F)c2)CC1 ZINC001236602485 1038149324 /nfs/dbraw/zinc/14/93/24/1038149324.db2.gz WHDRMYNKDRJVSB-QGZVFWFLSA-N 3 1 360.521 2.542 20 10 FFCDMP COc1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)c(O)cc1Br ZINC001236752902 1038237639 /nfs/dbraw/zinc/23/76/39/1038237639.db2.gz IILAQYHKCXBOND-UHFFFAOYSA-N 2 1 357.292 2.937 20 10 FFCDMP CC(C)c1ccc(C[NH+]2CCC([NH+]3CCC(C(N)=O)CC3)CC2)c(O)c1 ZINC001237055367 1038425471 /nfs/dbraw/zinc/42/54/71/1038425471.db2.gz NGOSJPVTPUXYIQ-UHFFFAOYSA-N 2 1 359.514 2.677 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+](C3CCC3)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155897 1038456333 /nfs/dbraw/zinc/45/63/33/1038456333.db2.gz USTAPJDURWXXFU-QFIPXVFZSA-N 3 1 356.558 2.935 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C3CCC3)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155897 1038456338 /nfs/dbraw/zinc/45/63/38/1038456338.db2.gz USTAPJDURWXXFU-QFIPXVFZSA-N 3 1 356.558 2.935 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C2 ZINC001279686297 1043467065 /nfs/dbraw/zinc/46/70/65/1043467065.db2.gz TYRBLZPPWSNGDE-UHFFFAOYSA-N 2 1 371.447 2.870 20 10 FFCDMP C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319811158 1045276854 /nfs/dbraw/zinc/27/68/54/1045276854.db2.gz VASLUTCIXDTPCX-GOSISDBHSA-N 2 1 371.500 2.961 20 10 FFCDMP C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319811158 1045276860 /nfs/dbraw/zinc/27/68/60/1045276860.db2.gz VASLUTCIXDTPCX-GOSISDBHSA-N 2 1 371.500 2.961 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ncc[nH]4)CC3)cc2F)CC1 ZINC001324732433 1046192516 /nfs/dbraw/zinc/19/25/16/1046192516.db2.gz POXSXISAYCPLJS-UHFFFAOYSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC3(CO)CC4(CCC4)C3)cc2F)CC1 ZINC001324870844 1046264502 /nfs/dbraw/zinc/26/45/02/1046264502.db2.gz VMGPGTRTJCTHCZ-UHFFFAOYSA-N 2 1 361.505 2.610 20 10 FFCDMP C[C@H](O)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001330315401 1049130302 /nfs/dbraw/zinc/13/03/02/1049130302.db2.gz ISUIUMHVZJZQLZ-HRAATJIYSA-N 2 1 357.473 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)cc2F)CC1 ZINC001330781283 1049324252 /nfs/dbraw/zinc/32/42/52/1049324252.db2.gz WFMGPEBJQWMGIH-HXUWFJFHSA-N 2 1 374.548 2.789 20 10 FFCDMP Cc1ccccc1[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001308304247 1052444378 /nfs/dbraw/zinc/44/43/78/1052444378.db2.gz XRJQLWXJODPLGJ-FQEVSTJZSA-N 2 1 357.473 2.709 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](O)Cc1ccccc1 ZINC001461363647 1061300396 /nfs/dbraw/zinc/30/03/96/1061300396.db2.gz JSQRHKHKHVNPNO-HTAPYJJXSA-N 2 1 371.500 2.659 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](O)Cc1ccccc1 ZINC001461363653 1061300852 /nfs/dbraw/zinc/30/08/52/1061300852.db2.gz JSQRHKHKHVNPNO-VGOFRKELSA-N 2 1 371.500 2.659 20 10 FFCDMP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cc1C ZINC001474019581 1065441986 /nfs/dbraw/zinc/44/19/86/1065441986.db2.gz DQLNEPJZDBIPOO-RTWAWAEBSA-N 2 1 354.494 2.976 20 10 FFCDMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1C ZINC001474019581 1065441992 /nfs/dbraw/zinc/44/19/92/1065441992.db2.gz DQLNEPJZDBIPOO-RTWAWAEBSA-N 2 1 354.494 2.976 20 10 FFCDMP CCC[NH2+][C@H](C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551310 1078375691 /nfs/dbraw/zinc/37/56/91/1078375691.db2.gz OSIAMALYUUOUDH-CZUORRHYSA-N 2 1 353.894 2.514 20 10 FFCDMP CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722857 1076063608 /nfs/dbraw/zinc/06/36/08/1076063608.db2.gz DFEIEGXJVXGLSG-ICSRJNTNSA-N 2 1 360.546 2.594 20 10 FFCDMP C[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(Br)ccc1O ZINC000185366625 510824153 /nfs/dbraw/zinc/82/41/53/510824153.db2.gz ABAPROIKDFGIPS-CQSZACIVSA-N 2 1 370.335 2.833 20 10 FFCDMP Cc1cc(Br)cc(C[N@@H+](C)CCCN2CC[NH+](C)CC2)c1O ZINC000289439128 511102339 /nfs/dbraw/zinc/10/23/39/511102339.db2.gz LRLTTZTWEKCLBR-UHFFFAOYSA-N 2 1 370.335 2.532 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CCC[N@@H+]3CCCO[C@H](C)C3)CC2)cc1 ZINC000365330472 511383673 /nfs/dbraw/zinc/38/36/73/511383673.db2.gz LUQRMDOYXKCFSW-GOSISDBHSA-N 2 1 361.530 2.755 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CCC[N@H+]3CCCO[C@H](C)C3)CC2)cc1 ZINC000365330472 511383678 /nfs/dbraw/zinc/38/36/78/511383678.db2.gz LUQRMDOYXKCFSW-GOSISDBHSA-N 2 1 361.530 2.755 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH+]2CCCC2)C1 ZINC000443916769 514071374 /nfs/dbraw/zinc/07/13/74/514071374.db2.gz BTLGMBHHNRKLHL-UHFFFAOYSA-N 2 1 368.525 2.620 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[NH+]2C)C1 ZINC000444236040 514164249 /nfs/dbraw/zinc/16/42/49/514164249.db2.gz KAZPNBIHPQSRLI-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[N@@H+]2C)C1 ZINC000444236040 514164253 /nfs/dbraw/zinc/16/42/53/514164253.db2.gz KAZPNBIHPQSRLI-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[N@H+]2C)C1 ZINC000444236040 514164255 /nfs/dbraw/zinc/16/42/55/514164255.db2.gz KAZPNBIHPQSRLI-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP COc1cccc(O)c1C[NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000725841473 734395836 /nfs/dbraw/zinc/39/58/36/734395836.db2.gz JVLXVYUJSQWAAC-INIZCTEOSA-N 2 1 361.511 2.541 20 10 FFCDMP C[N@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000816610568 742047158 /nfs/dbraw/zinc/04/71/58/742047158.db2.gz PLGYVVHFXPAEFE-HNNXBMFYSA-N 2 1 355.885 2.785 20 10 FFCDMP C[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000816610568 742047162 /nfs/dbraw/zinc/04/71/62/742047162.db2.gz PLGYVVHFXPAEFE-HNNXBMFYSA-N 2 1 355.885 2.785 20 10 FFCDMP COC[C@@]1(C[NH2+][C@@H](C)c2cc(Br)cc(C)c2O)CCC[NH2+]1 ZINC000817974289 742226165 /nfs/dbraw/zinc/22/61/65/742226165.db2.gz KODVWQRITBWDJM-LRDDRELGSA-N 2 1 357.292 2.882 20 10 FFCDMP Cn1ccc([C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000896492332 971510460 /nfs/dbraw/zinc/51/04/60/971510460.db2.gz CBHSFMNINYNLQD-LJQANCHMSA-N 2 1 353.514 2.552 20 10 FFCDMP COC(=O)c1c(C[NH2+]CCCn2cc[nH+]c2C)c2cc(F)ccc2n1C ZINC000894193189 978125981 /nfs/dbraw/zinc/12/59/81/978125981.db2.gz HBUORZFCVGAOFM-UHFFFAOYSA-N 2 1 358.417 2.789 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206027864 1032114222 /nfs/dbraw/zinc/11/42/22/1032114222.db2.gz WZRJOWQKLFFCQU-CVEARBPZSA-N 2 1 351.922 2.983 20 10 FFCDMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447948 1000250664 /nfs/dbraw/zinc/25/06/64/1000250664.db2.gz RYMNOJACQADSSD-GUXCAODWSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447948 1000250667 /nfs/dbraw/zinc/25/06/67/1000250667.db2.gz RYMNOJACQADSSD-GUXCAODWSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447948 1000250669 /nfs/dbraw/zinc/25/06/69/1000250669.db2.gz RYMNOJACQADSSD-GUXCAODWSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447948 1000250671 /nfs/dbraw/zinc/25/06/71/1000250671.db2.gz RYMNOJACQADSSD-GUXCAODWSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817887754 1007785562 /nfs/dbraw/zinc/78/55/62/1007785562.db2.gz DLSZPSUVHMHJJZ-OXQOHEQNSA-N 2 1 357.473 2.710 20 10 FFCDMP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1c(O)cccc1F ZINC000886522399 1008717903 /nfs/dbraw/zinc/71/79/03/1008717903.db2.gz IGEHUVIQFSFGLG-MRXNPFEDSA-N 2 1 373.476 2.574 20 10 FFCDMP C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177830545 1008761306 /nfs/dbraw/zinc/76/13/06/1008761306.db2.gz XRKVVYBIATXJCB-UTKZUKDTSA-N 2 1 371.500 2.832 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c2ncnn21 ZINC000925677204 1017814098 /nfs/dbraw/zinc/81/40/98/1017814098.db2.gz ORXZDSWFDHHEAO-UZLBHIALSA-N 2 1 366.513 2.606 20 10 FFCDMP [NH3+]CC1(O)CC[NH+](CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 ZINC000842480572 1030754752 /nfs/dbraw/zinc/75/47/52/1030754752.db2.gz RWWKCZGLUMJDQS-UHFFFAOYSA-N 2 1 367.453 2.826 20 10 FFCDMP COc1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c(O)c1 ZINC001203622818 1030792971 /nfs/dbraw/zinc/79/29/71/1030792971.db2.gz CBBFEXPWCZHTTJ-UHFFFAOYSA-N 2 1 370.497 2.642 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753578 1030906968 /nfs/dbraw/zinc/90/69/68/1030906968.db2.gz FKYFNVLBFUAYAN-HMXCVIKNSA-N 3 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753578 1030906974 /nfs/dbraw/zinc/90/69/74/1030906974.db2.gz FKYFNVLBFUAYAN-HMXCVIKNSA-N 2 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@@H]43)cc2F)CC1 ZINC000796753578 1030906985 /nfs/dbraw/zinc/90/69/85/1030906985.db2.gz FKYFNVLBFUAYAN-HMXCVIKNSA-N 2 1 374.548 2.930 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128884 1031196725 /nfs/dbraw/zinc/19/67/25/1031196725.db2.gz YIXGTLZIKMJBAJ-RBUKOAKNSA-N 2 1 361.505 2.874 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@]1(O)CCc2ccccc21 ZINC000843420609 1031394104 /nfs/dbraw/zinc/39/41/04/1031394104.db2.gz IVXFMVCTGUEUOX-HSZRJFAPSA-N 2 1 365.521 2.704 20 10 FFCDMP [NH3+]C[C@@]1(O)CCC[N@@H+](Cc2cc(OCc3ccccc3)ccc2O)CC1 ZINC001205247359 1031624616 /nfs/dbraw/zinc/62/46/16/1031624616.db2.gz FQHOGIGKXHWQJY-OAQYLSRUSA-N 2 1 356.466 2.647 20 10 FFCDMP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001205725002 1031956362 /nfs/dbraw/zinc/95/63/62/1031956362.db2.gz BYCDHNHYOXWQQM-OAQYLSRUSA-N 2 1 356.466 2.647 20 10 FFCDMP COc1cc(C[N@H+](C)Cc2cnc3ccccn23)cc(C[NH+](C)C)c1O ZINC001139253992 1035030351 /nfs/dbraw/zinc/03/03/51/1035030351.db2.gz APDHQZMMIDTCRS-UHFFFAOYSA-N 2 1 354.454 2.742 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2cnc3ccccn23)cc(C[NH+](C)C)c1O ZINC001139253992 1035030356 /nfs/dbraw/zinc/03/03/56/1035030356.db2.gz APDHQZMMIDTCRS-UHFFFAOYSA-N 2 1 354.454 2.742 20 10 FFCDMP COc1cc(CN2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257662 1035032293 /nfs/dbraw/zinc/03/22/93/1035032293.db2.gz ZWVBASAIUOHLQJ-HXUWFJFHSA-N 2 1 369.509 2.951 20 10 FFCDMP COc1cc(C[N@@H+]2CCN(C)[C@@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257662 1035032306 /nfs/dbraw/zinc/03/23/06/1035032306.db2.gz ZWVBASAIUOHLQJ-HXUWFJFHSA-N 2 1 369.509 2.951 20 10 FFCDMP COc1cc(C[N@H+]2CCN(C)[C@@H](c3ccccc3)C2)cc(C[NH+](C)C)c1O ZINC001139257662 1035032315 /nfs/dbraw/zinc/03/23/15/1035032315.db2.gz ZWVBASAIUOHLQJ-HXUWFJFHSA-N 2 1 369.509 2.951 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC001140300792 1035424033 /nfs/dbraw/zinc/42/40/33/1035424033.db2.gz UIGIFWYKKJMAPK-UHFFFAOYSA-N 2 1 365.525 2.546 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4ccccn4)C3)cc2)CC1 ZINC001140309340 1035429456 /nfs/dbraw/zinc/42/94/56/1035429456.db2.gz BRXWUIHTKJMARA-NRFANRHFSA-N 2 1 366.509 2.877 20 10 FFCDMP c1cn2c(n1)[C@H]([NH2+]Cc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CC2 ZINC000834697337 1035431276 /nfs/dbraw/zinc/43/12/76/1035431276.db2.gz ITEZOYDZSWHYPB-HXUWFJFHSA-N 2 1 351.498 2.650 20 10 FFCDMP CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC001232363735 1035625535 /nfs/dbraw/zinc/62/55/35/1035625535.db2.gz OIUFCDWDJOEKJW-UHFFFAOYSA-N 2 1 367.541 2.922 20 10 FFCDMP Oc1cc(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)cc(O)c1O ZINC001233012231 1036245516 /nfs/dbraw/zinc/24/55/16/1036245516.db2.gz KAQIXSQYTUYBIQ-UHFFFAOYSA-N 2 1 358.438 2.885 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1O ZINC001233485815 1036654138 /nfs/dbraw/zinc/65/41/38/1036654138.db2.gz LJUZRVJIRSHOLQ-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1O ZINC001233485815 1036654141 /nfs/dbraw/zinc/65/41/41/1036654141.db2.gz LJUZRVJIRSHOLQ-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1O ZINC001233485815 1036654146 /nfs/dbraw/zinc/65/41/46/1036654146.db2.gz LJUZRVJIRSHOLQ-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1O ZINC001233485815 1036654148 /nfs/dbraw/zinc/65/41/48/1036654148.db2.gz LJUZRVJIRSHOLQ-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)cc1Cl ZINC001235717515 1037709629 /nfs/dbraw/zinc/70/96/29/1037709629.db2.gz HQIZTQUUJGJLOA-UHFFFAOYSA-N 2 1 351.922 2.998 20 10 FFCDMP COC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)cc(C)cc3O)CC2)C1 ZINC001231850695 1037945616 /nfs/dbraw/zinc/94/56/16/1037945616.db2.gz UCDHNBZNWQAYAI-KRWDZBQOSA-N 2 1 360.498 2.858 20 10 FFCDMP COc1ccc(N2CCOC[C@@]3(CCC[N@@H+](C4CC[NH+](C)CC4)C3)C2)cc1 ZINC001256202876 1038429539 /nfs/dbraw/zinc/42/95/39/1038429539.db2.gz ANXRGHVERHDALE-JOCHJYFZSA-N 2 1 373.541 2.708 20 10 FFCDMP COc1ccc(N2CCOC[C@@]3(CCC[N@H+](C4CC[NH+](C)CC4)C3)C2)cc1 ZINC001256202876 1038429547 /nfs/dbraw/zinc/42/95/47/1038429547.db2.gz ANXRGHVERHDALE-JOCHJYFZSA-N 2 1 373.541 2.708 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCN[C@@H]3CC[NH2+][C@H](C(C)C)C3)CC2)cc1 ZINC001246185118 1039267628 /nfs/dbraw/zinc/26/76/28/1039267628.db2.gz SFBFQWJTAWPANX-KNQAVFIVSA-N 2 1 374.573 2.574 20 10 FFCDMP Cc1cc(C[NH+]2CC3(C2)CC[NH+](Cc2ccc(C)cc2O)CC3)n(C)n1 ZINC001279338012 1043010767 /nfs/dbraw/zinc/01/07/67/1043010767.db2.gz FWZBUWHRMHWEQU-UHFFFAOYSA-N 2 1 354.498 2.841 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCC12C[NH2+]C2 ZINC001237432981 1043157879 /nfs/dbraw/zinc/15/78/79/1043157879.db2.gz YOLJKTQSOMCUHW-KRWDZBQOSA-N 2 1 360.498 2.664 20 10 FFCDMP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cc(O)c(O)cc1O)Cc1ccccc12 ZINC001279515765 1043212301 /nfs/dbraw/zinc/21/23/01/1043212301.db2.gz XJVPGIYTNSOGTN-UHFFFAOYSA-N 2 1 354.450 2.783 20 10 FFCDMP C[N@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001319828760 1045281526 /nfs/dbraw/zinc/28/15/26/1045281526.db2.gz MHPWDPCMYOERJY-HXUWFJFHSA-N 2 1 374.548 2.741 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001319828760 1045281533 /nfs/dbraw/zinc/28/15/33/1045281533.db2.gz MHPWDPCMYOERJY-HXUWFJFHSA-N 2 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C4CCOCC4)C3)cc2F)CC1 ZINC001319961631 1045313621 /nfs/dbraw/zinc/31/36/21/1045313621.db2.gz CXUIVLUVWARHLM-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C4CCOCC4)C3)cc2F)CC1 ZINC001319961631 1045313628 /nfs/dbraw/zinc/31/36/28/1045313628.db2.gz CXUIVLUVWARHLM-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)CCc3ccccc3)cc2F)CC1 ZINC001320047057 1045337140 /nfs/dbraw/zinc/33/71/40/1045337140.db2.gz PCPPENKUMSILFC-HXUWFJFHSA-N 2 1 371.500 2.661 20 10 FFCDMP CC(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccnn1C ZINC001320780256 1045467020 /nfs/dbraw/zinc/46/70/20/1045467020.db2.gz YAFDNCVHANRGDD-SFHVURJKSA-N 2 1 373.520 2.840 20 10 FFCDMP Cc1ccc([C@@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001324758868 1046210295 /nfs/dbraw/zinc/21/02/95/1046210295.db2.gz MFCZFWCTEHSHJE-NRFANRHFSA-N 2 1 357.473 2.709 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H](O)C[C@@H]3c3ccccc3)cc2F)CC1 ZINC001331397779 1047914169 /nfs/dbraw/zinc/91/41/69/1047914169.db2.gz FLLARMMAIKDCNV-DENIHFKCSA-N 2 1 369.484 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H](O)C[C@@H]3c3ccccc3)cc2F)CC1 ZINC001331397779 1047914181 /nfs/dbraw/zinc/91/41/81/1047914181.db2.gz FLLARMMAIKDCNV-DENIHFKCSA-N 2 1 369.484 2.885 20 10 FFCDMP C[C@H]1CC2(C[N@H+]1Cc1ccc(N3CCN(C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919360 1048094496 /nfs/dbraw/zinc/09/44/96/1048094496.db2.gz ZPIXTBBLVVSNJG-KRWDZBQOSA-N 3 1 360.521 2.542 20 10 FFCDMP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919360 1048094510 /nfs/dbraw/zinc/09/45/10/1048094510.db2.gz ZPIXTBBLVVSNJG-KRWDZBQOSA-N 3 1 360.521 2.542 20 10 FFCDMP C[C@H]1CC2(C[N@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919360 1048094522 /nfs/dbraw/zinc/09/45/22/1048094522.db2.gz ZPIXTBBLVVSNJG-KRWDZBQOSA-N 3 1 360.521 2.542 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353545 1048681705 /nfs/dbraw/zinc/68/17/05/1048681705.db2.gz FZRKCYQTQLDXDM-HXUWFJFHSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353545 1048681714 /nfs/dbraw/zinc/68/17/14/1048681714.db2.gz FZRKCYQTQLDXDM-HXUWFJFHSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cc2F)CC1 ZINC001329353545 1048681723 /nfs/dbraw/zinc/68/17/23/1048681723.db2.gz FZRKCYQTQLDXDM-HXUWFJFHSA-N 3 1 374.548 2.789 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](O)c1ccccc1 ZINC001329836872 1048933595 /nfs/dbraw/zinc/93/35/95/1048933595.db2.gz YROIZRHEFKQYER-KKSFZXQISA-N 2 1 357.473 2.789 20 10 FFCDMP Cn1ccnc1[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001343927565 1052493476 /nfs/dbraw/zinc/49/34/76/1052493476.db2.gz PCNWSWZWYGWQJX-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001343927565 1052493480 /nfs/dbraw/zinc/49/34/80/1052493480.db2.gz PCNWSWZWYGWQJX-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP CCc1cccc(C[NH+]2CCC(CC(=O)N3CC[NH+](CC)CC3)CC2)c1O ZINC000848885682 1055303213 /nfs/dbraw/zinc/30/32/13/1055303213.db2.gz MBSXEAVCZGYKPY-UHFFFAOYSA-N 2 1 373.541 2.721 20 10 FFCDMP Cc1noc(C)c1C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001200639711 1058902130 /nfs/dbraw/zinc/90/21/30/1058902130.db2.gz JSSAYHUIOPZJKL-CQSZACIVSA-N 2 1 360.477 2.903 20 10 FFCDMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001462191186 1061532245 /nfs/dbraw/zinc/53/22/45/1061532245.db2.gz IASLJIKSPZPYQP-KRWDZBQOSA-N 2 1 368.516 2.879 20 10 FFCDMP C[C@@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001472281309 1064998171 /nfs/dbraw/zinc/99/81/71/1064998171.db2.gz VBFIUUQCQZBJNV-CLWJZODNSA-N 2 1 360.546 2.733 20 10 FFCDMP COc1c(O)c(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000278548879 510999040 /nfs/dbraw/zinc/99/90/40/510999040.db2.gz YTBIPGLMQRXLIC-AWEZNQCLSA-N 2 1 351.447 2.767 20 10 FFCDMP COc1c(O)c(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000278548879 510999041 /nfs/dbraw/zinc/99/90/41/510999041.db2.gz YTBIPGLMQRXLIC-AWEZNQCLSA-N 2 1 351.447 2.767 20 10 FFCDMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273446703 511526141 /nfs/dbraw/zinc/52/61/41/511526141.db2.gz NXIYVQLHPNALDG-KSSFIOAISA-N 2 1 371.437 2.718 20 10 FFCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H](C(N)=O)C2)c1O ZINC000808693096 741252618 /nfs/dbraw/zinc/25/26/18/741252618.db2.gz WAPVYKFEGHJBID-KBPBESRZSA-N 2 1 353.894 2.592 20 10 FFCDMP CCn1nc(C)c(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC000877664613 1014666599 /nfs/dbraw/zinc/66/65/99/1014666599.db2.gz URPFKFHGYQHAFV-UHFFFAOYSA-N 2 1 355.530 2.904 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206011530 1032107119 /nfs/dbraw/zinc/10/71/19/1032107119.db2.gz DGPJJNKOOHXZKZ-NVXWUHKLSA-N 2 1 351.922 2.983 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cc1Br ZINC001206011585 1032108353 /nfs/dbraw/zinc/10/83/53/1032108353.db2.gz FAUTZOWZIXJFMR-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000879650588 1015625933 /nfs/dbraw/zinc/62/59/33/1015625933.db2.gz IKETWWAAGJMAIB-SCTDSRPQSA-N 2 1 367.493 2.822 20 10 FFCDMP Oc1ccccc1C[N@@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000903893114 1016291620 /nfs/dbraw/zinc/29/16/20/1016291620.db2.gz QNSZWNVPLKBWBG-GOSISDBHSA-N 2 1 355.486 2.853 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1O ZINC000846141882 1000217610 /nfs/dbraw/zinc/21/76/10/1000217610.db2.gz BGTDEOPYFQHPSK-QGZVFWFLSA-N 2 1 369.509 2.999 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000769329470 1000493687 /nfs/dbraw/zinc/49/36/87/1000493687.db2.gz PHOBAFDUCUZTOW-UHFFFAOYSA-N 2 1 353.510 2.950 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H]2CCCC[N@H+]2C)[NH+](C)C)cc1 ZINC001184426892 1002611597 /nfs/dbraw/zinc/61/15/97/1002611597.db2.gz POUJKGIIBXITMR-VQTJNVASSA-N 2 1 360.546 2.736 20 10 FFCDMP COc1ccccc1OCC[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775654200 1004959411 /nfs/dbraw/zinc/95/94/11/1004959411.db2.gz IALWUSYZHMPRJF-UHFFFAOYSA-N 2 1 369.509 2.958 20 10 FFCDMP Cc1nc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)[nH]c1C ZINC000850234308 1005797557 /nfs/dbraw/zinc/79/75/57/1005797557.db2.gz DYDRFJODKHWHLL-UHFFFAOYSA-N 2 1 353.514 2.848 20 10 FFCDMP CCOc1cccc(C[N@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c1O ZINC000817414106 1007591625 /nfs/dbraw/zinc/59/16/25/1007591625.db2.gz RLPRGKNHOKAIDR-UHFFFAOYSA-N 2 1 361.530 2.783 20 10 FFCDMP COc1ccc(N2CCN(CC[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)CC2)cc1 ZINC000817894945 1007802342 /nfs/dbraw/zinc/80/23/42/1007802342.db2.gz PJNFEJFEUHLDKL-VXKWHMMOSA-N 2 1 366.509 2.552 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@H+]1C ZINC000773145613 1009668120 /nfs/dbraw/zinc/66/81/20/1009668120.db2.gz KELGADJYXUYIDH-RXVVDRJESA-N 3 1 356.558 2.791 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCN1C ZINC000773145613 1009668128 /nfs/dbraw/zinc/66/81/28/1009668128.db2.gz KELGADJYXUYIDH-RXVVDRJESA-N 2 1 356.558 2.791 20 10 FFCDMP COc1ccc(C[NH2+]C[C@@H]2CN(C(=O)[C@@H]3CC[N@@H+](C)[C@@H]3C)C[C@H]2C)cc1C ZINC001093780771 1010554052 /nfs/dbraw/zinc/55/40/52/1010554052.db2.gz CZDRERWVFCSBEI-HNBVOPMISA-N 2 1 373.541 2.528 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@H+]1Cc1ccc(N(C)C)c(C)c1)CC[NH2+]CC2 ZINC001222221102 1032831896 /nfs/dbraw/zinc/83/18/96/1032831896.db2.gz JZTQJBNRUKIQGC-IBGZPJMESA-N 2 1 359.514 2.568 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c2c1c(F)ccc2O ZINC000756561694 1023729637 /nfs/dbraw/zinc/72/96/37/1023729637.db2.gz HCGOTFIXGBXMRC-BBRMVZONSA-N 2 1 363.477 2.612 20 10 FFCDMP COc1cccc(C[N@@H+]2CCc3c(CN(C)C)nn(C(C)C)c3C2)c1O ZINC001203589443 1030772370 /nfs/dbraw/zinc/77/23/70/1030772370.db2.gz IFIHFTSDGWULFU-UHFFFAOYSA-N 2 1 358.486 2.798 20 10 FFCDMP COc1cccc(C[N@H+]2CCc3c(CN(C)C)nn(C(C)C)c3C2)c1O ZINC001203589443 1030772388 /nfs/dbraw/zinc/77/23/88/1030772388.db2.gz IFIHFTSDGWULFU-UHFFFAOYSA-N 2 1 358.486 2.798 20 10 FFCDMP C[N@@H+](Cc1ccco1)[C@@H]1COC2(C1)CC[NH+](Cc1ccc(O)cc1O)CC2 ZINC001204272583 1031199301 /nfs/dbraw/zinc/19/93/01/1031199301.db2.gz CYTPQWUGTDWQDW-KRWDZBQOSA-N 2 1 372.465 2.946 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(I)cc2O)CC[C@H]1C[NH3+] ZINC001205637833 1031893447 /nfs/dbraw/zinc/89/34/47/1031893447.db2.gz JESIJSXGXOCVFN-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205635933 1031894519 /nfs/dbraw/zinc/89/45/19/1031894519.db2.gz BGNCFBUENKCFOY-WBVHZDCISA-N 2 1 351.922 2.983 20 10 FFCDMP [NH3+]C[C@H]1C[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CCC1(F)F ZINC001205787014 1031993333 /nfs/dbraw/zinc/99/33/33/1031993333.db2.gz DMMGDJUQJOBURU-NSHDSACASA-N 2 1 354.319 2.749 20 10 FFCDMP [NH3+]C[C@H]1C[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)CCC1(F)F ZINC001205787014 1031993340 /nfs/dbraw/zinc/99/33/40/1031993340.db2.gz DMMGDJUQJOBURU-NSHDSACASA-N 2 1 354.319 2.749 20 10 FFCDMP CC[N@@H+](C)[C@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281722 1034699042 /nfs/dbraw/zinc/69/90/42/1034699042.db2.gz VWJSDHRARUKKQD-PMACEKPBSA-N 2 1 354.498 2.562 20 10 FFCDMP COC(=O)CC[N@@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)C1CCCC1 ZINC001139256418 1035030729 /nfs/dbraw/zinc/03/07/29/1035030729.db2.gz ANZXSANVMGXKAA-UHFFFAOYSA-N 2 1 364.486 2.770 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@](O)(C(F)(F)F)C3)cc2)CC1 ZINC001139407699 1035092729 /nfs/dbraw/zinc/09/27/29/1035092729.db2.gz AUDJPTWFFOJKSR-GOSISDBHSA-N 2 1 371.447 2.718 20 10 FFCDMP Cc1nc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)no1 ZINC001139408733 1035092904 /nfs/dbraw/zinc/09/29/04/1035092904.db2.gz PVHYINXTBXCZSN-GOSISDBHSA-N 2 1 355.486 2.509 20 10 FFCDMP Cc1cccc(O[C@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC001139411635 1035095100 /nfs/dbraw/zinc/09/51/00/1035095100.db2.gz WCRYMMYYJGEDFN-NRFANRHFSA-N 2 1 366.509 2.795 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839905 1036092703 /nfs/dbraw/zinc/09/27/03/1036092703.db2.gz YCNUFEWTURSVHF-KNQAVFIVSA-N 2 1 373.541 2.639 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839905 1036092721 /nfs/dbraw/zinc/09/27/21/1036092721.db2.gz YCNUFEWTURSVHF-KNQAVFIVSA-N 2 1 373.541 2.639 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(N(C)C)cc1O)C2 ZINC001232839905 1036092743 /nfs/dbraw/zinc/09/27/43/1036092743.db2.gz YCNUFEWTURSVHF-KNQAVFIVSA-N 2 1 373.541 2.639 20 10 FFCDMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001235716428 1037707212 /nfs/dbraw/zinc/70/72/12/1037707212.db2.gz BEZXDFFAEHQGEV-UHFFFAOYSA-N 2 1 351.922 2.998 20 10 FFCDMP CN(C)c1ccc(C[N@@H+](C)Cc2cccc(CN3CC[NH2+]CC3)c2)cc1 ZINC001236190793 1037978288 /nfs/dbraw/zinc/97/82/88/1037978288.db2.gz YCKXBRBPDKMCBO-UHFFFAOYSA-N 2 1 352.526 2.790 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375565 1038059982 /nfs/dbraw/zinc/05/99/82/1038059982.db2.gz KYCNZSGLUNBFPF-SFHVURJKSA-N 2 1 372.557 2.546 20 10 FFCDMP COc1ccc(CN(CCC[NH+](C)C)CCC[NH+](C)C)c(O)c1Cl ZINC001236812595 1038286089 /nfs/dbraw/zinc/28/60/89/1038286089.db2.gz ZSLAAIUIGCYWHJ-UHFFFAOYSA-N 2 1 357.926 2.760 20 10 FFCDMP COc1ccc(N2CCOC[C@@]3(CCC[N@H+]([C@@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701979 1039442035 /nfs/dbraw/zinc/44/20/35/1039442035.db2.gz JQPWEGGSBQMSNI-SYYKKAFVSA-N 2 1 373.541 2.755 20 10 FFCDMP COC(=O)Cc1ccc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)c(O)c1 ZINC001249213898 1040628798 /nfs/dbraw/zinc/62/87/98/1040628798.db2.gz BNCYVRWLIGGMMF-UHFFFAOYSA-N 2 1 365.433 2.925 20 10 FFCDMP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(Cl)cc1O)C2 ZINC001278557130 1041145163 /nfs/dbraw/zinc/14/51/63/1041145163.db2.gz FRMWWFAQWSHSLJ-LJQANCHMSA-N 2 1 351.922 2.895 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCC12C[NH2+]C2 ZINC001237432982 1043157503 /nfs/dbraw/zinc/15/75/03/1043157503.db2.gz YOLJKTQSOMCUHW-QGZVFWFLSA-N 2 1 360.498 2.664 20 10 FFCDMP CCOc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]CCN(C)C)(C2)CCC3)c(O)c1 ZINC001279671933 1043440647 /nfs/dbraw/zinc/44/06/47/1043440647.db2.gz IDDFSUSPARVFEH-RTWAWAEBSA-N 2 1 361.530 2.877 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC001319717846 1045250633 /nfs/dbraw/zinc/25/06/33/1045250633.db2.gz LTHHCIHSRLCCRA-DENIHFKCSA-N 2 1 356.558 2.745 20 10 FFCDMP C[N@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001319828758 1045281579 /nfs/dbraw/zinc/28/15/79/1045281579.db2.gz MHPWDPCMYOERJY-FQEVSTJZSA-N 2 1 374.548 2.741 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001319828758 1045281583 /nfs/dbraw/zinc/28/15/83/1045281583.db2.gz MHPWDPCMYOERJY-FQEVSTJZSA-N 2 1 374.548 2.741 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCN4CCCC[C@@H]34)cc2F)CC1 ZINC001329113372 1048582299 /nfs/dbraw/zinc/58/22/99/1048582299.db2.gz JPZVYMRKBCITCX-CTNGQTDRSA-N 2 1 360.521 2.684 20 10 FFCDMP CCCCCC[N@@H+](C)CC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001303084032 1051273626 /nfs/dbraw/zinc/27/36/26/1051273626.db2.gz DEUSMWCCFMOQFK-UHFFFAOYSA-N 2 1 360.546 2.567 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC3CC[NH+](C4CCCC4)CC3)cc2)CC1 ZINC001308301366 1052443459 /nfs/dbraw/zinc/44/34/59/1052443459.db2.gz WTSNISNTYBDIFH-UHFFFAOYSA-N 2 1 356.558 2.935 20 10 FFCDMP CC(C)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1cnn(C)c1 ZINC001352035000 1055141441 /nfs/dbraw/zinc/14/14/41/1055141441.db2.gz YXGOYXCHTOXCTE-HXUWFJFHSA-N 2 1 359.493 2.798 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CNCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000849350002 1056836077 /nfs/dbraw/zinc/83/60/77/1056836077.db2.gz MXQMRVHZWGSEIK-DHIUTWEWSA-N 2 1 364.537 2.674 20 10 FFCDMP C[NH+](C)CCOc1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)ccn1 ZINC000293523708 511995886 /nfs/dbraw/zinc/99/58/86/511995886.db2.gz DFEQODDRZQTHGK-UHFFFAOYSA-N 2 1 353.825 2.810 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[C@@H](C)[NH+](C)C)C1 ZINC000617758420 520705289 /nfs/dbraw/zinc/70/52/89/520705289.db2.gz OYIFTLQQEIYLMX-QGZVFWFLSA-N 2 1 370.541 2.864 20 10 FFCDMP CC[N@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809738330 741338242 /nfs/dbraw/zinc/33/82/42/741338242.db2.gz USNYDXXUNDZKSN-QGZVFWFLSA-N 2 1 369.937 2.902 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903450 748133313 /nfs/dbraw/zinc/13/33/13/748133313.db2.gz ZFPLKQRMWHSFTQ-XPKDYRNWSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903450 748133319 /nfs/dbraw/zinc/13/33/19/748133319.db2.gz ZFPLKQRMWHSFTQ-XPKDYRNWSA-N 2 1 369.303 2.873 20 10 FFCDMP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1ccc(Cl)cc1O ZINC001275893366 1013149506 /nfs/dbraw/zinc/14/95/06/1013149506.db2.gz WZEQOYSJKIZYPJ-IBGZPJMESA-N 2 1 365.905 2.564 20 10 FFCDMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 ZINC000067452962 967688504 /nfs/dbraw/zinc/68/85/04/967688504.db2.gz HVXXJCQGKPVVGL-KDURUIRLSA-N 2 1 361.530 2.502 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc(F)ccc2n1C ZINC000894188080 978124111 /nfs/dbraw/zinc/12/41/11/978124111.db2.gz QGCCOBTVZBQEFX-HUUCEWRRSA-N 2 1 359.445 2.820 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc(F)ccc2n1C ZINC000894188080 978124116 /nfs/dbraw/zinc/12/41/16/978124116.db2.gz QGCCOBTVZBQEFX-HUUCEWRRSA-N 2 1 359.445 2.820 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@H]3CCC[C@H]3O)cc2)CC1 ZINC000824695654 997058688 /nfs/dbraw/zinc/05/86/88/997058688.db2.gz AGEIYAZUZNJBDX-YPAWHYETSA-N 2 1 357.542 2.954 20 10 FFCDMP Cc1c(C[C@H](C[NH3+])C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cnn1C ZINC000903879880 1016284328 /nfs/dbraw/zinc/28/43/28/1016284328.db2.gz LHJYYSORARGYFK-GOSISDBHSA-N 2 1 355.530 2.577 20 10 FFCDMP CCOc1ccc(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000741257663 999717101 /nfs/dbraw/zinc/71/71/01/999717101.db2.gz ICJVLLRVPNHZCV-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1ccc(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(O)c1 ZINC000741257663 999717102 /nfs/dbraw/zinc/71/71/02/999717102.db2.gz ICJVLLRVPNHZCV-NRFANRHFSA-N 2 1 356.466 2.518 20 10 FFCDMP Cc1cnc(N2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)cc3)CC2)s1 ZINC000775705875 1003733621 /nfs/dbraw/zinc/73/36/21/1003733621.db2.gz NMKGLDYJJXDOJK-UHFFFAOYSA-N 2 1 371.554 2.526 20 10 FFCDMP CC[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCN1CC(F)F ZINC000775726569 1003861967 /nfs/dbraw/zinc/86/19/67/1003861967.db2.gz UDPHJNJIGMGPIB-GOSISDBHSA-N 2 1 366.500 2.600 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929616 /nfs/dbraw/zinc/92/96/16/1003929616.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929623 /nfs/dbraw/zinc/92/96/23/1003929623.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929627 /nfs/dbraw/zinc/92/96/27/1003929627.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4[C@@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929637 /nfs/dbraw/zinc/92/96/37/1003929637.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 2 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4[C@@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738388 1003929643 /nfs/dbraw/zinc/92/96/43/1003929643.db2.gz CSKORDKWBDOZGC-REWPJTCUSA-N 2 1 368.569 2.887 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](c2ccccc2)C1 ZINC000775633246 1004883690 /nfs/dbraw/zinc/88/36/90/1004883690.db2.gz GJQTZOPOJYOGMJ-QHCPKHFHSA-N 2 1 364.537 2.927 20 10 FFCDMP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cccc(I)c2O)CC1 ZINC001206326128 1032230851 /nfs/dbraw/zinc/23/08/51/1032230851.db2.gz KLRVQKPORPWEKP-OAHLLOKOSA-N 2 1 374.266 2.948 20 10 FFCDMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(I)c2O)CC1 ZINC001206326128 1032230861 /nfs/dbraw/zinc/23/08/61/1032230861.db2.gz KLRVQKPORPWEKP-OAHLLOKOSA-N 2 1 374.266 2.948 20 10 FFCDMP CC(C)n1cc(C(C)(C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)nn1 ZINC000817419742 1007595157 /nfs/dbraw/zinc/59/51/57/1007595157.db2.gz KMYLKLSNBMMTOX-UHFFFAOYSA-N 2 1 356.518 2.636 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205545675 1007849194 /nfs/dbraw/zinc/84/91/94/1007849194.db2.gz LQFZEWAFYIZYIK-HNNXBMFYSA-N 2 1 361.255 2.816 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(C(=O)N2CCN(C)CC2)cc1)c1c(O)cccc1F ZINC000886503735 1008704763 /nfs/dbraw/zinc/70/47/63/1008704763.db2.gz CBKWZABCLLPWRF-HNNXBMFYSA-N 2 1 371.456 2.770 20 10 FFCDMP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000931764225 1020577916 /nfs/dbraw/zinc/57/79/16/1020577916.db2.gz OAJVCYUKXOCOTJ-GOSISDBHSA-N 2 1 352.482 2.629 20 10 FFCDMP C[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756561222 1023728086 /nfs/dbraw/zinc/72/80/86/1023728086.db2.gz CSQMDQSOMCESTP-MRXNPFEDSA-N 2 1 373.541 2.864 20 10 FFCDMP [NH3+]CC(=O)N1CCC[C@H](C[N@@H+](Cc2ccccc2O)C2CCCCC2)C1 ZINC000841018696 1029981089 /nfs/dbraw/zinc/98/10/89/1029981089.db2.gz OOIKWIBMGUHTJD-KRWDZBQOSA-N 2 1 359.514 2.724 20 10 FFCDMP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccc(I)cc2O)C1 ZINC001206631859 1031587036 /nfs/dbraw/zinc/58/70/36/1031587036.db2.gz BGFKOCHOZDGFMX-NSHDSACASA-N 2 1 360.239 2.558 20 10 FFCDMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(I)cc2O)C1 ZINC001206631859 1031587044 /nfs/dbraw/zinc/58/70/44/1031587044.db2.gz BGFKOCHOZDGFMX-NSHDSACASA-N 2 1 360.239 2.558 20 10 FFCDMP CC(C)c1ncc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000799737097 1031870338 /nfs/dbraw/zinc/87/03/38/1031870338.db2.gz VVXNRZXDANDLTQ-UHFFFAOYSA-N 2 1 353.514 2.984 20 10 FFCDMP CCc1noc([C@H]2CCC[N@@H+](Cc3cc(C[NH+](C)C)c(O)c(OC)c3)C2)n1 ZINC001139258625 1035031493 /nfs/dbraw/zinc/03/14/93/1035031493.db2.gz VFBWCCKQIDHPCB-HNNXBMFYSA-N 2 1 374.485 2.787 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](Oc4cccnc4)C3)cc2)CC1 ZINC001139408597 1035092841 /nfs/dbraw/zinc/09/28/41/1035092841.db2.gz AOAQBYMXUPNKBA-JOCHJYFZSA-N 2 1 366.509 2.877 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](c4nnc(C)o4)C3)cc2)CC1 ZINC001140306002 1035427616 /nfs/dbraw/zinc/42/76/16/1035427616.db2.gz KADQWQWBFLXHHT-LJQANCHMSA-N 2 1 369.513 2.900 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C(=O)OC)CC3)cc2)CC1 ZINC001140309423 1035429649 /nfs/dbraw/zinc/42/96/49/1035429649.db2.gz GCGCPWKHXMKMNS-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429428 1037544690 /nfs/dbraw/zinc/54/46/90/1037544690.db2.gz UENRAZQRDUTYKQ-RBUKOAKNSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429428 1037544699 /nfs/dbraw/zinc/54/46/99/1037544699.db2.gz UENRAZQRDUTYKQ-RBUKOAKNSA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429428 1037544709 /nfs/dbraw/zinc/54/47/09/1037544709.db2.gz UENRAZQRDUTYKQ-RBUKOAKNSA-N 2 1 374.548 2.789 20 10 FFCDMP C[C@H](c1ccccc1)N1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235864384 1037801639 /nfs/dbraw/zinc/80/16/39/1037801639.db2.gz QDQJQHSJMYGMIA-QGZVFWFLSA-N 2 1 367.493 2.753 20 10 FFCDMP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]1C2 ZINC001236027656 1037892690 /nfs/dbraw/zinc/89/26/90/1037892690.db2.gz LNJSDDIJAXEAKZ-WHEACTPUSA-N 2 1 372.509 2.520 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]1C[NH2+]CC2 ZINC001236037996 1037899925 /nfs/dbraw/zinc/89/99/25/1037899925.db2.gz DSMNLNHFNABYNK-DENIHFKCSA-N 2 1 371.525 2.652 20 10 FFCDMP c1ccc2c(c1)CCN1CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C[C@H]21 ZINC001236058705 1037910374 /nfs/dbraw/zinc/91/03/74/1037910374.db2.gz AJKVQZKINWRIKI-HSZRJFAPSA-N 2 1 362.521 2.511 20 10 FFCDMP CC(C)(C)c1cc(O)c(C[N@H+]2CCC[C@H](N3CC([NH3+])C3)C2)cc1Cl ZINC001236079815 1037921686 /nfs/dbraw/zinc/92/16/86/1037921686.db2.gz YZUVUIRZUFZWSM-HNNXBMFYSA-N 2 1 351.922 2.950 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CC[NH+](C)CC4)CC3)c(F)c2)CC1 ZINC001236942949 1038371578 /nfs/dbraw/zinc/37/15/78/1038371578.db2.gz ONPRZWUFENYOTK-UHFFFAOYSA-N 2 1 374.548 2.885 20 10 FFCDMP c1ccc(C[C@@H]2C[C@@H](NCc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173837 1039266552 /nfs/dbraw/zinc/26/65/52/1039266552.db2.gz MZGDPLDZJJLQDU-FCHUYYIVSA-N 2 1 364.537 2.549 20 10 FFCDMP Oc1ccccc1C[N@H+]1CCC[C@]2(CCC[NH+](CCn3ccnc3)C2)C1 ZINC001278551390 1041111971 /nfs/dbraw/zinc/11/19/71/1041111971.db2.gz ICDRRXONVLBMEN-NRFANRHFSA-N 2 1 354.498 2.967 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC[C@]2(CCC[N@H+](CCn3ccnc3)C2)C1 ZINC001278551390 1041111974 /nfs/dbraw/zinc/11/19/74/1041111974.db2.gz ICDRRXONVLBMEN-NRFANRHFSA-N 2 1 354.498 2.967 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC[C@]2(CCC[N@@H+](CCn3ccnc3)C2)C1 ZINC001278551390 1041111980 /nfs/dbraw/zinc/11/19/80/1041111980.db2.gz ICDRRXONVLBMEN-NRFANRHFSA-N 2 1 354.498 2.967 20 10 FFCDMP COc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001278577070 1041237829 /nfs/dbraw/zinc/23/78/29/1041237829.db2.gz MRRYQCYPODFSCR-UHFFFAOYSA-N 2 1 356.470 2.612 20 10 FFCDMP Cc1cc(C[NH+]2CC3(C2)CC[NH+](Cc2cccc(C)c2O)CC3)n(C)n1 ZINC001279290453 1042985892 /nfs/dbraw/zinc/98/58/92/1042985892.db2.gz OZZXQFPSAPTCSY-UHFFFAOYSA-N 2 1 354.498 2.841 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001238063232 1043511307 /nfs/dbraw/zinc/51/13/07/1043511307.db2.gz YQGZFXCTBHDUTP-AEFFLSMTSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001238063232 1043511316 /nfs/dbraw/zinc/51/13/16/1043511316.db2.gz YQGZFXCTBHDUTP-AEFFLSMTSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[N@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001238063232 1043511328 /nfs/dbraw/zinc/51/13/28/1043511328.db2.gz YQGZFXCTBHDUTP-AEFFLSMTSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[N@@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001238063232 1043511336 /nfs/dbraw/zinc/51/13/36/1043511336.db2.gz YQGZFXCTBHDUTP-AEFFLSMTSA-N 2 1 358.461 2.527 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)c3ccccc3)cc2F)CC1 ZINC001318553424 1044746210 /nfs/dbraw/zinc/74/62/10/1044746210.db2.gz YCPUXSXFOKEXMW-OAQYLSRUSA-N 2 1 357.473 2.575 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC001319717847 1045251220 /nfs/dbraw/zinc/25/12/20/1045251220.db2.gz LTHHCIHSRLCCRA-KNQAVFIVSA-N 2 1 356.558 2.745 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3cnc(C4CC4)nc3)cc2F)CC1 ZINC001320198309 1045367117 /nfs/dbraw/zinc/36/71/17/1045367117.db2.gz SJPRXYRQAQKOOR-UHFFFAOYSA-N 2 1 369.488 2.577 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCOCC4(CCCC4)C3)cc2F)CC1 ZINC001325803220 1046644789 /nfs/dbraw/zinc/64/47/89/1046644789.db2.gz KJELDFHNEXVZFJ-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOCC4(CCCC4)C3)cc2F)CC1 ZINC001325803220 1046644799 /nfs/dbraw/zinc/64/47/99/1046644799.db2.gz KJELDFHNEXVZFJ-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP Cc1cccc(C[C@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001326129790 1046777384 /nfs/dbraw/zinc/77/73/84/1046777384.db2.gz OKVZZEBQUGHGHK-HXUWFJFHSA-N 2 1 371.500 2.579 20 10 FFCDMP CO[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)Cc1ccccc1 ZINC001327953841 1048108671 /nfs/dbraw/zinc/10/86/71/1048108671.db2.gz ZQDASTJSCQIFBG-HXUWFJFHSA-N 2 1 371.500 2.925 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCN(c4cccs4)CC3)cc2F)CC1 ZINC001341569043 1050195314 /nfs/dbraw/zinc/19/53/14/1050195314.db2.gz KXXGFVNDIUMHCW-UHFFFAOYSA-N 2 1 374.529 2.961 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)C3CCCCC3)cc2F)CC1 ZINC001343561686 1052308152 /nfs/dbraw/zinc/30/81/52/1052308152.db2.gz UEDLHCHCPLHDKU-OAQYLSRUSA-N 2 1 363.521 2.998 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CC3)[C@H]3CCCOC3)cc2F)CC1 ZINC001355302701 1060092723 /nfs/dbraw/zinc/09/27/23/1060092723.db2.gz SRXUZCLSOJZXHH-GHTZIAJQSA-N 2 1 361.505 2.872 20 10 FFCDMP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c(OC)c1 ZINC001461068441 1061202331 /nfs/dbraw/zinc/20/23/31/1061202331.db2.gz YVRIXVAHMBQAGP-UHFFFAOYSA-N 2 1 373.472 2.885 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1 ZINC000185084835 510675238 /nfs/dbraw/zinc/67/52/38/510675238.db2.gz AUFSWBKOKKYAAK-KRWDZBQOSA-N 2 1 369.509 2.999 20 10 FFCDMP CCCC[N@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1O ZINC000282836548 511129205 /nfs/dbraw/zinc/12/92/05/511129205.db2.gz CGRVQBCIVUGCIH-UHFFFAOYSA-N 2 1 369.513 2.736 20 10 FFCDMP CCCC[N@@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1O ZINC000282836548 511129211 /nfs/dbraw/zinc/12/92/11/511129211.db2.gz CGRVQBCIVUGCIH-UHFFFAOYSA-N 2 1 369.513 2.736 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000273622780 511553872 /nfs/dbraw/zinc/55/38/72/511553872.db2.gz ZPHNJDUOLRIHSZ-OAHLLOKOSA-N 2 1 372.465 2.970 20 10 FFCDMP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000750837628 735819168 /nfs/dbraw/zinc/81/91/68/735819168.db2.gz LPYHROHPSNOUEO-QGZVFWFLSA-N 2 1 352.450 2.667 20 10 FFCDMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000750837628 735819172 /nfs/dbraw/zinc/81/91/72/735819172.db2.gz LPYHROHPSNOUEO-QGZVFWFLSA-N 2 1 352.450 2.667 20 10 FFCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c1O ZINC000808696393 741252997 /nfs/dbraw/zinc/25/29/97/741252997.db2.gz VNEAWNOESQECEX-CQSZACIVSA-N 2 1 367.921 2.947 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000894297911 964320931 /nfs/dbraw/zinc/32/09/31/964320931.db2.gz KEJGLISWTGMXPH-WOJBJXKFSA-N 2 1 370.493 2.682 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000894297911 964320939 /nfs/dbraw/zinc/32/09/39/964320939.db2.gz KEJGLISWTGMXPH-WOJBJXKFSA-N 2 1 370.493 2.682 20 10 FFCDMP CN(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001177066345 1013842073 /nfs/dbraw/zinc/84/20/73/1013842073.db2.gz UFGWSPQYWPHYAZ-JOCHJYFZSA-N 2 1 370.516 2.970 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1O ZINC001206011268 1032107570 /nfs/dbraw/zinc/10/75/70/1032107570.db2.gz BDDIDKWUPGYLKO-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP CCNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809691361 994568343 /nfs/dbraw/zinc/56/83/43/994568343.db2.gz MANOHDLWAJMQEY-FQEVSTJZSA-N 2 1 374.529 2.539 20 10 FFCDMP CCNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809691362 994568847 /nfs/dbraw/zinc/56/88/47/994568847.db2.gz MANOHDLWAJMQEY-HXUWFJFHSA-N 2 1 374.529 2.539 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000702604879 999129787 /nfs/dbraw/zinc/12/97/87/999129787.db2.gz ZZTRKCLVZWJFPC-HRAATJIYSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000702604879 999129791 /nfs/dbraw/zinc/12/97/91/999129791.db2.gz ZZTRKCLVZWJFPC-HRAATJIYSA-N 2 1 356.466 2.688 20 10 FFCDMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447952 1000249876 /nfs/dbraw/zinc/24/98/76/1000249876.db2.gz RYMNOJACQADSSD-QINHECLXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447952 1000249881 /nfs/dbraw/zinc/24/98/81/1000249881.db2.gz RYMNOJACQADSSD-QINHECLXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447952 1000249885 /nfs/dbraw/zinc/24/98/85/1000249885.db2.gz RYMNOJACQADSSD-QINHECLXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OC[C@@H]3O)C1 ZINC000768447952 1000249891 /nfs/dbraw/zinc/24/98/91/1000249891.db2.gz RYMNOJACQADSSD-QINHECLXSA-N 2 1 360.498 2.904 20 10 FFCDMP COc1ccc([C@H](CO)[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775701484 1003706370 /nfs/dbraw/zinc/70/63/70/1003706370.db2.gz YXCZRDBQHWVWOZ-QFIPXVFZSA-N 2 1 369.509 2.612 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929779 /nfs/dbraw/zinc/92/97/79/1003929779.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929787 /nfs/dbraw/zinc/92/97/87/1003929787.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929795 /nfs/dbraw/zinc/92/97/95/1003929795.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4[C@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929801 /nfs/dbraw/zinc/92/98/01/1003929801.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 2 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]4[C@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738385 1003929807 /nfs/dbraw/zinc/92/98/07/1003929807.db2.gz CSKORDKWBDOZGC-NFBKMPQASA-N 2 1 368.569 2.887 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1O ZINC001205601768 1004166927 /nfs/dbraw/zinc/16/69/27/1004166927.db2.gz GGJUQYJJIIDQBK-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3CN3CCCCC3)cc2)CC1 ZINC000775658805 1004975574 /nfs/dbraw/zinc/97/55/74/1004975574.db2.gz CPQSTDAZVSLFLS-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3CN3CCCCC3)cc2)CC1 ZINC000775658805 1004975575 /nfs/dbraw/zinc/97/55/75/1004975575.db2.gz CPQSTDAZVSLFLS-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3CN3CCCCC3)cc2)CC1 ZINC000775658806 1004976098 /nfs/dbraw/zinc/97/60/98/1004976098.db2.gz CPQSTDAZVSLFLS-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3CN3CCCCC3)cc2)CC1 ZINC000775658806 1004976103 /nfs/dbraw/zinc/97/61/03/1004976103.db2.gz CPQSTDAZVSLFLS-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000854231891 1006734222 /nfs/dbraw/zinc/73/42/22/1006734222.db2.gz OMYWZXVWQFGVOP-ZDUSSCGKSA-N 2 1 359.449 2.621 20 10 FFCDMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817887752 1007784588 /nfs/dbraw/zinc/78/45/88/1007784588.db2.gz DLSZPSUVHMHJJZ-JXFKEZNVSA-N 2 1 357.473 2.710 20 10 FFCDMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(I)cc2O)CC1 ZINC001206319004 1008910724 /nfs/dbraw/zinc/91/07/24/1008910724.db2.gz XGZXGERQRPSCSL-OAHLLOKOSA-N 2 1 374.266 2.948 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3COc4cc(F)ccc4C3)cc2F)CC1 ZINC001179192987 1009286914 /nfs/dbraw/zinc/28/69/14/1009286914.db2.gz BXWBJRDRXITBMF-GOSISDBHSA-N 2 1 373.447 2.810 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccn(C)n1 ZINC000840733279 1027233811 /nfs/dbraw/zinc/23/38/11/1027233811.db2.gz PFXIVWDMGFLDFC-QGZVFWFLSA-N 2 1 353.514 2.803 20 10 FFCDMP CCOc1ccc(O)c(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665987 1027395850 /nfs/dbraw/zinc/39/58/50/1027395850.db2.gz CXACXAWTASMWFI-ROUUACIJSA-N 2 1 361.530 2.781 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001204869541 1031457845 /nfs/dbraw/zinc/45/78/45/1031457845.db2.gz CCQIJBRCTHWWKR-HSZRJFAPSA-N 2 1 364.537 2.803 20 10 FFCDMP CN(Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001204869541 1031457852 /nfs/dbraw/zinc/45/78/52/1031457852.db2.gz CCQIJBRCTHWWKR-HSZRJFAPSA-N 2 1 364.537 2.803 20 10 FFCDMP CN(Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001204869541 1031457856 /nfs/dbraw/zinc/45/78/56/1031457856.db2.gz CCQIJBRCTHWWKR-HSZRJFAPSA-N 2 1 364.537 2.803 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCC[C@](C)([NH3+])CC2)c(O)c1 ZINC001205295941 1031655793 /nfs/dbraw/zinc/65/57/93/1031655793.db2.gz CYDMULUTCXXZHJ-FQEVSTJZSA-N 2 1 364.486 2.818 20 10 FFCDMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001205591724 1031856072 /nfs/dbraw/zinc/85/60/72/1031856072.db2.gz OIRRZAWIFNGNPX-HNNXBMFYSA-N 2 1 350.356 2.986 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(c4nccs4)CC3)cc2)CC1 ZINC001140299651 1035424111 /nfs/dbraw/zinc/42/41/11/1035424111.db2.gz DITNDTAFXOZZGT-UHFFFAOYSA-N 2 1 371.554 2.607 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)cc1O ZINC001231635823 1037758256 /nfs/dbraw/zinc/75/82/56/1037758256.db2.gz MPSJGJSWOFIUBB-QZTJIDSGSA-N 2 1 354.450 2.670 20 10 FFCDMP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]1C2 ZINC001236029202 1037896078 /nfs/dbraw/zinc/89/60/78/1037896078.db2.gz ZBYJSCIXVONACA-WHEACTPUSA-N 2 1 372.509 2.520 20 10 FFCDMP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)C[NH2+]C4)CC2)c(OC)c1 ZINC001236409551 1038077338 /nfs/dbraw/zinc/07/73/38/1038077338.db2.gz BMRUKQFHRZLYGP-UHFFFAOYSA-N 2 1 353.466 2.629 20 10 FFCDMP C[NH+]1CCC2(CC[N@@H+](Cc3cc(O)c(Br)cc3O)C2)CC1 ZINC001236770106 1038255588 /nfs/dbraw/zinc/25/55/88/1038255588.db2.gz DQZZSGAVUQOIIA-UHFFFAOYSA-N 2 1 355.276 2.778 20 10 FFCDMP C[N@H+](Cc1ccc(N2CCOCC2)cc1Cl)CC1CC[NH+](C)CC1 ZINC001236926442 1038357785 /nfs/dbraw/zinc/35/77/85/1038357785.db2.gz GSFOITOATXKEQE-UHFFFAOYSA-N 2 1 351.922 2.950 20 10 FFCDMP Fc1cccc(O[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236949234 1038376332 /nfs/dbraw/zinc/37/63/32/1038376332.db2.gz GUPOZVDKCAOMBL-NRFANRHFSA-N 2 1 355.457 2.889 20 10 FFCDMP CCOc1ccc(C[N@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@@H]3COC)C2)c(O)c1 ZINC001237040337 1038418573 /nfs/dbraw/zinc/41/85/73/1038418573.db2.gz HKCFZNBYUHTKFN-KNQAVFIVSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COC)c(O)c1 ZINC001237040337 1038418579 /nfs/dbraw/zinc/41/85/79/1038418579.db2.gz HKCFZNBYUHTKFN-KNQAVFIVSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c(O)c1 ZINC001237040337 1038418585 /nfs/dbraw/zinc/41/85/85/1038418585.db2.gz HKCFZNBYUHTKFN-KNQAVFIVSA-N 2 1 374.525 2.971 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256521038 1038542263 /nfs/dbraw/zinc/54/22/63/1038542263.db2.gz XNNOWYHZQMBZDO-YWMUFLPLSA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256521038 1038542268 /nfs/dbraw/zinc/54/22/68/1038542268.db2.gz XNNOWYHZQMBZDO-YWMUFLPLSA-N 2 1 356.466 2.774 20 10 FFCDMP Cc1cc(C[NH+]2C[C@@H]3CC[N@@H+](CCN(C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766765 /nfs/dbraw/zinc/76/67/65/1039766765.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 1 358.574 2.766 20 10 FFCDMP Cc1cc(C[N@@H+]2C[C@@H]3CC[NH+](CCN(C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766780 /nfs/dbraw/zinc/76/67/80/1039766780.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 1 358.574 2.766 20 10 FFCDMP Cc1cc(C[N@H+]2C[C@@H]3CC[NH+](CCN(C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766790 /nfs/dbraw/zinc/76/67/90/1039766790.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 1 358.574 2.766 20 10 FFCDMP Cc1cc(C[N@H+]2C[C@@H]3CCN(CC[NH+](C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766805 /nfs/dbraw/zinc/76/68/05/1039766805.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 1 358.574 2.766 20 10 FFCDMP Cc1cc(C[N@@H+]2C[C@@H]3CCN(CC[NH+](C)C)CC[C@@H]3C2)ccc1N(C)C ZINC001278686121 1039766822 /nfs/dbraw/zinc/76/68/22/1039766822.db2.gz JYHURCKVABCRBF-OYRHEFFESA-N 2 1 358.574 2.766 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN(CC[NH3+])Cc3ccccc3)cc2F)CC1 ZINC001261482092 1041261242 /nfs/dbraw/zinc/26/12/42/1041261242.db2.gz ALCBZPGZOKJRBB-UHFFFAOYSA-N 2 1 356.489 2.538 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149199 1042919940 /nfs/dbraw/zinc/91/99/40/1042919940.db2.gz AVGBJXRWPKIHTI-QFIPXVFZSA-N 2 1 358.574 2.992 20 10 FFCDMP COc1ccc(Br)c(C[N@@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c1O ZINC001279282608 1042982351 /nfs/dbraw/zinc/98/23/51/1042982351.db2.gz SPYNKOKSHVIIRR-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP COc1ccc(Br)c(C[NH+]2C[C@@H]3CC[N@@H+](C)CC[C@@H]3C2)c1O ZINC001279282608 1042982354 /nfs/dbraw/zinc/98/23/54/1042982354.db2.gz SPYNKOKSHVIIRR-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP COc1ccc(Br)c(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)c1O ZINC001279282608 1042982358 /nfs/dbraw/zinc/98/23/58/1042982358.db2.gz SPYNKOKSHVIIRR-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP Oc1ccc(F)c(F)c1C[NH+]1CCC2(CC[N@H+](Cc3cn[nH]c3)C2)CC1 ZINC001279490576 1043175651 /nfs/dbraw/zinc/17/56/51/1043175651.db2.gz SLWREYTZDCANHB-UHFFFAOYSA-N 2 1 362.424 2.882 20 10 FFCDMP Oc1ccc(F)c(F)c1C[NH+]1CCC2(CC[N@@H+](Cc3cn[nH]c3)C2)CC1 ZINC001279490576 1043175656 /nfs/dbraw/zinc/17/56/56/1043175656.db2.gz SLWREYTZDCANHB-UHFFFAOYSA-N 2 1 362.424 2.882 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(C(F)(F)F)ccc1O ZINC001279685748 1043467474 /nfs/dbraw/zinc/46/74/74/1043467474.db2.gz FMNMLJXMQDYXPY-IYBDPMFKSA-N 2 1 357.420 2.621 20 10 FFCDMP CC(C)CC[C@@](C)(O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001318664630 1044797093 /nfs/dbraw/zinc/79/70/93/1044797093.db2.gz ZLWNHQPBIWFYJQ-HXUWFJFHSA-N 2 1 351.510 2.854 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@]3(CO)CCc4ccccc43)cc2F)CC1 ZINC001319392656 1045134088 /nfs/dbraw/zinc/13/40/88/1045134088.db2.gz YDKJSPKSQYKUHX-JOCHJYFZSA-N 2 1 369.484 2.501 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH+](C4CCCC4)CC3)cc2F)CC1 ZINC001324725224 1046188102 /nfs/dbraw/zinc/18/81/02/1046188102.db2.gz RMVVXWXISLRYHQ-UHFFFAOYSA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@](C)(O)c3ccccc3)cc2F)CC1 ZINC001325879825 1046672194 /nfs/dbraw/zinc/67/21/94/1046672194.db2.gz KEFVAEXJPABJJR-QFIPXVFZSA-N 2 1 371.500 2.965 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)cc2F)CC1 ZINC001329428565 1048715957 /nfs/dbraw/zinc/71/59/57/1048715957.db2.gz SQBDJABPOCDCPE-FQEVSTJZSA-N 3 1 360.521 2.542 20 10 FFCDMP Cc1ccccc1[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001560327272 1076264795 /nfs/dbraw/zinc/26/47/95/1076264795.db2.gz DDAQQQYYWAYZAZ-OAQYLSRUSA-N 2 1 357.473 2.709 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c(O)c1 ZINC001560925637 1076309874 /nfs/dbraw/zinc/30/98/74/1076309874.db2.gz PUKQTBPFMYROCF-GOSISDBHSA-N 2 1 356.466 2.566 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(F)cc1O ZINC000186060329 509505020 /nfs/dbraw/zinc/50/50/20/509505020.db2.gz BBSUSBVBNFBVKR-CQSZACIVSA-N 2 1 359.445 2.674 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246113608 510300812 /nfs/dbraw/zinc/30/08/12/510300812.db2.gz JWBQLYQBLVSSJW-SIKLNZKXSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246113608 510300818 /nfs/dbraw/zinc/30/08/18/510300818.db2.gz JWBQLYQBLVSSJW-SIKLNZKXSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246113608 510300825 /nfs/dbraw/zinc/30/08/25/510300825.db2.gz JWBQLYQBLVSSJW-SIKLNZKXSA-N 2 1 355.526 2.972 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3cc[nH+]cc3Br)cc2)CC1 ZINC000792689087 739693825 /nfs/dbraw/zinc/69/38/25/739693825.db2.gz MGLFMBCRZRAQMI-UHFFFAOYSA-N 2 1 361.287 2.630 20 10 FFCDMP CC[C@H]([NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1ccc(F)cc1O ZINC000796894460 740194162 /nfs/dbraw/zinc/19/41/62/740194162.db2.gz WAILNBBJKTZRML-IRXDYDNUSA-N 2 1 353.482 2.665 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000765795386 985853041 /nfs/dbraw/zinc/85/30/41/985853041.db2.gz CCPZFBYICSNTBH-UYAOXDASSA-N 2 1 372.557 2.915 20 10 FFCDMP CC(C)(C)c1cccc(C[NH+]2CCC([NH+]3CCC(C(N)=O)CC3)CC2)c1O ZINC001143112077 987613505 /nfs/dbraw/zinc/61/35/05/987613505.db2.gz JJCWYCBZICMVQQ-UHFFFAOYSA-N 2 1 373.541 2.851 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1 ZINC000922391238 988549187 /nfs/dbraw/zinc/54/91/87/988549187.db2.gz AEVNPGIDRYPAOH-CWJKEVGVSA-N 2 1 362.514 2.750 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)c3cccs3)cc2F)CC1 ZINC001116115402 1032135055 /nfs/dbraw/zinc/13/50/55/1032135055.db2.gz LFUQRGLRPMLSOG-LJQANCHMSA-N 2 1 363.502 2.636 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000826941325 1016237646 /nfs/dbraw/zinc/23/76/46/1016237646.db2.gz IBSRTKHRFXKLFE-QFIPXVFZSA-N 2 1 353.510 2.917 20 10 FFCDMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447947 1000250158 /nfs/dbraw/zinc/25/01/58/1000250158.db2.gz RYMNOJACQADSSD-GQIGUUNPSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447947 1000250164 /nfs/dbraw/zinc/25/01/64/1000250164.db2.gz RYMNOJACQADSSD-GQIGUUNPSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447947 1000250172 /nfs/dbraw/zinc/25/01/72/1000250172.db2.gz RYMNOJACQADSSD-GQIGUUNPSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447947 1000250176 /nfs/dbraw/zinc/25/01/76/1000250176.db2.gz RYMNOJACQADSSD-GQIGUUNPSA-N 2 1 360.498 2.904 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930075 /nfs/dbraw/zinc/93/00/75/1003930075.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930080 /nfs/dbraw/zinc/93/00/80/1003930080.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930084 /nfs/dbraw/zinc/93/00/84/1003930084.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 3 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930091 /nfs/dbraw/zinc/93/00/91/1003930091.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 2 1 368.569 2.887 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)cc2)CC1 ZINC000775738386 1003930095 /nfs/dbraw/zinc/93/00/95/1003930095.db2.gz CSKORDKWBDOZGC-NZQKXSOJSA-N 2 1 368.569 2.887 20 10 FFCDMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817895337 1007801531 /nfs/dbraw/zinc/80/15/31/1007801531.db2.gz SZYOHPSGCZFUMB-IERDGZPVSA-N 2 1 371.500 2.835 20 10 FFCDMP Cc1ccc(O[C@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)nc1 ZINC000858012757 1008276714 /nfs/dbraw/zinc/27/67/14/1008276714.db2.gz LMVIVWGYJUDKPH-NRFANRHFSA-N 2 1 366.509 2.795 20 10 FFCDMP C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177830540 1008761482 /nfs/dbraw/zinc/76/14/82/1008761482.db2.gz XRKVVYBIATXJCB-DYESRHJHSA-N 2 1 371.500 2.832 20 10 FFCDMP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1cc(Cl)ccc1O ZINC001275248685 1012139442 /nfs/dbraw/zinc/13/94/42/1012139442.db2.gz QSGIPYHHJQYNNV-IBGZPJMESA-N 2 1 365.905 2.564 20 10 FFCDMP CC1(C)[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925689929 1017819004 /nfs/dbraw/zinc/81/90/04/1017819004.db2.gz DQSQNFDOMDVQJG-MDASCCDHSA-N 2 1 365.468 2.668 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3c(C)n(C)c4ccccc43)C[C@@H]1C[NH2+]CCC2 ZINC001222125758 1032769103 /nfs/dbraw/zinc/76/91/03/1032769103.db2.gz UYQVHJKEIWGJPM-JTSKRJEESA-N 2 1 369.509 2.851 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOc4ccc(O)cc4C3)cc2)CC1 ZINC000827657913 1018598981 /nfs/dbraw/zinc/59/89/81/1018598981.db2.gz RWAIPFLCTDKPKT-UHFFFAOYSA-N 2 1 353.466 2.539 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOc4ccc(O)cc4C3)cc2)CC1 ZINC000827657913 1018598991 /nfs/dbraw/zinc/59/89/91/1018598991.db2.gz RWAIPFLCTDKPKT-UHFFFAOYSA-N 2 1 353.466 2.539 20 10 FFCDMP CCCC[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1ccccc1O ZINC000801599460 1019158701 /nfs/dbraw/zinc/15/87/01/1019158701.db2.gz OWLMNTGWGHCMEA-UHFFFAOYSA-N 2 1 361.530 2.983 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@H+]1Cc1ccc(N(C)C)c(C)c1)CC[NH2+]CC2 ZINC001222221104 1032830850 /nfs/dbraw/zinc/83/08/50/1032830850.db2.gz JZTQJBNRUKIQGC-LJQANCHMSA-N 2 1 359.514 2.568 20 10 FFCDMP OC1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)cc2)CC1 ZINC000903202654 1020735687 /nfs/dbraw/zinc/73/56/87/1020735687.db2.gz DSLUUFYVDHQSIK-PRJVBOEPSA-N 2 1 355.526 2.895 20 10 FFCDMP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001116565354 1021288324 /nfs/dbraw/zinc/28/83/24/1021288324.db2.gz PWPHRPWJULUIRW-NVXWUHKLSA-N 2 1 359.514 2.781 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222609293 1033071839 /nfs/dbraw/zinc/07/18/39/1033071839.db2.gz MPZMLUAWJBJNKD-FQEVSTJZSA-N 2 1 351.494 2.950 20 10 FFCDMP COc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222609293 1033071852 /nfs/dbraw/zinc/07/18/52/1033071852.db2.gz MPZMLUAWJBJNKD-FQEVSTJZSA-N 2 1 351.494 2.950 20 10 FFCDMP C[N@@H+](Cc1ccco1)[C@H]1COC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001141157490 1025537917 /nfs/dbraw/zinc/53/79/17/1025537917.db2.gz JTUWSXNKDJGEJJ-QGZVFWFLSA-N 2 1 372.465 2.946 20 10 FFCDMP Cc1[nH]c2nc[nH+]c(NCc3ccc(N4CC[NH+](C)CC4)cc3)c2c1C ZINC001156657244 1029291356 /nfs/dbraw/zinc/29/13/56/1029291356.db2.gz JGDSNNSHULOIEZ-UHFFFAOYSA-N 2 1 350.470 2.939 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000843058448 1031165859 /nfs/dbraw/zinc/16/58/59/1031165859.db2.gz SLJCAKOKHUPWLK-CTNGQTDRSA-N 2 1 372.557 2.613 20 10 FFCDMP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001205690983 1031938617 /nfs/dbraw/zinc/93/86/17/1031938617.db2.gz ZTSKNPYJALYQIG-NRFANRHFSA-N 2 1 356.466 2.647 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCN(CCC[NH+](C)C)CC2)c(OC)c1 ZINC001138388936 1034224972 /nfs/dbraw/zinc/22/49/72/1034224972.db2.gz BKWMUGNHLGHMES-UHFFFAOYSA-N 2 1 362.562 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4c5ccccc5C(=O)[C@H]4C3)cc2)CC1 ZINC001139409224 1035093728 /nfs/dbraw/zinc/09/37/28/1035093728.db2.gz XBBOVQXITLPSPM-VXKWHMMOSA-N 2 1 361.489 2.850 20 10 FFCDMP C[N@@H+](CCCC(=O)c1cccnc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408872 1035094078 /nfs/dbraw/zinc/09/40/78/1035094078.db2.gz GEXZCCVVMHFOOI-UHFFFAOYSA-N 2 1 366.509 2.928 20 10 FFCDMP CCOC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139411490 1035095973 /nfs/dbraw/zinc/09/59/73/1035095973.db2.gz ORZHUTCLVBGRTM-QUCCMNQESA-N 2 1 373.541 2.850 20 10 FFCDMP Cc1ccc(C)c(C[NH+]2C[C@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001140180606 1035370911 /nfs/dbraw/zinc/37/09/11/1035370911.db2.gz JLQTYCMCESNHGV-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[NH+]2C[C@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001140180606 1035370915 /nfs/dbraw/zinc/37/09/15/1035370915.db2.gz JLQTYCMCESNHGV-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[N@@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001140180606 1035370920 /nfs/dbraw/zinc/37/09/20/1035370920.db2.gz JLQTYCMCESNHGV-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[N@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001140180606 1035370922 /nfs/dbraw/zinc/37/09/22/1035370922.db2.gz JLQTYCMCESNHGV-RTBURBONSA-N 2 1 354.498 2.696 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](CCO)Cc3cccs3)cc2)CC1 ZINC001140305277 1035427544 /nfs/dbraw/zinc/42/75/44/1035427544.db2.gz SXJLKFYHLXUNPN-UHFFFAOYSA-N 2 1 359.539 2.885 20 10 FFCDMP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4cc(O)c(O)cc4O)C[C@@H]3C2)cc1 ZINC001233484129 1036650738 /nfs/dbraw/zinc/65/07/38/1036650738.db2.gz ZBMPDMJWKQJCKO-ROUUACIJSA-N 2 1 354.450 2.676 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487295 1036655428 /nfs/dbraw/zinc/65/54/28/1036655428.db2.gz XWAHNSRBHGLXHL-FUHWJXTLSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487295 1036655440 /nfs/dbraw/zinc/65/54/40/1036655440.db2.gz XWAHNSRBHGLXHL-FUHWJXTLSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487295 1036655453 /nfs/dbraw/zinc/65/54/53/1036655453.db2.gz XWAHNSRBHGLXHL-FUHWJXTLSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487295 1036655463 /nfs/dbraw/zinc/65/54/63/1036655463.db2.gz XWAHNSRBHGLXHL-FUHWJXTLSA-N 2 1 354.450 2.757 20 10 FFCDMP CC[N@@H+](CCn1ccnc1)Cc1c(Br)ccc(OC)c1O ZINC001231554750 1037676688 /nfs/dbraw/zinc/67/66/88/1037676688.db2.gz BVWHVDRLDFTZNX-UHFFFAOYSA-N 2 1 354.248 2.882 20 10 FFCDMP C[NH+]1CCN(C(=O)C2CC[NH+](Cc3ccc(C(C)(C)C)cc3O)CC2)CC1 ZINC001235683486 1037679700 /nfs/dbraw/zinc/67/97/00/1037679700.db2.gz GMDMVLUCUVEUOM-UHFFFAOYSA-N 2 1 373.541 2.676 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715892 1037707964 /nfs/dbraw/zinc/70/79/64/1037707964.db2.gz XDLHRZVYNXXGFY-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715892 1037707979 /nfs/dbraw/zinc/70/79/79/1037707979.db2.gz XDLHRZVYNXXGFY-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235715892 1037707997 /nfs/dbraw/zinc/70/79/97/1037707997.db2.gz XDLHRZVYNXXGFY-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]1C[NH2+]CC2 ZINC001236041202 1037904706 /nfs/dbraw/zinc/90/47/06/1037904706.db2.gz QPZOTRTWXAQYNR-DYESRHJHSA-N 2 1 360.498 2.664 20 10 FFCDMP COC(=O)c1c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599809 1038148270 /nfs/dbraw/zinc/14/82/70/1038148270.db2.gz DQQYJLCTUFPXPE-HNNXBMFYSA-N 2 1 355.482 2.929 20 10 FFCDMP COC(=O)c1c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c2ccccc2n1C ZINC001236599809 1038148274 /nfs/dbraw/zinc/14/82/74/1038148274.db2.gz DQQYJLCTUFPXPE-HNNXBMFYSA-N 2 1 355.482 2.929 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCN(c4ccccc4)CC3)c(F)c2)CC1 ZINC001236931244 1038364339 /nfs/dbraw/zinc/36/43/39/1038364339.db2.gz IASMELOTRNEZGW-UHFFFAOYSA-N 2 1 368.500 2.900 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c1 ZINC001278617044 1038843828 /nfs/dbraw/zinc/84/38/28/1038843828.db2.gz OGGKBIJJAKNLMJ-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC[C@@]3(CC[N@H+](CCn4ccnc4)C3)C2)c1 ZINC001278617044 1038843851 /nfs/dbraw/zinc/84/38/51/1038843851.db2.gz OGGKBIJJAKNLMJ-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC[C@@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c1 ZINC001278617044 1038843873 /nfs/dbraw/zinc/84/38/73/1038843873.db2.gz OGGKBIJJAKNLMJ-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c1 ZINC001278617045 1038844370 /nfs/dbraw/zinc/84/43/70/1038844370.db2.gz OGGKBIJJAKNLMJ-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC[C@]3(CC[N@H+](CCn4ccnc4)C3)C2)c1 ZINC001278617045 1038844398 /nfs/dbraw/zinc/84/43/98/1038844398.db2.gz OGGKBIJJAKNLMJ-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC[C@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c1 ZINC001278617045 1038844425 /nfs/dbraw/zinc/84/44/25/1038844425.db2.gz OGGKBIJJAKNLMJ-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[NH+](C)CC[C@@H]4C3)cc2)CC1 ZINC001278474404 1039551558 /nfs/dbraw/zinc/55/15/58/1039551558.db2.gz HVLSAUZQLFYMSX-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@@H]4CC[N@@H+](C)CC[C@@H]4C3)cc2)CC1 ZINC001278474404 1039551569 /nfs/dbraw/zinc/55/15/69/1039551569.db2.gz HVLSAUZQLFYMSX-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3C[C@@H]4CC[N@H+](C)CC[C@@H]4C3)cc2)CC1 ZINC001278474404 1039551581 /nfs/dbraw/zinc/55/15/81/1039551581.db2.gz HVLSAUZQLFYMSX-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP Cc1cc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2O)CC3)n(C)n1 ZINC001278552732 1041120799 /nfs/dbraw/zinc/12/07/99/1041120799.db2.gz XVJOEAVSODQTSE-UHFFFAOYSA-N 2 1 354.498 2.922 20 10 FFCDMP COc1cccc(C[NH+]2CCC3(CC[N@@H+](Cc4cn[nH]c4)C3)CC2)c1O ZINC001278562786 1041181171 /nfs/dbraw/zinc/18/11/71/1041181171.db2.gz LYEPJCRBNOHAFC-UHFFFAOYSA-N 2 1 356.470 2.612 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3COCc4ccccc43)cc2F)CC1 ZINC001261376297 1041198674 /nfs/dbraw/zinc/19/86/74/1041198674.db2.gz MCJDIMNJGYZLEJ-FQEVSTJZSA-N 2 1 355.457 2.939 20 10 FFCDMP Cc1cc(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cc(C)[nH+]1 ZINC001215828308 1041892554 /nfs/dbraw/zinc/89/25/54/1041892554.db2.gz FRQKALNDYBCIHS-LJQANCHMSA-N 2 1 355.486 2.611 20 10 FFCDMP Cc1ccc(C[N@H+]2CCC[C@]3(CC[NH+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338726 1043011331 /nfs/dbraw/zinc/01/13/31/1043011331.db2.gz PKKYVSAYOJSWMS-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(C[NH+]2CCC[C@]3(CC[N@H+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338726 1043011336 /nfs/dbraw/zinc/01/13/36/1043011336.db2.gz PKKYVSAYOJSWMS-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c(O)c1 ZINC001279338726 1043011340 /nfs/dbraw/zinc/01/13/40/1043011340.db2.gz PKKYVSAYOJSWMS-OAQYLSRUSA-N 2 1 354.498 2.885 20 10 FFCDMP Oc1cccc(F)c1C[NH+]1CCC2(CC[N@H+](CCn3ccnc3)C2)CC1 ZINC001279421355 1043093795 /nfs/dbraw/zinc/09/37/95/1043093795.db2.gz FRCHZFJGKDUCBD-UHFFFAOYSA-N 2 1 358.461 2.716 20 10 FFCDMP Oc1cccc(F)c1C[NH+]1CCC2(CC[N@@H+](CCn3ccnc3)C2)CC1 ZINC001279421355 1043093809 /nfs/dbraw/zinc/09/38/09/1043093809.db2.gz FRCHZFJGKDUCBD-UHFFFAOYSA-N 2 1 358.461 2.716 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC12C[NH2+]C2 ZINC001237432301 1043158134 /nfs/dbraw/zinc/15/81/34/1043158134.db2.gz XGCXLRXSEJQWIT-QGZVFWFLSA-N 2 1 360.498 2.664 20 10 FFCDMP CN1Cc2ccccc2[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001323023901 1046311278 /nfs/dbraw/zinc/31/12/78/1046311278.db2.gz AABOGHRWZPMRQZ-OAQYLSRUSA-N 2 1 368.500 2.854 20 10 FFCDMP Cc1cccc(C[C@@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001326129788 1046777539 /nfs/dbraw/zinc/77/75/39/1046777539.db2.gz OKVZZEBQUGHGHK-FQEVSTJZSA-N 2 1 371.500 2.579 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)cc2F)CC1 ZINC001331397783 1047914285 /nfs/dbraw/zinc/91/42/85/1047914285.db2.gz FLLARMMAIKDCNV-SIKLNZKXSA-N 2 1 369.484 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)cc2F)CC1 ZINC001331397783 1047914295 /nfs/dbraw/zinc/91/42/95/1047914295.db2.gz FLLARMMAIKDCNV-SIKLNZKXSA-N 2 1 369.484 2.885 20 10 FFCDMP COc1ccc(C[NH2+]CCC[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1C ZINC001506924316 1059577817 /nfs/dbraw/zinc/57/78/17/1059577817.db2.gz VFPOUMAGVHLVSE-YQVWRLOYSA-N 2 1 361.530 2.718 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)Cc3ccccc3)cc2F)CC1 ZINC001461101083 1061208901 /nfs/dbraw/zinc/20/89/01/1061208901.db2.gz PBEQXPXSXXLPPN-FQEVSTJZSA-N 2 1 371.500 2.518 20 10 FFCDMP COc1c([O-])c(C[N@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463767 1061634133 /nfs/dbraw/zinc/63/41/33/1061634133.db2.gz WHQWJVJERGETJW-HIFRSBDPSA-N 2 1 351.447 2.861 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809389 509306107 /nfs/dbraw/zinc/30/61/07/509306107.db2.gz DXFFJDSHGKHVET-WOIUINJBSA-N 2 1 374.573 2.526 20 10 FFCDMP Cc1cccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@H](C(N)=O)C3)c2)c1O ZINC000182202622 510812546 /nfs/dbraw/zinc/81/25/46/510812546.db2.gz NGGAJGLEHOSENP-FQEVSTJZSA-N 2 1 367.493 2.688 20 10 FFCDMP COCC[NH+](CCOC)C1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000285086958 511994241 /nfs/dbraw/zinc/99/42/41/511994241.db2.gz KECJAIQUTQLZJH-UHFFFAOYSA-N 2 1 350.503 2.568 20 10 FFCDMP COc1c([O-])c(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000375690803 512457513 /nfs/dbraw/zinc/45/75/13/512457513.db2.gz IGCQHFHOPNASIT-INIZCTEOSA-N 2 1 371.437 2.921 20 10 FFCDMP CCC1(CC)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[S@]1=O ZINC000769558209 737542027 /nfs/dbraw/zinc/54/20/27/737542027.db2.gz UAZASGZXEURAGL-RUZDIDTESA-N 2 1 363.571 2.562 20 10 FFCDMP CCC1(CC)C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[S@]1=O ZINC000769558209 737542031 /nfs/dbraw/zinc/54/20/31/737542031.db2.gz UAZASGZXEURAGL-RUZDIDTESA-N 2 1 363.571 2.562 20 10 FFCDMP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502163 738097524 /nfs/dbraw/zinc/09/75/24/738097524.db2.gz PDJPOMRMWGYCQI-CZUORRHYSA-N 2 1 353.894 2.674 20 10 FFCDMP CCOc1ccc(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391441 988549397 /nfs/dbraw/zinc/54/93/97/988549397.db2.gz CTUJFQVXHWCNKP-PBASOCQRSA-N 2 1 362.514 2.750 20 10 FFCDMP CCOc1cccc(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000702601503 990009538 /nfs/dbraw/zinc/00/95/38/990009538.db2.gz IJKIOSMKGPUZJN-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1cccc(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000702601503 990009544 /nfs/dbraw/zinc/00/95/44/990009544.db2.gz IJKIOSMKGPUZJN-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000879650589 1015626092 /nfs/dbraw/zinc/62/60/92/1015626092.db2.gz IKETWWAAGJMAIB-YQVWRLOYSA-N 2 1 367.493 2.822 20 10 FFCDMP CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1N[C@@H](C)[C@H]1C[NH2+]CCO1)N=[N+]=[N-] ZINC001170563409 994316288 /nfs/dbraw/zinc/31/62/88/994316288.db2.gz LWCWQTGMCYXKDP-ORUOVYNKSA-N 2 1 374.445 2.702 20 10 FFCDMP Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000826941319 1016237451 /nfs/dbraw/zinc/23/74/51/1016237451.db2.gz IBSRTKHRFXKLFE-JOCHJYFZSA-N 2 1 353.510 2.917 20 10 FFCDMP COc1ccc([C@@H](C[NH3+])C[N@@H+](C)CCN(C)c2ccc(OC)cc2)cc1 ZINC000846225778 1000234713 /nfs/dbraw/zinc/23/47/13/1000234713.db2.gz UKCVXULLJVVDKW-SFHVURJKSA-N 2 1 357.498 2.814 20 10 FFCDMP C[N@H+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465833 1000262941 /nfs/dbraw/zinc/26/29/41/1000262941.db2.gz MHIJMCKXQBVYNB-LAUBAEHRSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000768465833 1000262949 /nfs/dbraw/zinc/26/29/49/1000262949.db2.gz MHIJMCKXQBVYNB-LAUBAEHRSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768465833 1000262953 /nfs/dbraw/zinc/26/29/53/1000262953.db2.gz MHIJMCKXQBVYNB-LAUBAEHRSA-N 2 1 368.477 2.772 20 10 FFCDMP CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775720214 1003786293 /nfs/dbraw/zinc/78/62/93/1003786293.db2.gz IRRJOAJGLRUHGR-RTWAWAEBSA-N 2 1 372.557 2.660 20 10 FFCDMP C[C@@H]1CC[N@H+](Cc2cccc(I)c2O)CC[C@H]1C[NH3+] ZINC001205651461 1004637221 /nfs/dbraw/zinc/63/72/21/1004637221.db2.gz FLNPOUKSSJBKHF-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2cccc(I)c2O)CC[C@H]1C[NH3+] ZINC001205651461 1004637226 /nfs/dbraw/zinc/63/72/26/1004637226.db2.gz FLNPOUKSSJBKHF-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP NC(=[NH2+])N(CCCC[NH3+])C(=O)c1ccccc1NN=C1C=CC(=O)C=C1 ZINC001195278545 1004929761 /nfs/dbraw/zinc/92/97/61/1004929761.db2.gz HYOIVXGJZBICAM-GHVJWSGMSA-N 2 1 354.414 2.882 20 10 FFCDMP COc1ccc(N2CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c(OC)c1 ZINC001172122411 1011658531 /nfs/dbraw/zinc/65/85/31/1011658531.db2.gz ASDOEECQWSCYLA-BCDXTJNWSA-N 2 1 359.514 2.841 20 10 FFCDMP COc1ccc(N2CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c(OC)c1 ZINC001172122411 1011658537 /nfs/dbraw/zinc/65/85/37/1011658537.db2.gz ASDOEECQWSCYLA-BCDXTJNWSA-N 2 1 359.514 2.841 20 10 FFCDMP C[C@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116409868 1021203124 /nfs/dbraw/zinc/20/31/24/1021203124.db2.gz ICLOUYYIKIYAKQ-BEFAXECRSA-N 2 1 361.461 2.772 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[N@@H+](C(C)(C)C)CC3)cc2F)CC1 ZINC001116444534 1021221195 /nfs/dbraw/zinc/22/11/95/1021221195.db2.gz XLTUVZLHOOHJSV-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[N@H+](C(C)(C)C)CC3)cc2F)CC1 ZINC001116444534 1021221210 /nfs/dbraw/zinc/22/12/10/1021221210.db2.gz XLTUVZLHOOHJSV-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116449601 1021223500 /nfs/dbraw/zinc/22/35/00/1021223500.db2.gz RKFYZAHRQAPPMJ-FQEVSTJZSA-N 2 1 371.504 2.957 20 10 FFCDMP Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116449601 1021223503 /nfs/dbraw/zinc/22/35/03/1021223503.db2.gz RKFYZAHRQAPPMJ-FQEVSTJZSA-N 2 1 371.504 2.957 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547806 1023727140 /nfs/dbraw/zinc/72/71/40/1023727140.db2.gz HPKIXVTXZCIKCG-YJBOKZPZSA-N 2 1 359.514 2.509 20 10 FFCDMP CN(C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204240227 1031181933 /nfs/dbraw/zinc/18/19/33/1031181933.db2.gz LVRHUYWFAXARAP-GOSISDBHSA-N 2 1 368.525 2.548 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](NC(=O)C[NH+](C)C)C2)c2ccccc21 ZINC001204240227 1031181938 /nfs/dbraw/zinc/18/19/38/1031181938.db2.gz LVRHUYWFAXARAP-GOSISDBHSA-N 2 1 368.525 2.548 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2CCC[C@@H](NC(=O)C[NH+](C)C)C2)c2ccccc21 ZINC001204240227 1031181943 /nfs/dbraw/zinc/18/19/43/1031181943.db2.gz LVRHUYWFAXARAP-GOSISDBHSA-N 2 1 368.525 2.548 20 10 FFCDMP C[NH+]1CCN(C(=O)C2CC[NH+](Cc3cccc(C(C)(C)C)c3O)CC2)CC1 ZINC001143111025 1031241228 /nfs/dbraw/zinc/24/12/28/1031241228.db2.gz UQZATYDBXRDEOG-UHFFFAOYSA-N 2 1 373.541 2.676 20 10 FFCDMP CCCCOC(=O)[C@H]1CC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259673 1035032107 /nfs/dbraw/zinc/03/21/07/1035032107.db2.gz AOJQUJQEGJVFJC-INIZCTEOSA-N 2 1 364.486 2.628 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@]1(O)C(F)(F)F ZINC001139408741 1035092980 /nfs/dbraw/zinc/09/29/80/1035092980.db2.gz PWFNIOSZSKAOSX-QAPCUYQASA-N 2 1 371.447 2.574 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C ZINC001139413541 1035096878 /nfs/dbraw/zinc/09/68/78/1035096878.db2.gz WAFOSTUWXFKQCT-XLIONFOSSA-N 2 1 359.514 2.602 20 10 FFCDMP Oc1ccc(F)cc1C[N@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001140055618 1035324649 /nfs/dbraw/zinc/32/46/49/1035324649.db2.gz NGOCEAPSBAGTOS-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CC[C@@H]2C[N@H+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001140055618 1035324654 /nfs/dbraw/zinc/32/46/54/1035324654.db2.gz NGOCEAPSBAGTOS-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001140055618 1035324656 /nfs/dbraw/zinc/32/46/56/1035324656.db2.gz NGOCEAPSBAGTOS-DYESRHJHSA-N 2 1 371.456 2.649 20 10 FFCDMP COC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)C1 ZINC001140185139 1035371874 /nfs/dbraw/zinc/37/18/74/1035371874.db2.gz PRVJGGJMGJMJJC-QGZVFWFLSA-N 2 1 360.498 2.858 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4cccnc4)C3)cc2)CC1 ZINC001140304532 1035426478 /nfs/dbraw/zinc/42/64/78/1035426478.db2.gz TXDDROLEKUJVKO-JOCHJYFZSA-N 2 1 366.509 2.877 20 10 FFCDMP CCC[NH+]1C[C@H]2CN(Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309876 1035429833 /nfs/dbraw/zinc/42/98/33/1035429833.db2.gz XZPADNBKTOLSGF-SFTDATJTSA-N 2 1 356.558 2.602 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745160 1036034635 /nfs/dbraw/zinc/03/46/35/1036034635.db2.gz YKKVWESVDDAGPJ-RXVVDRJESA-N 2 1 360.498 2.587 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745160 1036034655 /nfs/dbraw/zinc/03/46/55/1036034655.db2.gz YKKVWESVDDAGPJ-RXVVDRJESA-N 2 1 360.498 2.587 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(O)c(C)c1O)C2 ZINC001140745160 1036034678 /nfs/dbraw/zinc/03/46/78/1036034678.db2.gz YKKVWESVDDAGPJ-RXVVDRJESA-N 2 1 360.498 2.587 20 10 FFCDMP CC(C)N1CCOC[C@@]2(CCC[N@@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836977 1036090711 /nfs/dbraw/zinc/09/07/11/1036090711.db2.gz XZLWSNBWMSGTTB-OAQYLSRUSA-N 2 1 361.530 2.781 20 10 FFCDMP CC(C)[NH+]1CCOC[C@@]2(CCC[N@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836977 1036090766 /nfs/dbraw/zinc/09/07/66/1036090766.db2.gz XZLWSNBWMSGTTB-OAQYLSRUSA-N 2 1 361.530 2.781 20 10 FFCDMP CC(C)[NH+]1CCOC[C@@]2(CCC[N@@H+](Cc3ccc(N(C)C)cc3O)C2)C1 ZINC001232836977 1036090787 /nfs/dbraw/zinc/09/07/87/1036090787.db2.gz XZLWSNBWMSGTTB-OAQYLSRUSA-N 2 1 361.530 2.781 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)c(Cl)c1 ZINC001140925067 1036462806 /nfs/dbraw/zinc/46/28/06/1036462806.db2.gz YZWYRGBHVMKCOG-RBUKOAKNSA-N 2 1 350.938 2.616 20 10 FFCDMP COCC[N@@H+](Cc1cccc(OC(F)(F)F)c1O)C1CCN(C)CC1 ZINC001233754261 1036745832 /nfs/dbraw/zinc/74/58/32/1036745832.db2.gz BPMKEJHTFNZVGB-UHFFFAOYSA-N 2 1 362.392 2.833 20 10 FFCDMP COc1cc(O)c(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(OC)c1 ZINC001141028328 1036766130 /nfs/dbraw/zinc/76/61/30/1036766130.db2.gz KUHZKROBRAJHTL-HDICACEKSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(OC)c1 ZINC001141028328 1036766152 /nfs/dbraw/zinc/76/61/52/1036766152.db2.gz KUHZKROBRAJHTL-HDICACEKSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(OC)c1 ZINC001141028328 1036766171 /nfs/dbraw/zinc/76/61/71/1036766171.db2.gz KUHZKROBRAJHTL-HDICACEKSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(OC)c1 ZINC001141028328 1036766185 /nfs/dbraw/zinc/76/61/85/1036766185.db2.gz KUHZKROBRAJHTL-HDICACEKSA-N 2 1 368.477 2.973 20 10 FFCDMP Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235423697 1037541647 /nfs/dbraw/zinc/54/16/47/1037541647.db2.gz GJFKMRLIVCSYRZ-ZWKOTPCHSA-N 2 1 361.505 2.874 20 10 FFCDMP CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235694383 1037691061 /nfs/dbraw/zinc/69/10/61/1037691061.db2.gz DSAUNZLEAXDHDQ-GOSISDBHSA-N 2 1 359.514 2.650 20 10 FFCDMP CC1(N2CC[NH+](Cc3cc(C(F)(F)F)ccc3O)CC2)CC[NH2+]CC1 ZINC001235822015 1037769944 /nfs/dbraw/zinc/76/99/44/1037769944.db2.gz PIUQYVCWEPQSGB-UHFFFAOYSA-N 2 1 357.420 2.671 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CCC([NH+]2CCOCC2)CC1 ZINC001256695139 1038605227 /nfs/dbraw/zinc/60/52/27/1038605227.db2.gz OKUYOPLBMYEZHQ-UHFFFAOYSA-N 2 1 373.541 2.598 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@@H]3CC[NH2+]C4(CCCCC4)C3)cc2)CC1 ZINC001246184747 1039268529 /nfs/dbraw/zinc/26/85/29/1039268529.db2.gz PBUFJABHTXCAAZ-HXUWFJFHSA-N 2 1 356.558 2.983 20 10 FFCDMP C[C@H]1C[C@H]([NH+]2CCN(c3ccc(OCc4cccnc4)cc3)CC2)CC[NH2+]1 ZINC001246998867 1039569783 /nfs/dbraw/zinc/56/97/83/1039569783.db2.gz HFFGQHCYSOSFQI-GHTZIAJQSA-N 2 1 366.509 2.923 20 10 FFCDMP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001253996359 1040499645 /nfs/dbraw/zinc/49/96/45/1040499645.db2.gz CGSUMWYZOOAEAX-UHFFFAOYSA-N 3 1 362.537 2.741 20 10 FFCDMP Oc1ccc([C@@H](O)C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1O ZINC001255122685 1041157486 /nfs/dbraw/zinc/15/74/86/1041157486.db2.gz IUXLKTFVRDREAA-VWNVYAMZSA-N 2 1 368.477 2.916 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cc2F)CC1 ZINC001261579064 1041314040 /nfs/dbraw/zinc/31/40/40/1041314040.db2.gz WWVYWIRWLJJMBC-HXUWFJFHSA-N 3 1 374.548 2.789 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CC[NH+](Cc4cn[nH]c4)CC[C@@H]3C2)cc1 ZINC001279149383 1042920654 /nfs/dbraw/zinc/92/06/54/1042920654.db2.gz GHXZZPWJBSOPNK-BGYRXZFFSA-N 2 1 353.514 2.820 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](Cc4cn[nH]c4)CC[C@@H]3C2)cc1 ZINC001279149383 1042920657 /nfs/dbraw/zinc/92/06/57/1042920657.db2.gz GHXZZPWJBSOPNK-BGYRXZFFSA-N 2 1 353.514 2.820 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@@H]3CC[N@H+](Cc4cn[nH]c4)CC[C@@H]3C2)cc1 ZINC001279149383 1042920661 /nfs/dbraw/zinc/92/06/61/1042920661.db2.gz GHXZZPWJBSOPNK-BGYRXZFFSA-N 2 1 353.514 2.820 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001279533094 1043232274 /nfs/dbraw/zinc/23/22/74/1043232274.db2.gz DHJXFXKMEOOUHW-SZPZYZBQSA-N 2 1 356.558 2.887 20 10 FFCDMP CNC(=O)C[N@@H+]1CCCC12CCN(Cc1cc(Cl)cc(C)c1O)CC2 ZINC001237679222 1043307107 /nfs/dbraw/zinc/30/71/07/1043307107.db2.gz HAMKOZHFGCIBDZ-UHFFFAOYSA-N 2 1 365.905 2.530 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202858 1046808772 /nfs/dbraw/zinc/80/87/72/1046808772.db2.gz WFSYWIFDXYJWBG-VQTJNVASSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202858 1046808795 /nfs/dbraw/zinc/80/87/95/1046808795.db2.gz WFSYWIFDXYJWBG-VQTJNVASSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202858 1046808815 /nfs/dbraw/zinc/80/88/15/1046808815.db2.gz WFSYWIFDXYJWBG-VQTJNVASSA-N 3 1 374.548 2.789 20 10 FFCDMP CC(C)[C@H](O)C(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001461418590 1061314972 /nfs/dbraw/zinc/31/49/72/1061314972.db2.gz XWWZIQHKPKBMFE-IBGZPJMESA-N 2 1 351.510 2.710 20 10 FFCDMP COc1cc(Br)cc(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c1O ZINC000366536664 512077749 /nfs/dbraw/zinc/07/77/49/512077749.db2.gz SPYWKHJTDJNQRU-INIZCTEOSA-N 2 1 355.276 2.691 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391140 738135957 /nfs/dbraw/zinc/13/59/57/738135957.db2.gz SWKFEMZFDMTBCV-MOIQIXESSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391140 738135959 /nfs/dbraw/zinc/13/59/59/738135959.db2.gz SWKFEMZFDMTBCV-MOIQIXESSA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391140 738135960 /nfs/dbraw/zinc/13/59/60/738135960.db2.gz SWKFEMZFDMTBCV-MOIQIXESSA-N 2 1 356.869 2.754 20 10 FFCDMP Oc1ccc(Br)cc1C[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000841043186 747259874 /nfs/dbraw/zinc/25/98/74/747259874.db2.gz TUBSWUNQMNWCIN-UHFFFAOYSA-N 2 1 350.260 2.819 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](OCc4ccccn4)C3)cc2)CC1 ZINC000877645487 1014658990 /nfs/dbraw/zinc/65/89/90/1014658990.db2.gz MSZNOTSFWZZYPF-JOCHJYFZSA-N 2 1 366.509 2.625 20 10 FFCDMP [NH3+][C@@H]1CCCCC[C@H]1NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918326 1007810152 /nfs/dbraw/zinc/81/01/52/1007810152.db2.gz YRSHSKREEJTCKF-FGZHOGPDSA-N 2 1 356.558 2.968 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@](C)(O)c1ccccc1 ZINC000822517345 1008665503 /nfs/dbraw/zinc/66/55/03/1008665503.db2.gz WHYSRIVUGQEYPV-JOCHJYFZSA-N 2 1 353.510 2.778 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC3(O)CCC(C)(C)CC3)cc2F)CC1 ZINC001179232609 1009289106 /nfs/dbraw/zinc/28/91/06/1009289106.db2.gz JHOVVKXAOMCWIL-UHFFFAOYSA-N 2 1 363.521 2.998 20 10 FFCDMP COC(=O)c1cc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)oc1C ZINC001116472049 1021234888 /nfs/dbraw/zinc/23/48/88/1021234888.db2.gz RUVWOIIFAVPUJN-UHFFFAOYSA-N 2 1 371.481 2.758 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](O)[C@H](C4CCCC4)C3)cc2)CC1 ZINC000839190792 1026616487 /nfs/dbraw/zinc/61/64/87/1026616487.db2.gz BVPAQCMUYUOYHQ-FCHUYYIVSA-N 2 1 357.542 2.811 20 10 FFCDMP C[C@@H](C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000839193861 1026617943 /nfs/dbraw/zinc/61/79/43/1026617943.db2.gz XAXFKBGZSJACGH-KRWDZBQOSA-N 2 1 361.530 2.848 20 10 FFCDMP Oc1cc(F)c(F)cc1C[NH+]1CCC(COCC[NH+]2CCCC2)CC1 ZINC001142508549 1030558913 /nfs/dbraw/zinc/55/89/13/1030558913.db2.gz COVPGEIUZSMXGV-UHFFFAOYSA-N 2 1 354.441 2.995 20 10 FFCDMP COc1ccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001203623471 1030792065 /nfs/dbraw/zinc/79/20/65/1030792065.db2.gz SATFOZUVXVLHSL-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(C[N@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001203623471 1030792068 /nfs/dbraw/zinc/79/20/68/1030792068.db2.gz SATFOZUVXVLHSL-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(C[NH+]2C[C@H]3CC[N@H+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001203623471 1030792081 /nfs/dbraw/zinc/79/20/81/1030792081.db2.gz SATFOZUVXVLHSL-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(C[NH+]2C[C@H]3CC[N@@H+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001203623471 1030792088 /nfs/dbraw/zinc/79/20/88/1030792088.db2.gz SATFOZUVXVLHSL-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(I)cc2O)CC[C@@H]1C[NH3+] ZINC001205637834 1031894381 /nfs/dbraw/zinc/89/43/81/1031894381.db2.gz JESIJSXGXOCVFN-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cc1Br ZINC001205638273 1031896826 /nfs/dbraw/zinc/89/68/26/1031896826.db2.gz LVAZEYYOJNZBHH-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(C[N@@H+]2CCc3cc(CO)ccc3C2)cc(C[NH+](C)C)c1O ZINC001139254588 1035030309 /nfs/dbraw/zinc/03/03/09/1035030309.db2.gz IYFFXNDGOHUBQL-UHFFFAOYSA-N 2 1 356.466 2.513 20 10 FFCDMP COc1cc(C[N@H+]2CCc3cc(CO)ccc3C2)cc(C[NH+](C)C)c1O ZINC001139254588 1035030316 /nfs/dbraw/zinc/03/03/16/1035030316.db2.gz IYFFXNDGOHUBQL-UHFFFAOYSA-N 2 1 356.466 2.513 20 10 FFCDMP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCN(C(C)=O)CC1 ZINC001139412863 1035096478 /nfs/dbraw/zinc/09/64/78/1035096478.db2.gz QJSMELVMJSCCSF-UHFFFAOYSA-N 2 1 372.557 2.661 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](c4noc(C)n4)C3)cc2)CC1 ZINC001140301929 1035424943 /nfs/dbraw/zinc/42/49/43/1035424943.db2.gz DOCRQZXSZRTEAG-IBGZPJMESA-N 2 1 369.513 2.900 20 10 FFCDMP CCOC(=O)[C@]1(C)CCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140306587 1035428374 /nfs/dbraw/zinc/42/83/74/1035428374.db2.gz UVPZNZRAJSDWBZ-JOCHJYFZSA-N 2 1 373.541 2.994 20 10 FFCDMP Cc1ccc(O)c(CN2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749643 /nfs/dbraw/zinc/74/96/43/1035749643.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749657 /nfs/dbraw/zinc/74/96/57/1035749657.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749672 /nfs/dbraw/zinc/74/96/72/1035749672.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749687 /nfs/dbraw/zinc/74/96/87/1035749687.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(O)c(C[N@@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c1 ZINC001140622258 1035749705 /nfs/dbraw/zinc/74/97/05/1035749705.db2.gz ZVKKIURLGIKRGZ-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1cc(Br)c([O-])c(CN2CC[C@]3(C2)C[NH2+]CC[C@H]3F)c1 ZINC001235409295 1037531938 /nfs/dbraw/zinc/53/19/38/1037531938.db2.gz WAXLTEJTGROOEA-GDBMZVCRSA-N 2 1 357.267 2.987 20 10 FFCDMP c1ccc(C[N@@H+]2CCCN(Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235658815 1037668221 /nfs/dbraw/zinc/66/82/21/1037668221.db2.gz HFLIWBMQZZRFDF-UHFFFAOYSA-N 2 1 364.537 2.804 20 10 FFCDMP c1ccc(CN2CCC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235658815 1037668233 /nfs/dbraw/zinc/66/82/33/1037668233.db2.gz HFLIWBMQZZRFDF-UHFFFAOYSA-N 2 1 364.537 2.804 20 10 FFCDMP c1ccc(CN2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001235658815 1037668241 /nfs/dbraw/zinc/66/82/41/1037668241.db2.gz HFLIWBMQZZRFDF-UHFFFAOYSA-N 2 1 364.537 2.804 20 10 FFCDMP COc1ccccc1O[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235689514 1037684124 /nfs/dbraw/zinc/68/41/24/1037684124.db2.gz ZYFXOUKGQLOWDI-FQEVSTJZSA-N 2 1 367.493 2.758 20 10 FFCDMP COCCC[N@@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001235936683 1037844735 /nfs/dbraw/zinc/84/47/35/1037844735.db2.gz FPIYYXFMWPFSIY-UHFFFAOYSA-N 2 1 357.542 2.976 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc(Cl)c(C)cc3O)CC[C@@H]2C1 ZINC001231867470 1037966293 /nfs/dbraw/zinc/96/62/93/1037966293.db2.gz NEADUPPLPZWPMT-DNVCBOLYSA-N 2 1 368.905 2.523 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc(Cl)c(C)cc3O)CC[C@@H]2C1 ZINC001231867470 1037966300 /nfs/dbraw/zinc/96/63/00/1037966300.db2.gz NEADUPPLPZWPMT-DNVCBOLYSA-N 2 1 368.905 2.523 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc(Cl)c(C)cc3O)CC[C@@H]2C1 ZINC001231867470 1037966311 /nfs/dbraw/zinc/96/63/11/1037966311.db2.gz NEADUPPLPZWPMT-DNVCBOLYSA-N 2 1 368.905 2.523 20 10 FFCDMP CN(C)CC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N(C)C)cc3O)(C1)CCC2 ZINC001278924119 1038457168 /nfs/dbraw/zinc/45/71/68/1038457168.db2.gz UTSUUWGTUAPPJU-LEWJYISDSA-N 2 1 360.546 2.544 20 10 FFCDMP COc1ccc(C[N@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001278565448 1041190405 /nfs/dbraw/zinc/19/04/05/1041190405.db2.gz MIAFKSNYBSYWTP-OAQYLSRUSA-N 2 1 361.530 2.640 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(CCN3CC[NH+](C)C)C2)cc1 ZINC001279281047 1042982053 /nfs/dbraw/zinc/98/20/53/1042982053.db2.gz BLNMQKCZNWEVIB-UHFFFAOYSA-N 2 1 352.526 2.916 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCC12C[NH2+]C2 ZINC001237431091 1043155960 /nfs/dbraw/zinc/15/59/60/1043155960.db2.gz MXKZYFDYJCMHOZ-SFHVURJKSA-N 2 1 354.450 2.520 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCC12C[NH2+]C2 ZINC001237432896 1043158586 /nfs/dbraw/zinc/15/85/86/1043158586.db2.gz XMSGLQOYFHTRDK-GOSISDBHSA-N 2 1 354.450 2.520 20 10 FFCDMP Cc1cccc(O)c1C[NH+]1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001237485768 1043198481 /nfs/dbraw/zinc/19/84/81/1043198481.db2.gz LUYKXXWUKCABPS-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1cccc(O)c1C[N@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001237489536 1043203692 /nfs/dbraw/zinc/20/36/92/1043203692.db2.gz YVXADIDKUJUIEV-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP COc1cc(CN2CCC[C@@]3(CCC[N@@H+](C)C3)C2)cc(C[NH+](C)C)c1O ZINC001279698519 1043490399 /nfs/dbraw/zinc/49/03/99/1043490399.db2.gz NEXXJLUUBGRSDR-OAQYLSRUSA-N 2 1 361.530 2.770 20 10 FFCDMP Cc1cc(F)cc(C[N@H+]2C[C@H]3CN(Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001238062881 1043508908 /nfs/dbraw/zinc/50/89/08/1043508908.db2.gz YQGZFXCTBHDUTP-SJLPKXTDSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001238062881 1043508917 /nfs/dbraw/zinc/50/89/17/1043508917.db2.gz YQGZFXCTBHDUTP-SJLPKXTDSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[NH+]2C[C@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001238062881 1043508920 /nfs/dbraw/zinc/50/89/20/1043508920.db2.gz YQGZFXCTBHDUTP-SJLPKXTDSA-N 2 1 358.461 2.527 20 10 FFCDMP Cc1cc(F)cc(C[N@@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c1O ZINC001238062881 1043508925 /nfs/dbraw/zinc/50/89/25/1043508925.db2.gz YQGZFXCTBHDUTP-SJLPKXTDSA-N 2 1 358.461 2.527 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC4(CC[N@H+]4C4CCCC4)C3)cc2)CC1 ZINC001279709837 1043509920 /nfs/dbraw/zinc/50/99/20/1043509920.db2.gz LGXYMFWANZVCTG-UHFFFAOYSA-N 2 1 354.542 2.641 20 10 FFCDMP CCOC(=O)c1cc2c(cc(C)[nH+]c2-c2cnn(C3CC[NH2+]CC3)c2)n1C ZINC001241773293 1044596427 /nfs/dbraw/zinc/59/64/27/1044596427.db2.gz CPMMZOATTQCERP-UHFFFAOYSA-N 2 1 367.453 2.846 20 10 FFCDMP CSc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)ccn1 ZINC001319995840 1045322126 /nfs/dbraw/zinc/32/21/26/1045322126.db2.gz YTLFIJBKRGECJI-UHFFFAOYSA-N 2 1 360.502 2.984 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](O)c1ccccc1 ZINC001329836868 1048932658 /nfs/dbraw/zinc/93/26/58/1048932658.db2.gz YROIZRHEFKQYER-IERDGZPVSA-N 2 1 357.473 2.789 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H]2CO)c(O)c1 ZINC001461994310 1061473207 /nfs/dbraw/zinc/47/32/07/1061473207.db2.gz GTJSNIILNDRYHB-LJQANCHMSA-N 2 1 370.493 2.956 20 10 FFCDMP COc1c([O-])c(C[N@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)ccc1[N+](=O)[O-] ZINC001462463762 1061633953 /nfs/dbraw/zinc/63/39/53/1061633953.db2.gz WHQWJVJERGETJW-DZGCQCFKSA-N 2 1 351.447 2.861 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c2cc(F)ccc2n1C ZINC001560933551 1076310861 /nfs/dbraw/zinc/31/08/61/1076310861.db2.gz SDONYBVRFRSXMK-CQSZACIVSA-N 2 1 361.461 2.926 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c2cc(F)ccc2n1C ZINC001560933551 1076310869 /nfs/dbraw/zinc/31/08/69/1076310869.db2.gz SDONYBVRFRSXMK-CQSZACIVSA-N 2 1 361.461 2.926 20 10 FFCDMP Cc1ccc(O)c(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000113339857 508261636 /nfs/dbraw/zinc/26/16/36/508261636.db2.gz DSZJKXYOSCRYQO-LJQANCHMSA-N 2 1 367.493 2.688 20 10 FFCDMP COc1c(O)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000278265380 510986677 /nfs/dbraw/zinc/98/66/77/510986677.db2.gz QXNWNEZYPMXFCN-UHFFFAOYSA-N 2 1 351.447 2.863 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000370697441 513058931 /nfs/dbraw/zinc/05/89/31/513058931.db2.gz GGUJYQSFRLCXQZ-SIKLNZKXSA-N 2 1 358.574 2.991 20 10 FFCDMP COc1c(O)c(C[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000877697208 732415643 /nfs/dbraw/zinc/41/56/43/732415643.db2.gz IDLWLYSXUSCDME-UHFFFAOYSA-N 2 1 351.447 2.909 20 10 FFCDMP COc1cc(Br)cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1O ZINC000725846021 734395872 /nfs/dbraw/zinc/39/58/72/734395872.db2.gz UMFJXVVGZYUDFZ-ZIAGYGMSSA-N 2 1 355.276 2.880 20 10 FFCDMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502161 738097827 /nfs/dbraw/zinc/09/78/27/738097827.db2.gz PDJPOMRMWGYCQI-BBRMVZONSA-N 2 1 353.894 2.674 20 10 FFCDMP CC[C@@H]([NH2+]C[C@]1(COC)CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817975011 742226103 /nfs/dbraw/zinc/22/61/03/742226103.db2.gz PTXXMQATVDFFQH-ZBFHGGJFSA-N 2 1 357.292 2.964 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000844910436 748134392 /nfs/dbraw/zinc/13/43/92/748134392.db2.gz IBKRXVCHAFMWRK-XHSDSOJGSA-N 2 1 354.878 2.915 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000846222144 748433414 /nfs/dbraw/zinc/43/34/14/748433414.db2.gz GPLIQQNDALUQKR-XCRHUMRWSA-N 2 1 366.889 2.967 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000846222144 748433417 /nfs/dbraw/zinc/43/34/17/748433417.db2.gz GPLIQQNDALUQKR-XCRHUMRWSA-N 2 1 366.889 2.967 20 10 FFCDMP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 ZINC000765973792 987922650 /nfs/dbraw/zinc/92/26/50/987922650.db2.gz FRLSUVXROBFPBN-GCJKJVERSA-N 2 1 373.541 2.817 20 10 FFCDMP Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719175 1016149742 /nfs/dbraw/zinc/14/97/42/1016149742.db2.gz WJRCFTNDNHXMLX-OALUTQOASA-N 2 1 360.498 2.532 20 10 FFCDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768450104 1000250772 /nfs/dbraw/zinc/25/07/72/1000250772.db2.gz HVLKDBIHFQOTTF-FQEVSTJZSA-N 2 1 356.466 2.902 20 10 FFCDMP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)C1 ZINC000769379711 1000504194 /nfs/dbraw/zinc/50/41/94/1000504194.db2.gz DZCALHQYXPVYME-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)C1 ZINC000769379711 1000504196 /nfs/dbraw/zinc/50/41/96/1000504196.db2.gz DZCALHQYXPVYME-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775737498 1003900931 /nfs/dbraw/zinc/90/09/31/1003900931.db2.gz NKKVCWNCFAOSSW-NRFANRHFSA-N 2 1 353.514 2.817 20 10 FFCDMP COc1ccc(N2CC[C@H]([NH2+]C3CC[NH+](C[C@H]4CCCO4)CC3)C2)cc1 ZINC000850488873 1005818460 /nfs/dbraw/zinc/81/84/60/1005818460.db2.gz VMVZNIKKROBRBK-GHTZIAJQSA-N 2 1 359.514 2.507 20 10 FFCDMP CCOc1ccc(C[N@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c(O)c1 ZINC000817413710 1007591709 /nfs/dbraw/zinc/59/17/09/1007591709.db2.gz ALZFZNBLJPPCCX-UHFFFAOYSA-N 2 1 361.530 2.783 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1nccn1C ZINC000775425226 1007852813 /nfs/dbraw/zinc/85/28/13/1007852813.db2.gz XSFUWDZBBVXURG-KRWDZBQOSA-N 2 1 353.514 2.803 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@@H+]1Cc1cc(Cl)c(C)cc1O)CC[NH2+]CC2 ZINC001222226387 1032837852 /nfs/dbraw/zinc/83/78/52/1032837852.db2.gz RPCHJDSHKQFKQU-MRXNPFEDSA-N 2 1 366.889 2.861 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@H+]1Cc1cc(Cl)c(C)cc1O)CC[NH2+]CC2 ZINC001222226387 1032837865 /nfs/dbraw/zinc/83/78/65/1032837865.db2.gz RPCHJDSHKQFKQU-MRXNPFEDSA-N 2 1 366.889 2.861 20 10 FFCDMP CN(C)c1ccc(C[N@@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000190316291 1023614580 /nfs/dbraw/zinc/61/45/80/1023614580.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(CN(C)C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614584 /nfs/dbraw/zinc/61/45/84/1023614584.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(CN(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614587 /nfs/dbraw/zinc/61/45/87/1023614587.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(C[N@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614597 /nfs/dbraw/zinc/61/45/97/1023614597.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(C[N@@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614603 /nfs/dbraw/zinc/61/46/03/1023614603.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(C[NH+](C)C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614609 /nfs/dbraw/zinc/61/46/09/1023614609.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP CN(C)c1ccc(C[NH+](C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000190316291 1023614615 /nfs/dbraw/zinc/61/46/15/1023614615.db2.gz HIQQZFGDXGCLNJ-QFIPXVFZSA-N 2 1 353.510 2.821 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC2(CC1)COCC[N@@H+](Cc1cccnc1)C2 ZINC001203556445 1030767171 /nfs/dbraw/zinc/76/71/71/1030767171.db2.gz QAYAPZMSGPILMC-UHFFFAOYSA-N 2 1 367.493 2.902 20 10 FFCDMP COc1cccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001203591999 1030776472 /nfs/dbraw/zinc/77/64/72/1030776472.db2.gz AAOJTBVZEPBNOB-UHFFFAOYSA-N 2 1 370.497 2.642 20 10 FFCDMP CCOc1cccc(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c1O ZINC001203608498 1030784116 /nfs/dbraw/zinc/78/41/16/1030784116.db2.gz RLBOELVTAHCDGH-DENIHFKCSA-N 2 1 374.525 2.971 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC[C@@H]1C[NH3+] ZINC001205654157 1031908077 /nfs/dbraw/zinc/90/80/77/1031908077.db2.gz WOHLPRFDPMFMDS-JKSUJKDBSA-N 2 1 351.922 2.983 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3c4ccccc4n(C)c3C)CC[C@@H]2C1 ZINC001138255670 1034024643 /nfs/dbraw/zinc/02/46/43/1034024643.db2.gz OVSWRPDDYUJTLQ-XMSQKQJNSA-N 2 1 371.525 2.656 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3c4ccccc4n(C)c3C)CC[C@@H]2C1 ZINC001138255670 1034024660 /nfs/dbraw/zinc/02/46/60/1034024660.db2.gz OVSWRPDDYUJTLQ-XMSQKQJNSA-N 2 1 371.525 2.656 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3c4ccccc4n(C)c3C)CC[C@@H]2C1 ZINC001138255670 1034024677 /nfs/dbraw/zinc/02/46/77/1034024677.db2.gz OVSWRPDDYUJTLQ-XMSQKQJNSA-N 2 1 371.525 2.656 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3ccc(C)cn3)C2)cc(C[NH+](C)C)c1O ZINC001139260413 1035032007 /nfs/dbraw/zinc/03/20/07/1035032007.db2.gz LOKKGMXJBRLJLD-SFHVURJKSA-N 2 1 371.481 2.819 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](c4noc(C)n4)C3)cc2)CC1 ZINC001140301930 1035424972 /nfs/dbraw/zinc/42/49/72/1035424972.db2.gz DOCRQZXSZRTEAG-LJQANCHMSA-N 2 1 369.513 2.900 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001140304395 1035426221 /nfs/dbraw/zinc/42/62/21/1035426221.db2.gz NHDVDXBRVDPBBZ-LJQANCHMSA-N 2 1 373.541 2.992 20 10 FFCDMP CCCNC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304701 1035426388 /nfs/dbraw/zinc/42/63/88/1035426388.db2.gz YSJMIHPGFXQIKO-NRFANRHFSA-N 2 1 372.557 2.709 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3CN3CCCC3)cc2)CC1 ZINC001140304103 1035426466 /nfs/dbraw/zinc/42/64/66/1035426466.db2.gz IHVRLBYCXXSNML-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3CN3CCCC3)cc2)CC1 ZINC001140304103 1035426470 /nfs/dbraw/zinc/42/64/70/1035426470.db2.gz IHVRLBYCXXSNML-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP Cc1c(O)ccc(CN2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047821 /nfs/dbraw/zinc/04/78/21/1036047821.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 1 360.498 2.729 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047839 /nfs/dbraw/zinc/04/78/39/1036047839.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 1 360.498 2.729 20 10 FFCDMP Cc1c(O)ccc(C[N@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047856 /nfs/dbraw/zinc/04/78/56/1036047856.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 1 360.498 2.729 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047876 /nfs/dbraw/zinc/04/78/76/1036047876.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 1 360.498 2.729 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001140748787 1036047887 /nfs/dbraw/zinc/04/78/87/1036047887.db2.gz RJZKXQGCSZSJRP-AZUAARDMSA-N 2 1 360.498 2.729 20 10 FFCDMP CC[NH+](CC)CCCN1CC[NH+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC001233290162 1036494906 /nfs/dbraw/zinc/49/49/06/1036494906.db2.gz MTQXLVOFJZEFSY-UHFFFAOYSA-N 2 1 369.937 2.904 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487297 1036656412 /nfs/dbraw/zinc/65/64/12/1036656412.db2.gz XWAHNSRBHGLXHL-WMZOPIPTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487297 1036656414 /nfs/dbraw/zinc/65/64/14/1036656414.db2.gz XWAHNSRBHGLXHL-WMZOPIPTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487297 1036656420 /nfs/dbraw/zinc/65/64/20/1036656420.db2.gz XWAHNSRBHGLXHL-WMZOPIPTSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1O ZINC001233487297 1036656426 /nfs/dbraw/zinc/65/64/26/1036656426.db2.gz XWAHNSRBHGLXHL-WMZOPIPTSA-N 2 1 354.450 2.757 20 10 FFCDMP CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235776529 1037738538 /nfs/dbraw/zinc/73/85/38/1037738538.db2.gz SWZDEGPNIJOXKI-IBGZPJMESA-N 2 1 359.514 2.792 20 10 FFCDMP CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235776529 1037738555 /nfs/dbraw/zinc/73/85/55/1037738555.db2.gz SWZDEGPNIJOXKI-IBGZPJMESA-N 2 1 359.514 2.792 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CC[C@@]3(CCN(CC[NH+](C)C)C3=O)C2)c(O)c1 ZINC001277976763 1037857634 /nfs/dbraw/zinc/85/76/34/1037857634.db2.gz WBZXVVKIACOFIH-OAQYLSRUSA-N 2 1 359.514 2.502 20 10 FFCDMP CCOCC[N@@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001236461691 1038097441 /nfs/dbraw/zinc/09/74/41/1038097441.db2.gz OTSGCQAIWMQVSI-UHFFFAOYSA-N 2 1 357.542 2.976 20 10 FFCDMP CC(C)c1ccc(C[NH+]2CCC(C(=O)N3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001237049686 1038424197 /nfs/dbraw/zinc/42/41/97/1038424197.db2.gz RSPYPHDMFSDTPX-UHFFFAOYSA-N 2 1 359.514 2.502 20 10 FFCDMP Cc1cc(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)ccc1N(C)C ZINC001278686338 1039774421 /nfs/dbraw/zinc/77/44/21/1039774421.db2.gz LZDBBLKVXOKZBD-QFIPXVFZSA-N 2 1 358.574 2.911 20 10 FFCDMP Oc1ccc(O)c(C[N@H+]2CCC[C@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278751421 1040474714 /nfs/dbraw/zinc/47/47/14/1040474714.db2.gz ZTRDTBSCOHSGGC-FQEVSTJZSA-N 2 1 356.470 2.699 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)c(O)c1 ZINC001249185389 1040619394 /nfs/dbraw/zinc/61/93/94/1040619394.db2.gz LXPFHKJBOUYQBT-UHFFFAOYSA-N 2 1 369.465 2.550 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2CCC3(CC[N@@H+](Cc4cn[nH]c4)C3)CC2)c1O ZINC001279311420 1042995040 /nfs/dbraw/zinc/99/50/40/1042995040.db2.gz APMWYDDEYMUNEY-UHFFFAOYSA-N 2 1 356.470 2.617 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2[C@@H]3CC[C@H]2CN(CC[NH+](C)C)C3)c(Cl)c1 ZINC001279334038 1043008839 /nfs/dbraw/zinc/00/88/39/1043008839.db2.gz YYJOCXITVZIDAE-HDICACEKSA-N 2 1 350.938 2.616 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CN(CC[NH+](C)C)C3)c(Cl)c1 ZINC001279334038 1043008844 /nfs/dbraw/zinc/00/88/44/1043008844.db2.gz YYJOCXITVZIDAE-HDICACEKSA-N 2 1 350.938 2.616 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3c(C)cc(C)cc3O)C[C@H]2CC1 ZINC001279433492 1043107538 /nfs/dbraw/zinc/10/75/38/1043107538.db2.gz XTGOPEGWIKGFFI-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3c(C)cc(C)cc3O)C[C@H]2CC1 ZINC001279433492 1043107540 /nfs/dbraw/zinc/10/75/40/1043107540.db2.gz XTGOPEGWIKGFFI-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3c(C)cc(C)cc3O)C[C@H]2CC1 ZINC001279433492 1043107543 /nfs/dbraw/zinc/10/75/43/1043107543.db2.gz XTGOPEGWIKGFFI-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCC12C[NH2+]C2 ZINC001237432897 1043158698 /nfs/dbraw/zinc/15/86/98/1043158698.db2.gz XMSGLQOYFHTRDK-SFHVURJKSA-N 2 1 354.450 2.520 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c1O ZINC001279476528 1043159884 /nfs/dbraw/zinc/15/98/84/1043159884.db2.gz QMIYAKMRKRHIGV-UHFFFAOYSA-N 2 1 367.921 2.514 20 10 FFCDMP CCOC(=O)C1CC[NH+](C2CC[NH+](Cc3c(C)cccc3O)CC2)CC1 ZINC001237485794 1043197844 /nfs/dbraw/zinc/19/78/44/1043197844.db2.gz SUHMAMWEWNHBPH-UHFFFAOYSA-N 2 1 360.498 2.940 20 10 FFCDMP C[NH+]1CC2(C1)CC[NH+](Cc1cccc(I)c1O)CC2 ZINC001237782027 1043356975 /nfs/dbraw/zinc/35/69/75/1043356975.db2.gz CSDSPRBSOHBOKV-UHFFFAOYSA-N 2 1 372.250 2.524 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC001319717848 1045250734 /nfs/dbraw/zinc/25/07/34/1045250734.db2.gz LTHHCIHSRLCCRA-SIKLNZKXSA-N 2 1 356.558 2.745 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC001324398633 1046006371 /nfs/dbraw/zinc/00/63/71/1046006371.db2.gz VPTQWTZIXUJREI-QFIPXVFZSA-N 2 1 356.558 2.887 20 10 FFCDMP CCc1ccc([C@@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001325658655 1046597861 /nfs/dbraw/zinc/59/78/61/1046597861.db2.gz IUAQCVOLCUDIAX-QFIPXVFZSA-N 2 1 371.500 2.963 20 10 FFCDMP C[C@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325712848 1046619846 /nfs/dbraw/zinc/61/98/46/1046619846.db2.gz DTIOOMVKJDRLHT-PXNSSMCTSA-N 2 1 360.521 2.636 20 10 FFCDMP CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001330422462 1049161823 /nfs/dbraw/zinc/16/18/23/1049161823.db2.gz COIVQVDJNZOIJX-OAQYLSRUSA-N 2 1 363.521 2.808 20 10 FFCDMP CC(C)[C@]1(CO)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001330422462 1049161825 /nfs/dbraw/zinc/16/18/25/1049161825.db2.gz COIVQVDJNZOIJX-OAQYLSRUSA-N 2 1 363.521 2.808 20 10 FFCDMP CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001330422462 1049161831 /nfs/dbraw/zinc/16/18/31/1049161831.db2.gz COIVQVDJNZOIJX-OAQYLSRUSA-N 2 1 363.521 2.808 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](CO)c1ccccc1 ZINC001330533490 1049194557 /nfs/dbraw/zinc/19/45/57/1049194557.db2.gz OHLAKDLSYCYLTL-OAQYLSRUSA-N 2 1 357.473 2.743 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@H](CO)c1ccccc1 ZINC001330533490 1049194564 /nfs/dbraw/zinc/19/45/64/1049194564.db2.gz OHLAKDLSYCYLTL-OAQYLSRUSA-N 2 1 357.473 2.743 20 10 FFCDMP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@@H]1n1ccnc1 ZINC001341604658 1050230273 /nfs/dbraw/zinc/23/02/73/1050230273.db2.gz LEAJPOYMRCOOFI-UWJYYQICSA-N 2 1 371.504 2.857 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@@H]1n1ccnc1 ZINC001341604658 1050230285 /nfs/dbraw/zinc/23/02/85/1050230285.db2.gz LEAJPOYMRCOOFI-UWJYYQICSA-N 2 1 371.504 2.857 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]34C[C@H]3COC43CCC3)cc2F)CC1 ZINC001336873132 1054304974 /nfs/dbraw/zinc/30/49/74/1054304974.db2.gz JXYGXDDXMQFFIT-FXAWDEMLSA-N 2 1 359.489 2.626 20 10 FFCDMP CC[NH+](CC)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001337042713 1054434508 /nfs/dbraw/zinc/43/45/08/1054434508.db2.gz SJYGYBABGSFIIQ-IBGZPJMESA-N 2 1 362.537 2.741 20 10 FFCDMP CN1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc4c(c3)CCO4)c2)CC1 ZINC001461142733 1061223214 /nfs/dbraw/zinc/22/32/14/1061223214.db2.gz SNRFULGWDYUKJF-UHFFFAOYSA-N 2 1 351.494 2.659 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@H+](C)CCCN2CC[NH+](C)CC2)c1 ZINC000809742610 741338785 /nfs/dbraw/zinc/33/87/85/741338785.db2.gz ARBFEHMQMGVSKZ-UHFFFAOYSA-N 2 1 370.335 2.532 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@@H+](C)CCCN2CC[NH+](C)CC2)c1 ZINC000809742610 741338790 /nfs/dbraw/zinc/33/87/90/741338790.db2.gz ARBFEHMQMGVSKZ-UHFFFAOYSA-N 2 1 370.335 2.532 20 10 FFCDMP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000841099530 747268846 /nfs/dbraw/zinc/26/88/46/747268846.db2.gz LGIWARDQFRQSGB-DOTOQJQBSA-N 2 1 369.303 2.873 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1O ZINC000844901388 748131117 /nfs/dbraw/zinc/13/11/17/748131117.db2.gz DRKNHCIVZBKPSV-LRDDRELGSA-N 2 1 355.276 2.724 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1O ZINC000844901388 748131121 /nfs/dbraw/zinc/13/11/21/748131121.db2.gz DRKNHCIVZBKPSV-LRDDRELGSA-N 2 1 355.276 2.724 20 10 FFCDMP CC[C@@H]([NH2+]Cc1cccc(-n2cc(C[NH3+])nn2)c1)c1ccc(F)cc1O ZINC000873242365 1013441233 /nfs/dbraw/zinc/44/12/33/1013441233.db2.gz AREWPPLWRZXPKK-GOSISDBHSA-N 2 1 355.417 2.812 20 10 FFCDMP C[N@H+]1CCCC[C@@H]1CN1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444977 1000250618 /nfs/dbraw/zinc/25/06/18/1000250618.db2.gz DHVVIRPBRDVUSS-OAQYLSRUSA-N 2 1 357.542 2.873 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CCO)c1ccccc1 ZINC000775698624 1003704572 /nfs/dbraw/zinc/70/45/72/1003704572.db2.gz PMHBCLAMJQATAW-QFIPXVFZSA-N 2 1 353.510 2.994 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942908 1007818166 /nfs/dbraw/zinc/81/81/66/1007818166.db2.gz RMRASBAXCXJMNN-URVUXULASA-N 2 1 366.509 2.598 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554323 1007884620 /nfs/dbraw/zinc/88/46/20/1007884620.db2.gz QZUPNCKPIYQMCR-SFHVURJKSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@H+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554323 1007884626 /nfs/dbraw/zinc/88/46/26/1007884626.db2.gz QZUPNCKPIYQMCR-SFHVURJKSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554323 1007884634 /nfs/dbraw/zinc/88/46/34/1007884634.db2.gz QZUPNCKPIYQMCR-SFHVURJKSA-N 2 1 371.481 2.901 20 10 FFCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249905 1008914585 /nfs/dbraw/zinc/91/45/85/1008914585.db2.gz WJJXAMLBSFWWLD-OAQYLSRUSA-N 3 1 358.574 2.896 20 10 FFCDMP CC(C)C[N@@H+]1CCC[C@H](CNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249905 1008914597 /nfs/dbraw/zinc/91/45/97/1008914597.db2.gz WJJXAMLBSFWWLD-OAQYLSRUSA-N 2 1 358.574 2.896 20 10 FFCDMP CC(C)C[N@H+]1CCC[C@H](CNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249905 1008914609 /nfs/dbraw/zinc/91/46/09/1008914609.db2.gz WJJXAMLBSFWWLD-OAQYLSRUSA-N 2 1 358.574 2.896 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000809750457 1013019191 /nfs/dbraw/zinc/01/91/91/1013019191.db2.gz XCKGYUJEONFFLH-LJQANCHMSA-N 2 1 373.541 2.992 20 10 FFCDMP CCn1cnc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1 ZINC000902445515 1020208553 /nfs/dbraw/zinc/20/85/53/1020208553.db2.gz MJKDLPYAFQMQPH-UHFFFAOYSA-N 2 1 353.514 2.725 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000756482919 1023717727 /nfs/dbraw/zinc/71/77/27/1023717727.db2.gz LBCUWBLPVZYGKL-OAGGEKHMSA-N 2 1 364.486 2.719 20 10 FFCDMP CO[C@]1(C(F)(F)F)CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000783718265 1030249569 /nfs/dbraw/zinc/24/95/69/1030249569.db2.gz PUPMHLUVUUBLPL-GOSISDBHSA-N 2 1 371.447 2.982 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)cc1 ZINC001203931999 1030991472 /nfs/dbraw/zinc/99/14/72/1030991472.db2.gz NQGRIDGLWQOGNK-UHFFFAOYSA-N 2 1 353.514 2.603 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCC[NH3+])Cc3ccccc3)cc2)CC1 ZINC000843107832 1031187687 /nfs/dbraw/zinc/18/76/87/1031187687.db2.gz JNXPPHYXCJINIC-UHFFFAOYSA-N 3 1 352.526 2.789 20 10 FFCDMP CN(C)c1ccc(/C=C/c2ccc(NC(=O)C[NH2+]CCC[NH3+])cc2)cc1 ZINC001219203881 1033553206 /nfs/dbraw/zinc/55/32/06/1033553206.db2.gz PMIHSORJZQFYNT-SNAWJCMRSA-N 2 1 352.482 2.800 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)[C@@H]1C ZINC001139258893 1035031236 /nfs/dbraw/zinc/03/12/36/1035031236.db2.gz ZUUASZBMNZVVBK-PBHICJAKSA-N 2 1 364.486 2.626 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](O)[C@@H]3Cc3ccccc3)cc2)CC1 ZINC001139407525 1035093057 /nfs/dbraw/zinc/09/30/57/1035093057.db2.gz FVRIYUNDGRFAIX-XZOQPEGZSA-N 2 1 365.521 2.616 20 10 FFCDMP CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304699 1035426159 /nfs/dbraw/zinc/42/61/59/1035426159.db2.gz YRTYEKIYEYYJMR-FQEVSTJZSA-N 2 1 359.514 2.746 20 10 FFCDMP CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304699 1035426160 /nfs/dbraw/zinc/42/61/60/1035426160.db2.gz YRTYEKIYEYYJMR-FQEVSTJZSA-N 2 1 359.514 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](c4ccncc4)C3)cc2)CC1 ZINC001140306432 1035428296 /nfs/dbraw/zinc/42/82/96/1035428296.db2.gz RVHWKOBYWCZBGA-JOCHJYFZSA-N 2 1 366.509 2.797 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](c4ccncc4)C3)cc2)CC1 ZINC001140306432 1035428299 /nfs/dbraw/zinc/42/82/99/1035428299.db2.gz RVHWKOBYWCZBGA-JOCHJYFZSA-N 2 1 366.509 2.797 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCN(C)CC34CCCC4)cc2)CC1 ZINC001140309292 1035429738 /nfs/dbraw/zinc/42/97/38/1035429738.db2.gz AHIIEEKAQZUZFF-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CC[N@H+](C)CC34CCCC4)cc2)CC1 ZINC001140309292 1035429741 /nfs/dbraw/zinc/42/97/41/1035429741.db2.gz AHIIEEKAQZUZFF-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CC[N@@H+](C)CC34CCCC4)cc2)CC1 ZINC001140309292 1035429742 /nfs/dbraw/zinc/42/97/42/1035429742.db2.gz AHIIEEKAQZUZFF-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP CN(C)c1ccc(/C=C\CN2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028821 1035489869 /nfs/dbraw/zinc/48/98/69/1035489869.db2.gz SRTFUQUTRSVFCS-DYRFGFBLSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH+]2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028821 1035489872 /nfs/dbraw/zinc/48/98/72/1035489872.db2.gz SRTFUQUTRSVFCS-DYRFGFBLSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C\C[NH+]2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028821 1035489877 /nfs/dbraw/zinc/48/98/77/1035489877.db2.gz SRTFUQUTRSVFCS-DYRFGFBLSA-N 2 1 356.558 2.868 20 10 FFCDMP COC(=O)c1c(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c2ccccc2n1C ZINC001232401030 1035652424 /nfs/dbraw/zinc/65/24/24/1035652424.db2.gz DLFJJZIFMBJVIV-UHFFFAOYSA-N 2 1 364.449 2.682 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001235693084 1037688171 /nfs/dbraw/zinc/68/81/71/1037688171.db2.gz RCLOVJLMUISFOI-NRFANRHFSA-N 2 1 367.493 2.845 20 10 FFCDMP COC(=O)[C@H]([NH3+])C1CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001236068544 1037913031 /nfs/dbraw/zinc/91/30/31/1037913031.db2.gz VHAXFPWHJYHHFC-HXUWFJFHSA-N 2 1 355.482 2.806 20 10 FFCDMP Cc1cccnc1O[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001236535599 1038122878 /nfs/dbraw/zinc/12/28/78/1038122878.db2.gz IMUZUSQDPQUGFF-GOSISDBHSA-N 2 1 369.465 2.621 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4ccncc4)C3)c(F)c2)CC1 ZINC001236942637 1038371140 /nfs/dbraw/zinc/37/11/40/1038371140.db2.gz LEMVPLMHCJHDGF-FQEVSTJZSA-N 2 1 370.472 2.626 20 10 FFCDMP Cc1cc(C[NH+]2CC3(C2)CC[NH+](Cc2cc(C)ccc2O)CC3)n(C)n1 ZINC001278616959 1038843080 /nfs/dbraw/zinc/84/30/80/1038843080.db2.gz LOCGRMYWZSMJJB-UHFFFAOYSA-N 2 1 354.498 2.841 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@H]3CC[NH2+]C4(CCCCC4)C3)cc2)CC1 ZINC001246184745 1039268964 /nfs/dbraw/zinc/26/89/64/1039268964.db2.gz PBUFJABHTXCAAZ-FQEVSTJZSA-N 2 1 356.558 2.983 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCC34CCOCC4)cc2F)CC1 ZINC001261851477 1041447170 /nfs/dbraw/zinc/44/71/70/1041447170.db2.gz VNLBGNUAMHNWFH-GOSISDBHSA-N 2 1 361.505 2.874 20 10 FFCDMP Oc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279197419 1042941732 /nfs/dbraw/zinc/94/17/32/1042941732.db2.gz VHGQOZWWRHIQTD-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1C[C@@H]2CC[N@@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279197419 1042941737 /nfs/dbraw/zinc/94/17/37/1042941737.db2.gz VHGQOZWWRHIQTD-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1C[C@@H]2CC[N@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279197419 1042941741 /nfs/dbraw/zinc/94/17/41/1042941741.db2.gz VHGQOZWWRHIQTD-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP c1ccc(COc2ccc(N3CC[NH+](C[C@@H]4CC[NH2+]C4)CC3)cc2)cc1 ZINC001237250734 1043075616 /nfs/dbraw/zinc/07/56/16/1043075616.db2.gz XGFZILVSJRKYDB-HXUWFJFHSA-N 2 1 351.494 2.997 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(N(CC)CC)cc2)CCC12C[NH2+]C2 ZINC001237413379 1043149170 /nfs/dbraw/zinc/14/91/70/1043149170.db2.gz WVSKBRZHZYZTDT-IBGZPJMESA-N 2 1 359.514 2.507 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(OCC4CC4)CC3)cc2F)CC1 ZINC001319716321 1045248801 /nfs/dbraw/zinc/24/88/01/1045248801.db2.gz GLHWGPYNJGYZRZ-UHFFFAOYSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCN3C3CCCC3)cc2F)CC1 ZINC001328699349 1048426001 /nfs/dbraw/zinc/42/60/01/1048426001.db2.gz HCNPUGAXBQGTCV-IBGZPJMESA-N 2 1 360.521 2.684 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)cc2F)CC1 ZINC001330532984 1049193386 /nfs/dbraw/zinc/19/33/86/1049193386.db2.gz JFDZGGNLYZHSKK-DSKINZAPSA-N 2 1 361.505 2.703 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)cc2F)CC1 ZINC001330532984 1049193391 /nfs/dbraw/zinc/19/33/91/1049193391.db2.gz JFDZGGNLYZHSKK-DSKINZAPSA-N 2 1 361.505 2.703 20 10 FFCDMP Cc1nc2ccccn2c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001335133896 1053228431 /nfs/dbraw/zinc/22/84/31/1053228431.db2.gz LROSCMWDZZFFAI-UHFFFAOYSA-N 2 1 367.472 2.823 20 10 FFCDMP C[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001472281311 1064998492 /nfs/dbraw/zinc/99/84/92/1064998492.db2.gz VBFIUUQCQZBJNV-YZLZLFLDSA-N 2 1 360.546 2.733 20 10 FFCDMP CCOc1ccc(O)c(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1 ZINC000377701160 512407669 /nfs/dbraw/zinc/40/76/69/512407669.db2.gz SBXMCCCPJXKGIY-DFNIBXOVSA-N 2 1 359.514 2.534 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCCN2CCC[N@@H+](C)CC2)cc1F ZINC000152190764 728749506 /nfs/dbraw/zinc/74/95/06/728749506.db2.gz ORFVVDNOHJUDGB-UHFFFAOYSA-N 2 1 350.526 2.789 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)c1 ZINC000781634781 738643421 /nfs/dbraw/zinc/64/34/21/738643421.db2.gz GGYKWJWTDPHIAN-UHFFFAOYSA-N 2 1 371.319 2.788 20 10 FFCDMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000761203849 736707455 /nfs/dbraw/zinc/70/74/55/736707455.db2.gz MSXZCJSRBRHNGH-MRXNPFEDSA-N 2 1 356.894 2.987 20 10 FFCDMP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000841099532 747268976 /nfs/dbraw/zinc/26/89/76/747268976.db2.gz LGIWARDQFRQSGB-RDJZCZTQSA-N 2 1 369.303 2.873 20 10 FFCDMP CCCNc1nc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]cc1C ZINC001167422939 963011104 /nfs/dbraw/zinc/01/11/04/963011104.db2.gz HRXAEHKMMCIJHS-UHFFFAOYSA-N 2 1 354.502 2.971 20 10 FFCDMP COc1cc2[nH+]ccn2cc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167436980 963270574 /nfs/dbraw/zinc/27/05/74/963270574.db2.gz JTOQQSPXZHZAPN-UHFFFAOYSA-N 2 1 351.454 2.707 20 10 FFCDMP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c(O)c1OC ZINC000892452436 968848456 /nfs/dbraw/zinc/84/84/56/968848456.db2.gz NTCBIUKHUQXXBN-UHFFFAOYSA-N 2 1 372.465 2.531 20 10 FFCDMP Cc1cccc(O)c1C[NH2+]Cc1cccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000877028190 1014453952 /nfs/dbraw/zinc/45/39/52/1014453952.db2.gz VRSDFDXLNATYLN-LJQANCHMSA-N 2 1 367.493 2.688 20 10 FFCDMP COc1cccc(C[N@@H+](C)CCN2CCN(Cc3ccccc3)CC2)c1O ZINC000809693740 994571309 /nfs/dbraw/zinc/57/13/09/994571309.db2.gz AKZRCBIQPXIOHA-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP COc1cccc(C[N@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000809693740 994571323 /nfs/dbraw/zinc/57/13/23/994571323.db2.gz AKZRCBIQPXIOHA-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP COc1cccc(C[N@@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000809693740 994571337 /nfs/dbraw/zinc/57/13/37/994571337.db2.gz AKZRCBIQPXIOHA-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP COc1ccc2ccc(O)c(C[NH+]3CCN([C@H]4CCC[N@@H+](C)C4)CC3)c2c1 ZINC000738215047 999622570 /nfs/dbraw/zinc/62/25/70/999622570.db2.gz RRFYQHNMSKAFPP-SFHVURJKSA-N 2 1 369.509 2.766 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850357366 1005810764 /nfs/dbraw/zinc/81/07/64/1005810764.db2.gz HDEGZZWSKRHNIU-IBGZPJMESA-N 2 1 356.466 2.647 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000850508379 1005819278 /nfs/dbraw/zinc/81/92/78/1005819278.db2.gz MDKVNYWUFAYXMF-CRAIPNDOSA-N 2 1 356.466 2.818 20 10 FFCDMP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883085424 1006635899 /nfs/dbraw/zinc/63/58/99/1006635899.db2.gz QSWDVFQSIKIGCX-SFHVURJKSA-N 2 1 362.420 2.917 20 10 FFCDMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883085424 1006635905 /nfs/dbraw/zinc/63/59/05/1006635905.db2.gz QSWDVFQSIKIGCX-SFHVURJKSA-N 2 1 362.420 2.917 20 10 FFCDMP COc1ccc(N2CCN(CC[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)CC2)cc1 ZINC000817894943 1007801838 /nfs/dbraw/zinc/80/18/38/1007801838.db2.gz PJNFEJFEUHLDKL-FCHUYYIVSA-N 2 1 366.509 2.552 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)c1O ZINC001205545676 1007848418 /nfs/dbraw/zinc/84/84/18/1007848418.db2.gz LQFZEWAFYIZYIK-OAHLLOKOSA-N 2 1 361.255 2.816 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554321 1007884533 /nfs/dbraw/zinc/88/45/33/1007884533.db2.gz QZUPNCKPIYQMCR-GOSISDBHSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554321 1007884538 /nfs/dbraw/zinc/88/45/38/1007884538.db2.gz QZUPNCKPIYQMCR-GOSISDBHSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](Cc3c(O)cccc3OC)C2)ccn1 ZINC000856554321 1007884543 /nfs/dbraw/zinc/88/45/43/1007884543.db2.gz QZUPNCKPIYQMCR-GOSISDBHSA-N 2 1 371.481 2.901 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@](C)(O)c1ccccc1 ZINC000822517347 1008664594 /nfs/dbraw/zinc/66/45/94/1008664594.db2.gz WHYSRIVUGQEYPV-QFIPXVFZSA-N 2 1 353.510 2.778 20 10 FFCDMP C[C@@H](COCC(F)(F)F)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177707084 1008721674 /nfs/dbraw/zinc/72/16/74/1008721674.db2.gz GEQMLSDOADBQMN-ZDUSSCGKSA-N 2 1 363.399 2.635 20 10 FFCDMP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1c(O)cccc1F ZINC000886536685 1008723494 /nfs/dbraw/zinc/72/34/94/1008723494.db2.gz NAXDVBPZZHNSGD-AWEZNQCLSA-N 2 1 365.493 2.809 20 10 FFCDMP CC[NH+](CC)CC[C@@H](CO)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001179067711 1009247423 /nfs/dbraw/zinc/24/74/23/1009247423.db2.gz VXOYHMLUKWQTNE-INIZCTEOSA-N 2 1 352.519 2.881 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@H+]1C ZINC000773145614 1009668840 /nfs/dbraw/zinc/66/88/40/1009668840.db2.gz KELGADJYXUYIDH-WIYYLYMNSA-N 3 1 356.558 2.791 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCN1C ZINC000773145614 1009668846 /nfs/dbraw/zinc/66/88/46/1009668846.db2.gz KELGADJYXUYIDH-WIYYLYMNSA-N 2 1 356.558 2.791 20 10 FFCDMP CCOC(=O)c1c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222148067 1032788841 /nfs/dbraw/zinc/78/88/41/1032788841.db2.gz IXGNANNUKMZFMX-NRFANRHFSA-N 2 1 355.482 2.931 20 10 FFCDMP CCOC(=O)c1c(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222148067 1032788882 /nfs/dbraw/zinc/78/88/82/1032788882.db2.gz IXGNANNUKMZFMX-NRFANRHFSA-N 2 1 355.482 2.931 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCCC[NH2+]4)CC3)cc2)CC1 ZINC001222292710 1032872881 /nfs/dbraw/zinc/87/28/81/1032872881.db2.gz JALHXDWUMYQYJB-UHFFFAOYSA-N 3 1 356.558 2.937 20 10 FFCDMP CC(C)C[N@H+](CCN(C)C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117592705 1021769813 /nfs/dbraw/zinc/76/98/13/1021769813.db2.gz XDFFTPJDIPXQQP-UHFFFAOYSA-N 2 1 350.526 2.597 20 10 FFCDMP CC(C)C[N@@H+](CCN(C)C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117592705 1021769827 /nfs/dbraw/zinc/76/98/27/1021769827.db2.gz XDFFTPJDIPXQQP-UHFFFAOYSA-N 2 1 350.526 2.597 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3c[nH+]ccc3-n3cccn3)cc2F)CC1 ZINC001117627167 1021785122 /nfs/dbraw/zinc/78/51/22/1021785122.db2.gz RXIPNIRTPHOMPK-UHFFFAOYSA-N 2 1 366.444 2.770 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]2C1 ZINC001120070879 1023229068 /nfs/dbraw/zinc/22/90/68/1023229068.db2.gz CPVQVNSJMPUQAL-TUNNFDKTSA-N 3 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@@H]([NH+](C)C)C[C@@H]4C3)cc2)CC1 ZINC001120070879 1023229076 /nfs/dbraw/zinc/22/90/76/1023229076.db2.gz CPVQVNSJMPUQAL-TUNNFDKTSA-N 2 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@@H]([NH+](C)C)C[C@@H]4C3)cc2)CC1 ZINC001120070879 1023229085 /nfs/dbraw/zinc/22/90/85/1023229085.db2.gz CPVQVNSJMPUQAL-TUNNFDKTSA-N 2 1 356.558 2.601 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)cc1 ZINC001203933782 1030992108 /nfs/dbraw/zinc/99/21/08/1030992108.db2.gz QLIJVFBVAHBEIQ-UHFFFAOYSA-N 2 1 367.541 2.993 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCC[C@@H](C[NH2+]C)C2)c(O)c1 ZINC001205016905 1031487155 /nfs/dbraw/zinc/48/71/55/1031487155.db2.gz LNBJXPBRAUYBOA-INIZCTEOSA-N 2 1 364.486 2.546 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205635929 1031893956 /nfs/dbraw/zinc/89/39/56/1031893956.db2.gz BGNCFBUENKCFOY-RDJZCZTQSA-N 2 1 351.922 2.983 20 10 FFCDMP Nc1ccc(N(C(=O)C[NH2+]CCC[NH3+])c2ccc3ccccc3c2N)cc1 ZINC001219473487 1033660734 /nfs/dbraw/zinc/66/07/34/1033660734.db2.gz BOCAXAVXDMMHLT-UHFFFAOYSA-N 2 1 363.465 2.607 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3ncccc3C)C2)cc(C[NH+](C)C)c1O ZINC001139259970 1035031621 /nfs/dbraw/zinc/03/16/21/1035031621.db2.gz GCQCFGGGLNJCMB-SFHVURJKSA-N 2 1 371.481 2.819 20 10 FFCDMP CCCCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411704 1035095204 /nfs/dbraw/zinc/09/52/04/1035095204.db2.gz ZNUJEZROZLHEOH-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP Cc1cc(C[N@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)ccc1N(C)C ZINC001139671367 1035194249 /nfs/dbraw/zinc/19/42/49/1035194249.db2.gz JYJUIRZFXQAGIJ-NHCUHLMSSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[N@@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)ccc1N(C)C ZINC001139671367 1035194253 /nfs/dbraw/zinc/19/42/53/1035194253.db2.gz JYJUIRZFXQAGIJ-NHCUHLMSSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[NH+]2C[C@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)ccc1N(C)C ZINC001139671367 1035194255 /nfs/dbraw/zinc/19/42/55/1035194255.db2.gz JYJUIRZFXQAGIJ-NHCUHLMSSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[NH+]2C[C@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)ccc1N(C)C ZINC001139671367 1035194261 /nfs/dbraw/zinc/19/42/61/1035194261.db2.gz JYJUIRZFXQAGIJ-NHCUHLMSSA-N 2 1 367.541 2.748 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4cccnc4)C3)cc2)CC1 ZINC001140304533 1035426092 /nfs/dbraw/zinc/42/60/92/1035426092.db2.gz TXDDROLEKUJVKO-QFIPXVFZSA-N 2 1 366.509 2.877 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@@H+](Cc1ccc(C)cc1O)CCC2 ZINC001140949598 1036546539 /nfs/dbraw/zinc/54/65/39/1036546539.db2.gz FMNGTDNKISXZCV-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@H+](Cc1ccc(C)cc1O)CCC2 ZINC001140949598 1036546550 /nfs/dbraw/zinc/54/65/50/1036546550.db2.gz FMNGTDNKISXZCV-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076710 1036926558 /nfs/dbraw/zinc/92/65/58/1036926558.db2.gz JEPPGTLKYBHGFU-FCHUYYIVSA-N 2 1 368.569 2.596 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235236202 1037427031 /nfs/dbraw/zinc/42/70/31/1037427031.db2.gz CSQUGXBTDNWLCA-JOCHJYFZSA-N 2 1 374.548 2.932 20 10 FFCDMP COc1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c(OC)c1 ZINC001235947970 1037850180 /nfs/dbraw/zinc/85/01/80/1037850180.db2.gz ITMPIYDMYGLSOA-UHFFFAOYSA-N 2 1 355.482 2.745 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3ccc(N(CC)CC)cc3)C[C@H]1C[NH2+]CC2 ZINC001236038545 1037900795 /nfs/dbraw/zinc/90/07/95/1037900795.db2.gz QSMIYRPHACCIFZ-WIYYLYMNSA-N 2 1 359.514 2.507 20 10 FFCDMP [NH3+]C1CN([C@H]2CCC[N@@H+](Cc3cc(OCc4ccccc4)ccc3O)C2)C1 ZINC001236079938 1037924018 /nfs/dbraw/zinc/92/40/18/1037924018.db2.gz ULTIGUUDVBIRAJ-FQEVSTJZSA-N 2 1 367.493 2.579 20 10 FFCDMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236180851 1037968409 /nfs/dbraw/zinc/96/84/09/1037968409.db2.gz ARKBHLXDASXVEX-UHFFFAOYSA-N 2 1 361.493 2.914 20 10 FFCDMP Cc1cccc(O[C@@H]2CCC[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)n1 ZINC001236849327 1038307123 /nfs/dbraw/zinc/30/71/23/1038307123.db2.gz VRNZSYYBEVZITF-GOSISDBHSA-N 2 1 369.465 2.621 20 10 FFCDMP CC(C)[N@@H+](CCCCCO)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236945687 1038372425 /nfs/dbraw/zinc/37/24/25/1038372425.db2.gz LVJBIVLKOBNFGB-UHFFFAOYSA-N 2 1 351.510 2.951 20 10 FFCDMP c1ccc(C[C@H]2C[C@@H](NCc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173840 1039267092 /nfs/dbraw/zinc/26/70/92/1039267092.db2.gz MZGDPLDZJJLQDU-VXKWHMMOSA-N 2 1 364.537 2.549 20 10 FFCDMP Oc1cccc2c1C[N@@H+](CC1(O)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001254040154 1040541596 /nfs/dbraw/zinc/54/15/96/1040541596.db2.gz QJTRKGBWTMRWSQ-UHFFFAOYSA-N 2 1 352.478 2.777 20 10 FFCDMP Oc1cc(O)c(CC[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255387999 1041314600 /nfs/dbraw/zinc/31/46/00/1041314600.db2.gz XCOVWESMVWOLNN-GOSISDBHSA-N 2 1 356.466 2.990 20 10 FFCDMP C[NH+](C)CCN1CCC[C@@]2(CCC[N@H+](Cc3c(O)ccc(F)c3F)C2)C1 ZINC001279490988 1043178383 /nfs/dbraw/zinc/17/83/83/1043178383.db2.gz SNHGZVDAEOQYJR-HXUWFJFHSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+](C)CCN1CCC[C@@]2(CCC[N@@H+](Cc3c(O)ccc(F)c3F)C2)C1 ZINC001279490988 1043178388 /nfs/dbraw/zinc/17/83/88/1043178388.db2.gz SNHGZVDAEOQYJR-HXUWFJFHSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001279515117 1043211147 /nfs/dbraw/zinc/21/11/47/1043211147.db2.gz YIQKASBRYRUTHN-HOTGVXAUSA-N 2 1 357.420 2.621 20 10 FFCDMP COc1cc(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)cc(C[NH+](C)C)c1O ZINC001279698870 1043489969 /nfs/dbraw/zinc/48/99/69/1043489969.db2.gz QZUSDRFZUQHOAQ-UHFFFAOYSA-N 3 1 361.530 2.770 20 10 FFCDMP COc1cc(CN2CCC3(CCC[N@H+](C)C3)CC2)cc(C[NH+](C)C)c1O ZINC001279698870 1043489977 /nfs/dbraw/zinc/48/99/77/1043489977.db2.gz QZUSDRFZUQHOAQ-UHFFFAOYSA-N 2 1 361.530 2.770 20 10 FFCDMP COc1cc(CN2CCC3(CCC[N@@H+](C)C3)CC2)cc(C[NH+](C)C)c1O ZINC001279698870 1043489982 /nfs/dbraw/zinc/48/99/82/1043489982.db2.gz QZUSDRFZUQHOAQ-UHFFFAOYSA-N 2 1 361.530 2.770 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCOC4)CC3)cc2F)CC1 ZINC001320967416 1045503795 /nfs/dbraw/zinc/50/37/95/1045503795.db2.gz GPCPMQUSCGMXSL-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)cc2F)CC1 ZINC001324822273 1046243251 /nfs/dbraw/zinc/24/32/51/1046243251.db2.gz IDJXKSFYNMXTRW-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)cc2F)CC1 ZINC001324822273 1046243263 /nfs/dbraw/zinc/24/32/63/1046243263.db2.gz IDJXKSFYNMXTRW-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[C@@H](CCO)C1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CCC1 ZINC001337273984 1054614987 /nfs/dbraw/zinc/61/49/87/1054614987.db2.gz FCJXMNFJDWVTDU-KRWDZBQOSA-N 2 1 363.521 2.856 20 10 FFCDMP CCc1cccc(C[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c1O ZINC000848893402 1055314951 /nfs/dbraw/zinc/31/49/51/1055314951.db2.gz WBVLSLLUGCZBEM-UHFFFAOYSA-N 2 1 367.493 2.632 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCCNc3ccccn3)cc2F)CC1 ZINC001461260083 1061269331 /nfs/dbraw/zinc/26/93/31/1061269331.db2.gz FBJRRNZSIUVUSW-UHFFFAOYSA-N 2 1 357.477 2.564 20 10 FFCDMP CC(C)[C@@H](O)C(C)(C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001461418592 1061314794 /nfs/dbraw/zinc/31/47/94/1061314794.db2.gz XWWZIQHKPKBMFE-LJQANCHMSA-N 2 1 351.510 2.710 20 10 FFCDMP COc1cc(C)c(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c(O)c1 ZINC001474333611 1065496056 /nfs/dbraw/zinc/49/60/56/1065496056.db2.gz QZSWPYVAIUEZFV-HDICACEKSA-N 2 1 361.530 2.700 20 10 FFCDMP CCC[NH2+][C@@H](C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551311 1078375738 /nfs/dbraw/zinc/37/57/38/1078375738.db2.gz OSIAMALYUUOUDH-XJKSGUPXSA-N 2 1 353.894 2.514 20 10 FFCDMP [NH3+][C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001580368792 1078792759 /nfs/dbraw/zinc/79/27/59/1078792759.db2.gz PKWWRENSEVZWMC-IXDOHACOSA-N 2 1 365.905 2.644 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c(O)c1 ZINC001560751246 1076295973 /nfs/dbraw/zinc/29/59/73/1076295973.db2.gz QIZBKAMYTXKAFP-SFHVURJKSA-N 2 1 356.466 2.566 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1 ZINC000186520159 509751686 /nfs/dbraw/zinc/75/16/86/509751686.db2.gz JQGLKJOTEGXQKO-QAPCUYQASA-N 2 1 356.466 2.818 20 10 FFCDMP C[N@@H+](CCOCC[NH3+])Cc1ccc(N2CCCCC2)c(Br)c1 ZINC000863652820 730799245 /nfs/dbraw/zinc/79/92/45/730799245.db2.gz VMRPSGLJQMPITH-UHFFFAOYSA-N 2 1 370.335 2.847 20 10 FFCDMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H](C)C1 ZINC000839144710 746787588 /nfs/dbraw/zinc/78/75/88/746787588.db2.gz JRKPGYMCMFAHKT-RDTXWAMCSA-N 2 1 353.457 2.621 20 10 FFCDMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H](C)C1 ZINC000839144710 746787592 /nfs/dbraw/zinc/78/75/92/746787592.db2.gz JRKPGYMCMFAHKT-RDTXWAMCSA-N 2 1 353.457 2.621 20 10 FFCDMP C[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728585 983998806 /nfs/dbraw/zinc/99/88/06/983998806.db2.gz MVRNXXBHSGEHLT-HKUYNNGSSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185728585 983998810 /nfs/dbraw/zinc/99/88/10/983998810.db2.gz MVRNXXBHSGEHLT-HKUYNNGSSA-N 2 1 372.557 2.611 20 10 FFCDMP C[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185728585 983998815 /nfs/dbraw/zinc/99/88/15/983998815.db2.gz MVRNXXBHSGEHLT-HKUYNNGSSA-N 2 1 372.557 2.611 20 10 FFCDMP CCOc1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c(O)c1 ZINC000809751622 994604482 /nfs/dbraw/zinc/60/44/82/994604482.db2.gz ULHUGLKVRFFPSX-DFNIBXOVSA-N 2 1 359.514 2.534 20 10 FFCDMP CC[C@@H]1[C@@H](C(=O)N2C[C@@H](C)[C@H]([NH2+]Cc3ccc(OC)c(C)c3)C2)CC[N@H+]1C ZINC001082522342 994815388 /nfs/dbraw/zinc/81/53/88/994815388.db2.gz BVQDIHXNEOZPTQ-GSEOLPGOSA-N 2 1 373.541 2.670 20 10 FFCDMP C[C@@H]1C[N@H+](Cc2cccc(I)c2O)CCC[C@@H]1C[NH3+] ZINC001206028307 1000501705 /nfs/dbraw/zinc/50/17/05/1000501705.db2.gz YBFHTXPVXJIAAD-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2cccc(I)c2O)CCC[C@@H]1C[NH3+] ZINC001206028307 1000501709 /nfs/dbraw/zinc/50/17/09/1000501709.db2.gz YBFHTXPVXJIAAD-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1nnc2n1CCCCC2 ZINC000771822069 1001220003 /nfs/dbraw/zinc/22/00/03/1001220003.db2.gz DAJIFBKFTQSNSL-QGZVFWFLSA-N 2 1 368.529 2.607 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C2(CCCCC2)C1 ZINC000775735546 1003893645 /nfs/dbraw/zinc/89/36/45/1003893645.db2.gz RUBIQMUPYARTLA-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[N@H+](C)CC34CCCCC4)cc2)CC1 ZINC000775735546 1003893657 /nfs/dbraw/zinc/89/36/57/1003893657.db2.gz RUBIQMUPYARTLA-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[N@@H+](C)CC34CCCCC4)cc2)CC1 ZINC000775735546 1003893671 /nfs/dbraw/zinc/89/36/71/1003893671.db2.gz RUBIQMUPYARTLA-UHFFFAOYSA-N 2 1 356.558 2.889 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cc2)CC1 ZINC000775652207 1004948921 /nfs/dbraw/zinc/94/89/21/1004948921.db2.gz IHWZCDZHTMWLKK-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775660888 1004985425 /nfs/dbraw/zinc/98/54/25/1004985425.db2.gz ZYZWWPJSMWSBFN-LJQANCHMSA-N 2 1 353.514 2.552 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850508061 1005819118 /nfs/dbraw/zinc/81/91/18/1005819118.db2.gz KDGYCNHDYQUEST-MAUKXSAKSA-N 2 1 356.466 2.818 20 10 FFCDMP CCN(C)c1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1 ZINC000773787058 1009211579 /nfs/dbraw/zinc/21/15/79/1009211579.db2.gz FQPANPSVBCAAJB-CBQGHPETSA-N 2 1 356.558 2.886 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000773147595 1009747997 /nfs/dbraw/zinc/74/79/97/1009747997.db2.gz SZDVCTHQCDGANH-GMAHTHKFSA-N 3 1 368.569 2.935 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000773147595 1009748006 /nfs/dbraw/zinc/74/80/06/1009748006.db2.gz SZDVCTHQCDGANH-GMAHTHKFSA-N 2 1 368.569 2.935 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000773147595 1009748017 /nfs/dbraw/zinc/74/80/17/1009748017.db2.gz SZDVCTHQCDGANH-GMAHTHKFSA-N 2 1 368.569 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)cc2)CC1 ZINC000827851966 1018785739 /nfs/dbraw/zinc/78/57/39/1018785739.db2.gz VSMDDEGRBFXXER-SZPZYZBQSA-N 2 1 355.526 2.831 20 10 FFCDMP CCOC(=O)[C@H]1CC2(C[N@H+]1Cc1ccc3c(c1)CCCN3C)CC[NH2+]CC2 ZINC001222221568 1032832099 /nfs/dbraw/zinc/83/20/99/1032832099.db2.gz NZYWPWINGZCJTC-HXUWFJFHSA-N 2 1 371.525 2.576 20 10 FFCDMP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1O ZINC000756508333 1023720508 /nfs/dbraw/zinc/72/05/08/1023720508.db2.gz IMIMZSXYINCENY-MRXNPFEDSA-N 2 1 358.461 2.789 20 10 FFCDMP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(F)cc1O ZINC000756532850 1023723656 /nfs/dbraw/zinc/72/36/56/1023723656.db2.gz HEXUSARBWLGCFL-INIZCTEOSA-N 2 1 373.476 2.574 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548176 1023725529 /nfs/dbraw/zinc/72/55/29/1023725529.db2.gz JAXCOQHTKNZDCE-WBVHZDCISA-N 2 1 355.482 2.783 20 10 FFCDMP CCOc1cccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1O ZINC000092665202 1027395181 /nfs/dbraw/zinc/39/51/81/1027395181.db2.gz AVTDYCBWXMIEOZ-ROUUACIJSA-N 2 1 361.530 2.781 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CCC[NH2+]Cc3cccnc3)CC2)cc1 ZINC000841041457 1029995149 /nfs/dbraw/zinc/99/51/49/1029995149.db2.gz GNHFPIBZPDWOPG-UHFFFAOYSA-N 2 1 354.498 2.829 20 10 FFCDMP Oc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(O)c1 ZINC001204274630 1031202975 /nfs/dbraw/zinc/20/29/75/1031202975.db2.gz RGSXYFNQOXBKQO-UHFFFAOYSA-N 2 1 353.466 2.981 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](N4CCCCC4)C3)cc2)CC1 ZINC001140304096 1035426208 /nfs/dbraw/zinc/42/62/08/1035426208.db2.gz HXKPKZBDCXGWLV-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](N4CCCCC4)C3)cc2)CC1 ZINC001140304096 1035426211 /nfs/dbraw/zinc/42/62/11/1035426211.db2.gz HXKPKZBDCXGWLV-QFIPXVFZSA-N 2 1 356.558 2.889 20 10 FFCDMP CN(C)c1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC001232361681 1035623143 /nfs/dbraw/zinc/62/31/43/1035623143.db2.gz BGHLORMLWOHPKY-UHFFFAOYSA-N 2 1 353.514 2.531 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001140619868 1035743840 /nfs/dbraw/zinc/74/38/40/1035743840.db2.gz SLJBQDNEFKSTCJ-KRWDZBQOSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3cc(C)ccc3O)CC2)C1 ZINC001140619868 1035743853 /nfs/dbraw/zinc/74/38/53/1035743853.db2.gz SLJBQDNEFKSTCJ-KRWDZBQOSA-N 2 1 360.498 2.940 20 10 FFCDMP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCOC[C@@]4(CCC[NH2+]C4)C3)ccc2O1 ZINC001235017239 1037306689 /nfs/dbraw/zinc/30/66/89/1037306689.db2.gz WCOWUEDZIHTOAQ-OAQYLSRUSA-N 2 1 358.482 2.778 20 10 FFCDMP CC1(C)C=Cc2c(O)c(C[N@H+]3CCOC[C@@]4(CCC[NH2+]C4)C3)ccc2O1 ZINC001235017239 1037306702 /nfs/dbraw/zinc/30/67/02/1037306702.db2.gz WCOWUEDZIHTOAQ-OAQYLSRUSA-N 2 1 358.482 2.778 20 10 FFCDMP Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001235675147 1037677306 /nfs/dbraw/zinc/67/73/06/1037677306.db2.gz PGDFHDWRXLFQNA-HXUWFJFHSA-N 2 1 367.493 2.764 20 10 FFCDMP c1ccc(C[N@@H+]2CCC23CN(Cc2ccc(N4CC[NH2+]CC4)cc2)C3)cc1 ZINC001235808353 1037757881 /nfs/dbraw/zinc/75/78/81/1037757881.db2.gz BGFQCINALKWAEU-UHFFFAOYSA-N 2 1 362.521 2.557 20 10 FFCDMP c1ccc(CN2CCC23C[NH+](Cc2ccc(N4CC[NH2+]CC4)cc2)C3)cc1 ZINC001235808353 1037757918 /nfs/dbraw/zinc/75/79/18/1037757918.db2.gz BGFQCINALKWAEU-UHFFFAOYSA-N 2 1 362.521 2.557 20 10 FFCDMP COc1cccc(CCC[N@@H+](C)Cc2cc3c(cc2O)OCC[NH2+]C3)c1 ZINC001236042539 1037906701 /nfs/dbraw/zinc/90/67/01/1037906701.db2.gz PXASGEWKQCDVKO-UHFFFAOYSA-N 2 1 356.466 2.947 20 10 FFCDMP COc1cc(O)c(C[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)cc1OC ZINC001236752529 1038239148 /nfs/dbraw/zinc/23/91/48/1038239148.db2.gz XCTFYLUDNTYHAX-UHFFFAOYSA-N 2 1 357.454 2.852 20 10 FFCDMP CCC[N@@H+](Cc1ccc(I)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236841972 1038304262 /nfs/dbraw/zinc/30/42/62/1038304262.db2.gz BLTGZOAZOAIAKK-LBPRGKRZSA-N 2 1 374.266 2.818 20 10 FFCDMP CCC[N@H+](Cc1ccc(I)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236841972 1038304275 /nfs/dbraw/zinc/30/42/75/1038304275.db2.gz BLTGZOAZOAIAKK-LBPRGKRZSA-N 2 1 374.266 2.818 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4ccc[nH]4)C3)CC2)cc1O ZINC001279514532 1043209949 /nfs/dbraw/zinc/20/99/49/1043209949.db2.gz NETQGUIWNLRCDE-UHFFFAOYSA-N 2 1 357.454 2.620 20 10 FFCDMP COc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1O ZINC001324389653 1046000729 /nfs/dbraw/zinc/00/07/29/1046000729.db2.gz IRSCHKCQCZQJFI-UHFFFAOYSA-N 2 1 359.445 2.582 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4oc(=O)[nH]c4c3)cc2F)CC1 ZINC001332395227 1048376838 /nfs/dbraw/zinc/37/68/38/1048376838.db2.gz GEWWZAMOHBJXBG-UHFFFAOYSA-N 2 1 370.428 2.714 20 10 FFCDMP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)OC(C)(C)C ZINC001329940803 1048977806 /nfs/dbraw/zinc/97/78/06/1048977806.db2.gz MPCQPRHTVVAKBI-HNNXBMFYSA-N 2 1 365.493 2.645 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@](C)(O)c1ccccc1 ZINC001349568107 1055343883 /nfs/dbraw/zinc/34/38/83/1055343883.db2.gz FCEIPOMJQJLNCK-JTSKRJEESA-N 2 1 371.500 2.963 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CC3)[C@@H]3CCCOC3)cc2F)CC1 ZINC001355302707 1060092660 /nfs/dbraw/zinc/09/26/60/1060092660.db2.gz SRXUZCLSOJZXHH-WIYYLYMNSA-N 2 1 361.505 2.872 20 10 FFCDMP Cc1c(C[C@@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cnn1C ZINC001579529545 1078639939 /nfs/dbraw/zinc/63/99/39/1078639939.db2.gz KRHINDKWSWJHMP-IBGZPJMESA-N 2 1 355.530 2.578 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000375785956 512504609 /nfs/dbraw/zinc/50/46/09/512504609.db2.gz CPFQATZMWZXYSJ-FKBYEOEOSA-N 2 1 357.542 2.858 20 10 FFCDMP CC[NH+](CC)CCNC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000436462753 513860933 /nfs/dbraw/zinc/86/09/33/513860933.db2.gz GHNDJTDHEZAYTJ-UHFFFAOYSA-N 2 1 370.541 2.866 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH2+]C(C)(C)C)C1 ZINC000444802499 514337787 /nfs/dbraw/zinc/33/77/87/514337787.db2.gz OFVQIUWCUBQSEW-UHFFFAOYSA-N 2 1 370.541 2.912 20 10 FFCDMP CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263801 728729305 /nfs/dbraw/zinc/72/93/05/728729305.db2.gz FSLQNYCSAUXYQY-FUHWJXTLSA-N 2 1 367.921 2.712 20 10 FFCDMP CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263801 728729306 /nfs/dbraw/zinc/72/93/06/728729306.db2.gz FSLQNYCSAUXYQY-FUHWJXTLSA-N 2 1 367.921 2.712 20 10 FFCDMP CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263778 728729328 /nfs/dbraw/zinc/72/93/28/728729328.db2.gz FSLQNYCSAUXYQY-WMZOPIPTSA-N 2 1 367.921 2.712 20 10 FFCDMP CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263778 728729329 /nfs/dbraw/zinc/72/93/29/728729329.db2.gz FSLQNYCSAUXYQY-WMZOPIPTSA-N 2 1 367.921 2.712 20 10 FFCDMP COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903893088 736184109 /nfs/dbraw/zinc/18/41/09/736184109.db2.gz QDHRDYRCNDMVCB-SFESLNEESA-N 2 1 352.862 2.551 20 10 FFCDMP COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903893088 736184110 /nfs/dbraw/zinc/18/41/10/736184110.db2.gz QDHRDYRCNDMVCB-SFESLNEESA-N 2 1 352.862 2.551 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)c1 ZINC000769946439 737586171 /nfs/dbraw/zinc/58/61/71/737586171.db2.gz WTKLAZIIKPUQLT-AWEZNQCLSA-N 2 1 370.335 2.579 20 10 FFCDMP Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000809741492 741339135 /nfs/dbraw/zinc/33/91/35/741339135.db2.gz OXZDDLZAOQJKRA-GOSISDBHSA-N 2 1 351.922 2.954 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@H](C(F)(F)F)O1 ZINC000877824056 1014742583 /nfs/dbraw/zinc/74/25/83/1014742583.db2.gz ONVKVJNICKYFIE-QAPCUYQASA-N 2 1 371.447 2.980 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206027875 1032113819 /nfs/dbraw/zinc/11/38/19/1032113819.db2.gz WZRJOWQKLFFCQU-JKSUJKDBSA-N 2 1 351.922 2.983 20 10 FFCDMP O=C(CN1CC[NH2+]CC[NH2+]CC1)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000923462092 991161186 /nfs/dbraw/zinc/16/11/86/991161186.db2.gz CLPNBQBWRJYHJD-UHFFFAOYSA-N 2 1 366.469 2.535 20 10 FFCDMP Cc1c(C[C@H](C[NH3+])C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cnn1C ZINC000903884285 1016287237 /nfs/dbraw/zinc/28/72/37/1016287237.db2.gz WPRJLINZOJGLQG-LJQANCHMSA-N 2 1 357.546 2.823 20 10 FFCDMP CN(C)c1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC[NH2+]CC2)cc1 ZINC000903980339 1016355273 /nfs/dbraw/zinc/35/52/73/1016355273.db2.gz PCWAFILOYVTTBO-UFICKVLRSA-N 2 1 354.542 2.666 20 10 FFCDMP c1cc(N2CC[NH+](CC3CC3)CC2)ccc1CNC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000817916778 1007807994 /nfs/dbraw/zinc/80/79/94/1007807994.db2.gz JXIPPNCQVZIKPQ-WCRBZPEASA-N 2 1 354.542 2.591 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(N4CCCC4)cc3)C[C@@H]1C[NH2+]CCC2 ZINC001222125478 1032770342 /nfs/dbraw/zinc/77/03/42/1032770342.db2.gz NDXIGWMSQUPOGS-UGKGYDQZSA-N 2 1 371.525 2.652 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C(C)(C)C)[C@H](O)C3)cc2F)CC1 ZINC001116502387 1021249936 /nfs/dbraw/zinc/24/99/36/1021249936.db2.gz UVNYUMLBKKFQSY-FXAWDEMLSA-N 2 1 363.521 2.806 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C(C)(C)C)[C@H](O)C3)cc2F)CC1 ZINC001116502387 1021249938 /nfs/dbraw/zinc/24/99/38/1021249938.db2.gz UVNYUMLBKKFQSY-FXAWDEMLSA-N 2 1 363.521 2.806 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C(C)(C)C)[C@@H](O)C3)cc2F)CC1 ZINC001116502388 1021250810 /nfs/dbraw/zinc/25/08/10/1021250810.db2.gz UVNYUMLBKKFQSY-PXNSSMCTSA-N 2 1 363.521 2.806 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C(C)(C)C)[C@@H](O)C3)cc2F)CC1 ZINC001116502388 1021250823 /nfs/dbraw/zinc/25/08/23/1021250823.db2.gz UVNYUMLBKKFQSY-PXNSSMCTSA-N 2 1 363.521 2.806 20 10 FFCDMP CN(CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)Nc1ccc(N)cc1 ZINC000841300929 1030171031 /nfs/dbraw/zinc/17/10/31/1030171031.db2.gz XDPNVLMMGDYETC-UHFFFAOYSA-N 2 1 373.545 2.929 20 10 FFCDMP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCCCC2)cc1 ZINC001138219510 1033972458 /nfs/dbraw/zinc/97/24/58/1033972458.db2.gz FHHVNZIIYOHMQL-UHFFFAOYSA-N 2 1 361.530 2.994 20 10 FFCDMP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1ccc(N2CCCCC2)cc1 ZINC001138219510 1033972466 /nfs/dbraw/zinc/97/24/66/1033972466.db2.gz FHHVNZIIYOHMQL-UHFFFAOYSA-N 2 1 361.530 2.994 20 10 FFCDMP Cc1cnccc1O[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139411644 1035094657 /nfs/dbraw/zinc/09/46/57/1035094657.db2.gz WMRXPTVCUJPGKQ-NRFANRHFSA-N 2 1 366.509 2.795 20 10 FFCDMP CCOC(=O)C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001139411488 1035096013 /nfs/dbraw/zinc/09/60/13/1035096013.db2.gz ORZHUTCLVBGRTM-AZUAARDMSA-N 2 1 373.541 2.850 20 10 FFCDMP CN(C)c1ccc(/C=C/CN2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028825 1035489788 /nfs/dbraw/zinc/48/97/88/1035489788.db2.gz SRTFUQUTRSVFCS-WMWRJIBUSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH+]2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000835028825 1035489789 /nfs/dbraw/zinc/48/97/89/1035489789.db2.gz SRTFUQUTRSVFCS-WMWRJIBUSA-N 2 1 356.558 2.868 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH+]2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000835028825 1035489791 /nfs/dbraw/zinc/48/97/91/1035489791.db2.gz SRTFUQUTRSVFCS-WMWRJIBUSA-N 2 1 356.558 2.868 20 10 FFCDMP CCOC(=O)C1CC[NH+](C2CC[NH+](Cc3cc(C)ccc3O)CC2)CC1 ZINC001140619855 1035742277 /nfs/dbraw/zinc/74/22/77/1035742277.db2.gz RWWBFFBJPDPANK-UHFFFAOYSA-N 2 1 360.498 2.940 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001232838870 1036096069 /nfs/dbraw/zinc/09/60/69/1036096069.db2.gz NGECUDQHEHBTRB-QUCCMNQESA-N 2 1 366.509 2.807 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001232838870 1036096090 /nfs/dbraw/zinc/09/60/90/1036096090.db2.gz NGECUDQHEHBTRB-QUCCMNQESA-N 2 1 366.509 2.807 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@H]3CC[N@H+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001232838870 1036096104 /nfs/dbraw/zinc/09/61/04/1036096104.db2.gz NGECUDQHEHBTRB-QUCCMNQESA-N 2 1 366.509 2.807 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@H]3CC[N@@H+](Cc4ccncc4)C[C@H]3C2)c(O)c1 ZINC001232838870 1036096122 /nfs/dbraw/zinc/09/61/22/1036096122.db2.gz NGECUDQHEHBTRB-QUCCMNQESA-N 2 1 366.509 2.807 20 10 FFCDMP Cc1ccc(C[NH+]2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c(O)c1 ZINC001140950422 1036548086 /nfs/dbraw/zinc/54/80/86/1036548086.db2.gz SRGDANFVYJSQSN-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(C[NH+]2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)c(O)c1 ZINC001140950422 1036548101 /nfs/dbraw/zinc/54/81/01/1036548101.db2.gz SRGDANFVYJSQSN-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(C[N@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c(O)c1 ZINC001140950422 1036548113 /nfs/dbraw/zinc/54/81/13/1036548113.db2.gz SRGDANFVYJSQSN-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP Cc1ccc(C[N@@H+]2CCCn3c(=O)cc(C[NH+](C)C(C)C)nc3C2)c(O)c1 ZINC001140950422 1036548128 /nfs/dbraw/zinc/54/81/28/1036548128.db2.gz SRGDANFVYJSQSN-UHFFFAOYSA-N 2 1 370.497 2.503 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccc(OC(F)(F)F)c1O ZINC001233745651 1036742859 /nfs/dbraw/zinc/74/28/59/1036742859.db2.gz NLDUHNBRYXROCY-LSDHHAIUSA-N 2 1 373.419 2.501 20 10 FFCDMP COC(=O)[C@H]([NH3+])C1CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001236067800 1037911741 /nfs/dbraw/zinc/91/17/41/1037911741.db2.gz PYKVRYSBMQCPNH-HXUWFJFHSA-N 2 1 355.482 2.806 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236315653 1038040148 /nfs/dbraw/zinc/04/01/48/1038040148.db2.gz MDWKHJIPUIRUAS-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP CCOc1ccc(N2CC[NH+](C[C@H]3[C@@H](C)C[NH2+]CC3(F)F)CC2)cc1 ZINC001236433842 1038086985 /nfs/dbraw/zinc/08/69/85/1038086985.db2.gz MIEVKOVIJAWAIU-YJBOKZPZSA-N 2 1 353.457 2.698 20 10 FFCDMP Cc1ccnc(O[C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236532877 1038122412 /nfs/dbraw/zinc/12/24/12/1038122412.db2.gz FVUVHYUPXOWINW-NRFANRHFSA-N 2 1 366.509 2.843 20 10 FFCDMP c1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)N3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001237188488 1038471285 /nfs/dbraw/zinc/47/12/85/1038471285.db2.gz PHQYVVYRWUVNFT-ZRZAMGCNSA-N 2 1 362.521 2.555 20 10 FFCDMP c1ccc(CN2C[C@H]3C[C@@H](C2)[N@H+]3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001237188488 1038471291 /nfs/dbraw/zinc/47/12/91/1038471291.db2.gz PHQYVVYRWUVNFT-ZRZAMGCNSA-N 2 1 362.521 2.555 20 10 FFCDMP c1ccc(CN2C[C@H]3C[C@@H](C2)[N@@H+]3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001237188488 1038471294 /nfs/dbraw/zinc/47/12/94/1038471294.db2.gz PHQYVVYRWUVNFT-ZRZAMGCNSA-N 2 1 362.521 2.555 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256521037 1038541631 /nfs/dbraw/zinc/54/16/31/1038541631.db2.gz XNNOWYHZQMBZDO-FYINFDKHSA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256521037 1038541639 /nfs/dbraw/zinc/54/16/39/1038541639.db2.gz XNNOWYHZQMBZDO-FYINFDKHSA-N 2 1 356.466 2.774 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC(=O)N(CC[NH+](C)C)CC2)cc1 ZINC001209519674 1038948425 /nfs/dbraw/zinc/94/84/25/1038948425.db2.gz DPRPXTQTERKELQ-UHFFFAOYSA-N 2 1 368.525 2.690 20 10 FFCDMP Oc1cc(O)c(CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1O ZINC001258135256 1039213190 /nfs/dbraw/zinc/21/31/90/1039213190.db2.gz WTHCFZZVUWEWBU-UHFFFAOYSA-N 2 1 356.466 2.643 20 10 FFCDMP C[NH2+]CC[C@@H](C)[N@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700992 1039442228 /nfs/dbraw/zinc/44/22/28/1039442228.db2.gz HYRWZTYYOYSABC-NQIIRXRSSA-N 2 1 361.530 2.612 20 10 FFCDMP COCCOC[N@@H+]1CCC2(C1)CC[NH+](Cc1cc(Cl)ccc1O)CC2 ZINC001278569489 1041212677 /nfs/dbraw/zinc/21/26/77/1041212677.db2.gz YOCZFSZVKXXNRN-UHFFFAOYSA-N 2 1 368.905 2.954 20 10 FFCDMP COCCOC[N@H+]1CCC2(C1)CC[NH+](Cc1cc(Cl)ccc1O)CC2 ZINC001278569489 1041212691 /nfs/dbraw/zinc/21/26/91/1041212691.db2.gz YOCZFSZVKXXNRN-UHFFFAOYSA-N 2 1 368.905 2.954 20 10 FFCDMP CCOc1cccc(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001278578451 1041241795 /nfs/dbraw/zinc/24/17/95/1041241795.db2.gz RNGZSLQSMILFCK-OAQYLSRUSA-N 2 1 361.530 2.640 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)cc1 ZINC001279149198 1042920073 /nfs/dbraw/zinc/92/00/73/1042920073.db2.gz AVGBJXRWPKIHTI-JOCHJYFZSA-N 2 1 358.574 2.992 20 10 FFCDMP COCCOC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccc(N(C)C)cc1)CC2 ZINC001279149412 1042920311 /nfs/dbraw/zinc/92/03/11/1042920311.db2.gz GSROSNIAONLNNG-UHFFFAOYSA-N 2 1 361.530 2.661 20 10 FFCDMP COCCOC[N@H+]1CCC2(C1)CC[NH+](Cc1ccc(N(C)C)cc1)CC2 ZINC001279149412 1042920316 /nfs/dbraw/zinc/92/03/16/1042920316.db2.gz GSROSNIAONLNNG-UHFFFAOYSA-N 2 1 361.530 2.661 20 10 FFCDMP Cc1ccc(C[N@@H+](CCO)Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001320022062 1045329855 /nfs/dbraw/zinc/32/98/55/1045329855.db2.gz FICCLCXHFHAPTR-UHFFFAOYSA-N 2 1 371.500 2.880 20 10 FFCDMP Cc1ccc(C[N@H+](CCO)Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001320022062 1045329862 /nfs/dbraw/zinc/32/98/62/1045329862.db2.gz FICCLCXHFHAPTR-UHFFFAOYSA-N 2 1 371.500 2.880 20 10 FFCDMP Cc1ccccc1C[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001320607804 1045436235 /nfs/dbraw/zinc/43/62/35/1045436235.db2.gz JLKNZINPZYUMTE-FQEVSTJZSA-N 2 1 371.500 2.579 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202857 1046808369 /nfs/dbraw/zinc/80/83/69/1046808369.db2.gz WFSYWIFDXYJWBG-UXHICEINSA-N 2 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202857 1046808384 /nfs/dbraw/zinc/80/83/84/1046808384.db2.gz WFSYWIFDXYJWBG-UXHICEINSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2F)CC1 ZINC001326202857 1046808400 /nfs/dbraw/zinc/80/84/00/1046808400.db2.gz WFSYWIFDXYJWBG-UXHICEINSA-N 3 1 374.548 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CCC3)[C@@H]3CCOC3)cc2F)CC1 ZINC001331966694 1048190049 /nfs/dbraw/zinc/19/00/49/1048190049.db2.gz UCQXRRYOOWFPRB-NQIIRXRSSA-N 2 1 361.505 2.872 20 10 FFCDMP CN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)cc1F ZINC001308366438 1052450798 /nfs/dbraw/zinc/45/07/98/1052450798.db2.gz MNOPEGXKRSCVDM-LJQANCHMSA-N 2 1 357.473 2.748 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](O)Cc1ccccc1 ZINC001461363650 1061299468 /nfs/dbraw/zinc/29/94/68/1061299468.db2.gz JSQRHKHKHVNPNO-JTSKRJEESA-N 2 1 371.500 2.659 20 10 FFCDMP CN(C)c1ccc(CN(C)C(=O)C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1 ZINC000366910249 512245198 /nfs/dbraw/zinc/24/51/98/512245198.db2.gz HFOLHHGCHFNOSQ-UHFFFAOYSA-N 2 1 372.557 2.519 20 10 FFCDMP C[C@H]1C[N@H+](CCC[NH2+]Cc2cc(Br)ccc2O)CCCO1 ZINC000277711041 510970326 /nfs/dbraw/zinc/97/03/26/510970326.db2.gz IREOZYBIAHKKPC-ZDUSSCGKSA-N 2 1 357.292 2.745 20 10 FFCDMP C[C@H]1C[N@@H+](CCC[NH2+]Cc2cc(Br)ccc2O)CCCO1 ZINC000277711041 510970334 /nfs/dbraw/zinc/97/03/34/510970334.db2.gz IREOZYBIAHKKPC-ZDUSSCGKSA-N 2 1 357.292 2.745 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1O ZINC000371848259 512602087 /nfs/dbraw/zinc/60/20/87/512602087.db2.gz YNVKNMGWYUUFHV-BZUAXINKSA-N 2 1 354.878 2.738 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1O ZINC000371848259 512602091 /nfs/dbraw/zinc/60/20/91/512602091.db2.gz YNVKNMGWYUUFHV-BZUAXINKSA-N 2 1 354.878 2.738 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[NH+]2C)C1 ZINC000444236039 514164054 /nfs/dbraw/zinc/16/40/54/514164054.db2.gz KAZPNBIHPQSRLI-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[N@@H+]2C)C1 ZINC000444236039 514164060 /nfs/dbraw/zinc/16/40/60/514164060.db2.gz KAZPNBIHPQSRLI-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[N@H+]2C)C1 ZINC000444236039 514164064 /nfs/dbraw/zinc/16/40/64/514164064.db2.gz KAZPNBIHPQSRLI-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP C[NH+]1CCN([C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)c2cccs2)CC1 ZINC000917392886 737755597 /nfs/dbraw/zinc/75/55/97/737755597.db2.gz RTPPHCQVSMOYBE-SFHVURJKSA-N 2 1 357.523 2.761 20 10 FFCDMP COc1c([O-])c(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973668 738046384 /nfs/dbraw/zinc/04/63/84/738046384.db2.gz DCWPYCYJRCJKSO-CQSZACIVSA-N 2 1 351.447 2.911 20 10 FFCDMP COc1c(O)c(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973668 738046390 /nfs/dbraw/zinc/04/63/90/738046390.db2.gz DCWPYCYJRCJKSO-CQSZACIVSA-N 2 1 351.447 2.911 20 10 FFCDMP COc1c(O)c(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973668 738046395 /nfs/dbraw/zinc/04/63/95/738046395.db2.gz DCWPYCYJRCJKSO-CQSZACIVSA-N 2 1 351.447 2.911 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)c1 ZINC000810252265 741402012 /nfs/dbraw/zinc/40/20/12/741402012.db2.gz MVAKJMPLWBUNMP-CYBMUJFWSA-N 2 1 352.500 2.657 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817864732 742219256 /nfs/dbraw/zinc/21/92/56/742219256.db2.gz BAYDITDTRDBMIC-MDZLAQPJSA-N 2 1 357.292 2.969 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817864732 742219257 /nfs/dbraw/zinc/21/92/57/742219257.db2.gz BAYDITDTRDBMIC-MDZLAQPJSA-N 2 1 357.292 2.969 20 10 FFCDMP COc1ccc(N2CC[C@H](C[NH2+]Cc3ncc(C[NH+](C)C)s3)C2)cc1 ZINC000818222535 742251412 /nfs/dbraw/zinc/25/14/12/742251412.db2.gz UPVBPTXNMJHUGF-OAHLLOKOSA-N 2 1 360.527 2.829 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000895248587 968749866 /nfs/dbraw/zinc/74/98/66/968749866.db2.gz ONXZLQIPJUQZAM-LJQANCHMSA-N 2 1 356.466 2.566 20 10 FFCDMP CC[NH+](CC)CC(=O)N1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000728905330 977074305 /nfs/dbraw/zinc/07/43/05/977074305.db2.gz JADDPGRMMQBINX-UHFFFAOYSA-N 2 1 361.530 2.810 20 10 FFCDMP COc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1OC ZINC000894144985 977982670 /nfs/dbraw/zinc/98/26/70/977982670.db2.gz HRCBOYNAXCYJCM-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1ccc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1OC ZINC000894144985 977982677 /nfs/dbraw/zinc/98/26/77/977982677.db2.gz HRCBOYNAXCYJCM-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1ccc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1OC ZINC000894144985 977982686 /nfs/dbraw/zinc/98/26/86/977982686.db2.gz HRCBOYNAXCYJCM-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1ccc(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1OC ZINC000894144985 977982693 /nfs/dbraw/zinc/98/26/93/977982693.db2.gz HRCBOYNAXCYJCM-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CC3([NH+]4CCCC4)CCOCC3)CC2)cc1 ZINC000765800957 985951490 /nfs/dbraw/zinc/95/14/90/985951490.db2.gz DVYKKOUHMVLWAI-UHFFFAOYSA-N 2 1 373.541 2.899 20 10 FFCDMP Cc1c(C[C@H](C[NH3+])C[N@@H+](Cc2ccccc2O)C2CCCC2)cnn1C ZINC000903892678 1016291847 /nfs/dbraw/zinc/29/18/47/1016291847.db2.gz LEBQDJSUJQLPGY-QGZVFWFLSA-N 2 1 356.514 2.996 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846144554 1000218348 /nfs/dbraw/zinc/21/83/48/1000218348.db2.gz LFUIFQMOXYZWAO-HRAATJIYSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000846144554 1000218355 /nfs/dbraw/zinc/21/83/55/1000218355.db2.gz LFUIFQMOXYZWAO-HRAATJIYSA-N 2 1 356.466 2.688 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCCC3)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000768465733 1000263430 /nfs/dbraw/zinc/26/34/30/1000263430.db2.gz RLNXPYWOWKHKCA-UTKZUKDTSA-N 2 1 357.542 2.729 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775725293 1003835910 /nfs/dbraw/zinc/83/59/10/1003835910.db2.gz RTYIMFQZBCKQCW-GOSISDBHSA-N 2 1 359.514 2.602 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1O ZINC001205601772 1004166227 /nfs/dbraw/zinc/16/62/27/1004166227.db2.gz GGJUQYJJIIDQBK-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1ccc(N2CC[C@H]([NH2+]C3CC[NH+](C[C@@H]4CCCO4)CC3)C2)cc1 ZINC000850488875 1005818615 /nfs/dbraw/zinc/81/86/15/1005818615.db2.gz VMVZNIKKROBRBK-RXVVDRJESA-N 2 1 359.514 2.507 20 10 FFCDMP O[C@H](C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1)C[NH+]1CCCC1 ZINC000796278159 1011620719 /nfs/dbraw/zinc/62/07/19/1011620719.db2.gz HXGCVDAVPOXYFR-JOCHJYFZSA-N 2 1 365.521 2.796 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000756482920 1023718110 /nfs/dbraw/zinc/71/81/10/1023718110.db2.gz LBCUWBLPVZYGKL-OWCLPIDISA-N 2 1 364.486 2.719 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000756482920 1023718114 /nfs/dbraw/zinc/71/81/14/1023718114.db2.gz LBCUWBLPVZYGKL-OWCLPIDISA-N 2 1 364.486 2.719 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+]2CCCC[C@@H](C[NH3+])C2)c(O)c1 ZINC001206649704 1027983117 /nfs/dbraw/zinc/98/31/17/1027983117.db2.gz YBUUFSSMPXXJNZ-INIZCTEOSA-N 2 1 364.486 2.675 20 10 FFCDMP c1nc2c(c(N3CCCC4=C[C@H]5C[C@H](C[N@@H+]6CCCC[C@H]56)[C@@H]43)n1)CC[NH2+]C2 ZINC001155630784 1028826765 /nfs/dbraw/zinc/82/67/65/1028826765.db2.gz XKJUVKGBSDMZTO-XWDORNJCSA-N 2 1 365.525 2.522 20 10 FFCDMP Cc1cc(C(=O)C[NH+]2CCC(C[NH3+])CC2)c(C)n1-c1ccc2c(c1)OCO2 ZINC000843345045 1031338077 /nfs/dbraw/zinc/33/80/77/1031338077.db2.gz NXPXFJBHXPIFLT-UHFFFAOYSA-N 2 1 369.465 2.676 20 10 FFCDMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205582053 1031850810 /nfs/dbraw/zinc/85/08/10/1031850810.db2.gz WHGHKZLSXZNJCL-SFHVURJKSA-N 2 1 355.885 2.830 20 10 FFCDMP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CCC1(F)F ZINC001205787013 1031993463 /nfs/dbraw/zinc/99/34/63/1031993463.db2.gz DMMGDJUQJOBURU-LLVKDONJSA-N 2 1 354.319 2.749 20 10 FFCDMP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc(OCC(F)(F)F)cc2O)CCC1(F)F ZINC001205787013 1031993473 /nfs/dbraw/zinc/99/34/73/1031993473.db2.gz DMMGDJUQJOBURU-LLVKDONJSA-N 2 1 354.319 2.749 20 10 FFCDMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001138498124 1034337439 /nfs/dbraw/zinc/33/74/39/1034337439.db2.gz SJHPFYUJMPQNDK-UHFFFAOYSA-N 2 1 366.509 2.966 20 10 FFCDMP C[NH+](C)CCOc1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc1 ZINC001138772170 1034639762 /nfs/dbraw/zinc/63/97/62/1034639762.db2.gz SLEQBJUIHSMTBQ-UHFFFAOYSA-N 2 1 356.466 2.987 20 10 FFCDMP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H](c2cccc(Cl)c2)[NH+](C)C)cc1 ZINC000832273566 1034694520 /nfs/dbraw/zinc/69/45/20/1034694520.db2.gz OTMPAECTTGMCST-RBUKOAKNSA-N 2 1 374.916 2.825 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)cc(C[NH+](C)C)c1O ZINC001139257153 1035029708 /nfs/dbraw/zinc/02/97/08/1035029708.db2.gz SYUNZCBSRFSOQR-OAHLLOKOSA-N 2 1 364.486 2.626 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](c3noc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139254059 1035030225 /nfs/dbraw/zinc/03/02/25/1035030225.db2.gz CLWNMMVNYADXFV-OAHLLOKOSA-N 2 1 360.458 2.533 20 10 FFCDMP CCOC(=O)[C@@H]1CCCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259622 1035032085 /nfs/dbraw/zinc/03/20/85/1035032085.db2.gz YXZVNSKIEYQOFG-MRXNPFEDSA-N 2 1 364.486 2.628 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3ncccc3C)C2)cc(C[NH+](C)C)c1O ZINC001139259969 1035032426 /nfs/dbraw/zinc/03/24/26/1035032426.db2.gz GCQCFGGGLNJCMB-GOSISDBHSA-N 2 1 371.481 2.819 20 10 FFCDMP COC(=O)CC[N@@H+](Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139409313 1035094052 /nfs/dbraw/zinc/09/40/52/1035094052.db2.gz HWHMXXJBWRCWDN-UHFFFAOYSA-N 2 1 371.481 2.597 20 10 FFCDMP CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139410973 1035094728 /nfs/dbraw/zinc/09/47/28/1035094728.db2.gz OCPCACJNLQCSNQ-JBACZVJFSA-N 2 1 371.525 2.602 20 10 FFCDMP CCCCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140309320 1035429856 /nfs/dbraw/zinc/42/98/56/1035429856.db2.gz BDWRCEOIWJVUQJ-HXUWFJFHSA-N 2 1 373.541 2.994 20 10 FFCDMP Cc1cccc(C[N@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c1O ZINC001231593281 1037714368 /nfs/dbraw/zinc/71/43/68/1037714368.db2.gz PFRPYCOWJOTYMB-TZIWHRDSSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1cccc(C[NH+]2CC[C@@H]3C[N@H+](Cc4cccnc4)CCO[C@@H]3C2)c1O ZINC001231593281 1037714385 /nfs/dbraw/zinc/71/43/85/1037714385.db2.gz PFRPYCOWJOTYMB-TZIWHRDSSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1cccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1O ZINC001231593281 1037714403 /nfs/dbraw/zinc/71/44/03/1037714403.db2.gz PFRPYCOWJOTYMB-TZIWHRDSSA-N 2 1 367.493 2.819 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CCC[C@@]23CCN(CC[NH+](C)C)C3=O)c(O)c1 ZINC001277975419 1037809698 /nfs/dbraw/zinc/80/96/98/1037809698.db2.gz FLUWXDXKSMYQPJ-NRFANRHFSA-N 2 1 359.514 2.644 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001235949983 1037853827 /nfs/dbraw/zinc/85/38/27/1037853827.db2.gz YNPCODWEBHJVOS-QGZVFWFLSA-N 2 1 355.457 2.930 20 10 FFCDMP COc1cc(C)c(C[N@H+]2CCc3onc(Cn4ccnc4)c3C2)c(O)c1 ZINC001236809131 1038283408 /nfs/dbraw/zinc/28/34/08/1038283408.db2.gz POLIHDGZNSYZJZ-UHFFFAOYSA-N 2 1 354.410 2.500 20 10 FFCDMP COc1cc(C)c(CN2CCc3onc(Cn4ccnc4)c3C2)c(O)c1 ZINC001236809131 1038283420 /nfs/dbraw/zinc/28/34/20/1038283420.db2.gz POLIHDGZNSYZJZ-UHFFFAOYSA-N 2 1 354.410 2.500 20 10 FFCDMP COc1ccc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c(O)c1Cl ZINC001236810340 1038286430 /nfs/dbraw/zinc/28/64/30/1038286430.db2.gz UDKBECSDWROBTD-UHFFFAOYSA-N 2 1 367.921 2.514 20 10 FFCDMP Cc1nc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C2)no1 ZINC001236933619 1038365549 /nfs/dbraw/zinc/36/55/49/1038365549.db2.gz YWIGKYWFRNEZJK-QGZVFWFLSA-N 2 1 373.476 2.649 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@]4(C3)CC(F)(F)CO4)c(F)c2)CC1 ZINC001236934887 1038366482 /nfs/dbraw/zinc/36/64/82/1038366482.db2.gz AAWVMHJEMDZXPX-SFHVURJKSA-N 2 1 369.431 2.578 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4ccncc4)C3)c(F)c2)CC1 ZINC001236937747 1038367786 /nfs/dbraw/zinc/36/77/86/1038367786.db2.gz DRRRHXWAJRAQML-GOSISDBHSA-N 2 1 354.473 2.962 20 10 FFCDMP CC(C)c1ccc(C[N@@H+]2CCCn3c(=O)cc(C[NH+](C)C)nc3C2)c(O)c1 ZINC001237049156 1038423176 /nfs/dbraw/zinc/42/31/76/1038423176.db2.gz SRTFDRCYRBUSNZ-UHFFFAOYSA-N 2 1 370.497 2.540 20 10 FFCDMP CC(C)c1ccc(C[N@H+]2CCCn3c(=O)cc(C[NH+](C)C)nc3C2)c(O)c1 ZINC001237049156 1038423181 /nfs/dbraw/zinc/42/31/81/1038423181.db2.gz SRTFDRCYRBUSNZ-UHFFFAOYSA-N 2 1 370.497 2.540 20 10 FFCDMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246175051 1039266066 /nfs/dbraw/zinc/26/60/66/1039266066.db2.gz RVPJUULFMYMCAC-IRLDBZIGSA-N 3 1 350.510 2.679 20 10 FFCDMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246175052 1039266681 /nfs/dbraw/zinc/26/66/81/1039266681.db2.gz RVPJUULFMYMCAC-RBBKRZOGSA-N 3 1 350.510 2.679 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@H+]([C@@H]4CC[NH2+][C@@H](C)C4)C3)C2)cc1 ZINC001246701974 1039440837 /nfs/dbraw/zinc/44/08/37/1039440837.db2.gz JQPWEGGSBQMSNI-DWLFOUALSA-N 2 1 373.541 2.755 20 10 FFCDMP C[N@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCC(O)CC4)cc3)CC2)C1 ZINC001278465346 1039476821 /nfs/dbraw/zinc/47/68/21/1039476821.db2.gz ZLGKRRDXCZOKGN-UHFFFAOYSA-N 2 1 357.542 2.956 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC4(CCOCC4)[C@@H]3C3CC3)cc2F)CC1 ZINC001261245686 1041097238 /nfs/dbraw/zinc/09/72/38/1041097238.db2.gz LOPDRJLSQTWBBC-NRFANRHFSA-N 2 1 373.516 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCOCC4)[C@@H]3C3CC3)cc2F)CC1 ZINC001261245686 1041097257 /nfs/dbraw/zinc/09/72/57/1041097257.db2.gz LOPDRJLSQTWBBC-NRFANRHFSA-N 2 1 373.516 2.969 20 10 FFCDMP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC001278568973 1041205752 /nfs/dbraw/zinc/20/57/52/1041205752.db2.gz LVGJWCCHZLTJDE-LJQANCHMSA-N 2 1 351.922 2.895 20 10 FFCDMP Cc1cccc(C[NH+]2CCC3(C[NH+](Cc4cccc(=O)[nH]4)C3)CC2)c1O ZINC001279290111 1042985351 /nfs/dbraw/zinc/98/53/51/1042985351.db2.gz FSOWKJLPHZBAOE-UHFFFAOYSA-N 2 1 353.466 2.899 20 10 FFCDMP CN1CCCc2cc(C[N@@H+]3[C@@H]4CC[C@H]3CC(NCC[NH+](C)C)C4)ccc21 ZINC001279550641 1043244642 /nfs/dbraw/zinc/24/46/42/1043244642.db2.gz AOZDRKOJEZXXMM-SEJPIABJSA-N 2 1 356.558 2.716 20 10 FFCDMP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2c(c1)CCCN2C ZINC001279550641 1043244660 /nfs/dbraw/zinc/24/46/60/1043244660.db2.gz AOZDRKOJEZXXMM-SEJPIABJSA-N 2 1 356.558 2.716 20 10 FFCDMP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2c(c1)CCCN2C ZINC001279550641 1043244678 /nfs/dbraw/zinc/24/46/78/1043244678.db2.gz AOZDRKOJEZXXMM-SEJPIABJSA-N 2 1 356.558 2.716 20 10 FFCDMP COc1cc(C[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)c(O)c(OC)c1 ZINC001237671768 1043301431 /nfs/dbraw/zinc/30/14/31/1043301431.db2.gz AXCHLLHTBXIWQA-UHFFFAOYSA-N 2 1 357.454 2.852 20 10 FFCDMP CCc1ccc(C[NH+]2CCC3(CC[N@H+](COCCOC)C3)CC2)c(O)c1 ZINC001279663758 1043425371 /nfs/dbraw/zinc/42/53/71/1043425371.db2.gz DMPWRFBETFLYFZ-UHFFFAOYSA-N 2 1 362.514 2.863 20 10 FFCDMP CCc1ccc(C[NH+]2CCC3(CC[N@@H+](COCCOC)C3)CC2)c(O)c1 ZINC001279663758 1043425375 /nfs/dbraw/zinc/42/53/75/1043425375.db2.gz DMPWRFBETFLYFZ-UHFFFAOYSA-N 2 1 362.514 2.863 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4c(c3)COC4)cc2F)CC1 ZINC001319278442 1045095369 /nfs/dbraw/zinc/09/53/69/1045095369.db2.gz GFCZXRINKYQNCW-UHFFFAOYSA-N 2 1 355.457 2.898 20 10 FFCDMP C[C@H](CC(=O)OC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001318340400 1045274903 /nfs/dbraw/zinc/27/49/03/1045274903.db2.gz NLNXMJZSJQAXSU-OAHLLOKOSA-N 2 1 365.493 2.787 20 10 FFCDMP CN(C)c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)cc1F ZINC001308244636 1052435757 /nfs/dbraw/zinc/43/57/57/1052435757.db2.gz MBRVQLBNAYEPOG-UHFFFAOYSA-N 2 1 370.516 2.929 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC(C)([NH+]4CCC4)CC3)cc2F)CC1 ZINC001350337925 1055732800 /nfs/dbraw/zinc/73/28/00/1055732800.db2.gz HVORUUDTJCJZCN-UHFFFAOYSA-N 2 1 360.521 2.638 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)Nc1ccccc1 ZINC001200365691 1056489532 /nfs/dbraw/zinc/48/95/32/1056489532.db2.gz NEBSCHZAOAEYFC-MRXNPFEDSA-N 2 1 370.472 2.694 20 10 FFCDMP COc1cc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)ccc1O ZINC001461217014 1061253188 /nfs/dbraw/zinc/25/31/88/1061253188.db2.gz UEEXYKDZOMGEPD-UHFFFAOYSA-N 2 1 373.472 2.624 20 10 FFCDMP Cc1c2ccccc2n(C)c1C[NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C ZINC001560302523 1076261527 /nfs/dbraw/zinc/26/15/27/1076261527.db2.gz BQILTDQRVSGSSV-IBGZPJMESA-N 2 1 356.514 2.519 20 10 FFCDMP Cc1c2ccccc2n(C)c1C[NH2+]CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC001560302523 1076261529 /nfs/dbraw/zinc/26/15/29/1076261529.db2.gz BQILTDQRVSGSSV-IBGZPJMESA-N 2 1 356.514 2.519 20 10 FFCDMP C[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1O ZINC000282404470 510963264 /nfs/dbraw/zinc/96/32/64/510963264.db2.gz RUTXQVAQRRUYJN-ZDUSSCGKSA-N 2 1 370.335 2.831 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000370697439 513058561 /nfs/dbraw/zinc/05/85/61/513058561.db2.gz GGUJYQSFRLCXQZ-DENIHFKCSA-N 2 1 358.574 2.991 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000370697440 513058862 /nfs/dbraw/zinc/05/88/62/513058862.db2.gz GGUJYQSFRLCXQZ-KNQAVFIVSA-N 2 1 358.574 2.991 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000370697442 513059279 /nfs/dbraw/zinc/05/92/79/513059279.db2.gz GGUJYQSFRLCXQZ-UGKGYDQZSA-N 2 1 358.574 2.991 20 10 FFCDMP Oc1c(Br)cccc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530249741 517656408 /nfs/dbraw/zinc/65/64/08/517656408.db2.gz YKJOCGVIDPINHQ-OAHLLOKOSA-N 2 1 369.303 2.745 20 10 FFCDMP Cc1cc(Cl)cc(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000809741495 741338835 /nfs/dbraw/zinc/33/88/35/741338835.db2.gz OXZDDLZAOQJKRA-SFHVURJKSA-N 2 1 351.922 2.954 20 10 FFCDMP COCC1(C[NH2+]Cc2cc(C)cc(Br)c2O)CC[NH2+]CC1 ZINC000841068776 747263118 /nfs/dbraw/zinc/26/31/18/747263118.db2.gz VKRALOQUYAPKGA-UHFFFAOYSA-N 2 1 357.292 2.569 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000846222142 748433260 /nfs/dbraw/zinc/43/32/60/748433260.db2.gz GPLIQQNDALUQKR-OWQGQXMQSA-N 2 1 366.889 2.967 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000846222142 748433264 /nfs/dbraw/zinc/43/32/64/748433264.db2.gz GPLIQQNDALUQKR-OWQGQXMQSA-N 2 1 366.889 2.967 20 10 FFCDMP CC[C@@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1ccc(F)cc1O ZINC000854232618 750266717 /nfs/dbraw/zinc/26/67/17/750266717.db2.gz VQXRLEWAHIXJSW-QGZVFWFLSA-N 2 1 351.466 2.563 20 10 FFCDMP CCOc1cccc(C[N@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)c1O ZINC000190315067 971601009 /nfs/dbraw/zinc/60/10/09/971601009.db2.gz NGCSQPYBFINSFR-QFIPXVFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[N@@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)c1O ZINC000190315067 971601013 /nfs/dbraw/zinc/60/10/13/971601013.db2.gz NGCSQPYBFINSFR-QFIPXVFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[NH+](C)C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000190315067 971601021 /nfs/dbraw/zinc/60/10/21/971601021.db2.gz NGCSQPYBFINSFR-QFIPXVFZSA-N 2 1 370.493 2.860 20 10 FFCDMP CCOc1cccc(C[NH+](C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000190315067 971601029 /nfs/dbraw/zinc/60/10/29/971601029.db2.gz NGCSQPYBFINSFR-QFIPXVFZSA-N 2 1 370.493 2.860 20 10 FFCDMP COc1ccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c(O)c1OC ZINC000895116947 967668769 /nfs/dbraw/zinc/66/87/69/967668769.db2.gz XEBJMDCUSCNZHB-MSOLQXFVSA-N 2 1 356.466 2.844 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(I)cc2O)CCC[C@@H]1C[NH3+] ZINC001206014486 1032107800 /nfs/dbraw/zinc/10/78/00/1032107800.db2.gz WXHFNSGQAPMGPR-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(I)cc2O)CCC[C@H]1C[NH3+] ZINC001206014485 1032108067 /nfs/dbraw/zinc/10/80/67/1032108067.db2.gz WXHFNSGQAPMGPR-NEPJUHHUSA-N 2 1 374.266 2.804 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)cc2)CC1 ZINC000824695652 997059319 /nfs/dbraw/zinc/05/93/19/997059319.db2.gz AGEIYAZUZNJBDX-VSKRKVRLSA-N 2 1 357.542 2.954 20 10 FFCDMP Cc1cc(C[NH+]2CCN(C(=O)C[NH+]3CCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000738159744 999621504 /nfs/dbraw/zinc/62/15/04/999621504.db2.gz BITJHJKBBQXHSX-UHFFFAOYSA-N 2 1 373.541 2.738 20 10 FFCDMP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)C1 ZINC000738208309 999622631 /nfs/dbraw/zinc/62/26/31/999622631.db2.gz LFKSVEMYJWENJU-SFHVURJKSA-N 2 1 361.530 2.607 20 10 FFCDMP C[N@H+]1CCC[C@H](N2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)C1 ZINC000738208309 999622633 /nfs/dbraw/zinc/62/26/33/999622633.db2.gz LFKSVEMYJWENJU-SFHVURJKSA-N 2 1 361.530 2.607 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1O ZINC000846166539 1000215140 /nfs/dbraw/zinc/21/51/40/1000215140.db2.gz YZLRJICRDJIKTO-MAUKXSAKSA-N 2 1 356.466 2.818 20 10 FFCDMP COc1cc(O)c(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1OC ZINC000793240682 1003317705 /nfs/dbraw/zinc/31/77/05/1003317705.db2.gz JQZVGJQNTUTPHW-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1OC ZINC000793240682 1003317712 /nfs/dbraw/zinc/31/77/12/1003317712.db2.gz JQZVGJQNTUTPHW-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1OC ZINC000793240682 1003317723 /nfs/dbraw/zinc/31/77/23/1003317723.db2.gz JQZVGJQNTUTPHW-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1OC ZINC000793240682 1003317730 /nfs/dbraw/zinc/31/77/30/1003317730.db2.gz JQZVGJQNTUTPHW-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775738527 1003926605 /nfs/dbraw/zinc/92/66/05/1003926605.db2.gz GUFKRTFQWWEXMI-IBGZPJMESA-N 2 1 373.541 2.994 20 10 FFCDMP Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775660872 1004985653 /nfs/dbraw/zinc/98/56/53/1004985653.db2.gz ZYZWWPJSMWSBFN-IBGZPJMESA-N 2 1 353.514 2.552 20 10 FFCDMP CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667264 1005013479 /nfs/dbraw/zinc/01/34/79/1005013479.db2.gz GWLNLFNANBZWOC-HXUWFJFHSA-N 2 1 372.557 2.567 20 10 FFCDMP COc1ccc(N2CC[C@@H]([NH2+]C3CC[NH+](C[C@@H]4CCCO4)CC3)C2)cc1 ZINC000850488874 1005818598 /nfs/dbraw/zinc/81/85/98/1005818598.db2.gz VMVZNIKKROBRBK-NQIIRXRSSA-N 2 1 359.514 2.507 20 10 FFCDMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817940510 1007818248 /nfs/dbraw/zinc/81/82/48/1007818248.db2.gz NPVQNSBEFYNBER-KRWDZBQOSA-N 2 1 372.488 2.888 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2([NH3+])C3CC4CC(C3)CC2C4)c1 ZINC000817984137 1007836733 /nfs/dbraw/zinc/83/67/33/1007836733.db2.gz NYMZSVNZRPGQDG-SFHSBBOOSA-N 2 1 358.482 2.983 20 10 FFCDMP C[C@H](COCC(F)(F)F)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177707083 1008721299 /nfs/dbraw/zinc/72/12/99/1008721299.db2.gz GEQMLSDOADBQMN-CYBMUJFWSA-N 2 1 363.399 2.635 20 10 FFCDMP C[C@@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc(C(F)(F)F)c1O ZINC000925853001 1017875014 /nfs/dbraw/zinc/87/50/14/1017875014.db2.gz XNHGHNCZFOKNBR-VXGBXAGGSA-N 2 1 372.387 2.747 20 10 FFCDMP c1c(C[N@H+]2CCOCC3(CC[NH2+]CC3)C2)cc2c3c1CCCN3CCC2 ZINC001222407790 1032948463 /nfs/dbraw/zinc/94/84/63/1032948463.db2.gz NJVYLILXYZSBNR-UHFFFAOYSA-N 2 1 355.526 2.587 20 10 FFCDMP [NH3+]C1(CC(=O)NCc2c(O)cccc2F)CC[NH+](Cc2ccccc2)CC1 ZINC001122257975 1023151276 /nfs/dbraw/zinc/15/12/76/1023151276.db2.gz GWTWTBCICNXTDM-UHFFFAOYSA-N 2 1 371.456 2.531 20 10 FFCDMP CN(C)c1ccc([C@@H](N)C[NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)cc1 ZINC000841041705 1029996077 /nfs/dbraw/zinc/99/60/77/1029996077.db2.gz AMKMROXPFZFPFP-NRFANRHFSA-N 2 1 367.472 2.926 20 10 FFCDMP COc1ccccc1-n1nccc1C[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000841041316 1029996472 /nfs/dbraw/zinc/99/64/72/1029996472.db2.gz FFRUAPVXFJNPCR-LJQANCHMSA-N 2 1 365.481 2.737 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205627467 1031884653 /nfs/dbraw/zinc/88/46/53/1031884653.db2.gz PQZLSFPWICTYQZ-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139260321 1035031410 /nfs/dbraw/zinc/03/14/10/1035031410.db2.gz KZGRAVJONOQQHC-LJQANCHMSA-N 2 1 371.481 2.901 20 10 FFCDMP CCOC(=O)C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC001139411491 1035094993 /nfs/dbraw/zinc/09/49/93/1035094993.db2.gz ORZHUTCLVBGRTM-UYAOXDASSA-N 2 1 373.541 2.850 20 10 FFCDMP Cc1ccc(C)c(C[NH+]2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001140180604 1035370939 /nfs/dbraw/zinc/37/09/39/1035370939.db2.gz JLQTYCMCESNHGV-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[NH+]2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001140180604 1035370944 /nfs/dbraw/zinc/37/09/44/1035370944.db2.gz JLQTYCMCESNHGV-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[N@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001140180604 1035370949 /nfs/dbraw/zinc/37/09/49/1035370949.db2.gz JLQTYCMCESNHGV-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1ccc(C)c(C[N@@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c1O ZINC001140180604 1035370954 /nfs/dbraw/zinc/37/09/54/1035370954.db2.gz JLQTYCMCESNHGV-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140304707 1035426438 /nfs/dbraw/zinc/42/64/38/1035426438.db2.gz ZERHJDDBZRKXRQ-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc4ccccc4cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235350845 1037497355 /nfs/dbraw/zinc/49/73/55/1037497355.db2.gz ABJAWSYDQBFNRG-UGKGYDQZSA-N 2 1 368.477 2.910 20 10 FFCDMP c1ccc(CO[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688112 1037683429 /nfs/dbraw/zinc/68/34/29/1037683429.db2.gz NJJVQDQFDDAASI-QFIPXVFZSA-N 2 1 351.494 2.887 20 10 FFCDMP Cc1cccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001231593337 1037714639 /nfs/dbraw/zinc/71/46/39/1037714639.db2.gz PSQZXNHHHGSORT-UHFFFAOYSA-N 2 1 354.498 2.941 20 10 FFCDMP Cc1cc(C)c(C[N@H+]2CCCn3cnc(COCC[NH+](C)C)c3C2)c(O)c1 ZINC001231844174 1037941798 /nfs/dbraw/zinc/94/17/98/1037941798.db2.gz HTOHHFHPJPJQSG-UHFFFAOYSA-N 2 1 372.513 2.690 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375564 1038062486 /nfs/dbraw/zinc/06/24/86/1038062486.db2.gz KYCNZSGLUNBFPF-GOSISDBHSA-N 2 1 372.557 2.546 20 10 FFCDMP CN1CCN(c2ccc(CN3CCC[C@H]3c3cnccn3)c(F)c2)CC1 ZINC001236934185 1038365007 /nfs/dbraw/zinc/36/50/07/1038365007.db2.gz DSAOSNCZPFUFGJ-FQEVSTJZSA-N 2 1 355.461 2.705 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4cccnc4)C3)c(F)c2)CC1 ZINC001236937423 1038366975 /nfs/dbraw/zinc/36/69/75/1038366975.db2.gz GWLYVBSPZRDQBQ-GOSISDBHSA-N 2 1 354.473 2.962 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@@H+](C4CC[NH+](C)CC4)C3)C2)cc1 ZINC001256202878 1038430086 /nfs/dbraw/zinc/43/00/86/1038430086.db2.gz ANXRGHVERHDALE-QFIPXVFZSA-N 2 1 373.541 2.708 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@H+](C4CC[NH+](C)CC4)C3)C2)cc1 ZINC001256202878 1038430090 /nfs/dbraw/zinc/43/00/90/1038430090.db2.gz ANXRGHVERHDALE-QFIPXVFZSA-N 2 1 373.541 2.708 20 10 FFCDMP C[N@H+]1CCC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001254510236 1040760211 /nfs/dbraw/zinc/76/02/11/1040760211.db2.gz UAIUJWAJKNWZOM-IWMITWMQSA-N 2 1 355.482 2.913 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3c(C)ccc(C)c3O)C[C@H]2CC1 ZINC001279235480 1042959285 /nfs/dbraw/zinc/95/92/85/1042959285.db2.gz OTHCPONOKFVHKZ-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3c(C)ccc(C)c3O)C[C@H]2CC1 ZINC001279235480 1042959292 /nfs/dbraw/zinc/95/92/92/1042959292.db2.gz OTHCPONOKFVHKZ-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3c(C)ccc(C)c3O)C[C@H]2CC1 ZINC001279235480 1042959296 /nfs/dbraw/zinc/95/92/96/1042959296.db2.gz OTHCPONOKFVHKZ-KDURUIRLSA-N 2 1 362.514 2.773 20 10 FFCDMP c1ccc(COc2ccc(N3CC[NH+](C[C@H]4CC[NH2+]C4)CC3)cc2)cc1 ZINC001237250732 1043074516 /nfs/dbraw/zinc/07/45/16/1043074516.db2.gz XGFZILVSJRKYDB-FQEVSTJZSA-N 2 1 351.494 2.997 20 10 FFCDMP C[NH+]1CCC(C[NH+]2CCN(Cc3cc(Cl)cc(F)c3O)CC2)CC1 ZINC001237622912 1043279026 /nfs/dbraw/zinc/27/90/26/1043279026.db2.gz FAQXLHBNSVYLCZ-UHFFFAOYSA-N 2 1 355.885 2.644 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)CC3CCCC3)cc2F)CC1 ZINC001321150009 1045562708 /nfs/dbraw/zinc/56/27/08/1045562708.db2.gz RBOVPWRLIATZJT-LJQANCHMSA-N 2 1 363.521 2.856 20 10 FFCDMP Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001324731435 1046192705 /nfs/dbraw/zinc/19/27/05/1046192705.db2.gz LLKOGGHMSJYSEP-KRWDZBQOSA-N 2 1 373.476 2.649 20 10 FFCDMP Cc1noc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001324731435 1046192712 /nfs/dbraw/zinc/19/27/12/1046192712.db2.gz LLKOGGHMSJYSEP-KRWDZBQOSA-N 2 1 373.476 2.649 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC[C@H](C4CCC4)C3)cc2F)CC1 ZINC001324822277 1046242943 /nfs/dbraw/zinc/24/29/43/1046242943.db2.gz IDJXKSFYNMXTRW-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC[C@H](C4CCC4)C3)cc2F)CC1 ZINC001324822277 1046242952 /nfs/dbraw/zinc/24/29/52/1046242952.db2.gz IDJXKSFYNMXTRW-LJQANCHMSA-N 2 1 361.505 2.826 20 10 FFCDMP C[C@@H]1[C@H]([NH+]2CCCC2)CCN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325712850 1046619933 /nfs/dbraw/zinc/61/99/33/1046619933.db2.gz DTIOOMVKJDRLHT-YLJYHZDGSA-N 2 1 360.521 2.636 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC([NH2+]CC4CC4)CC3)cc2F)CC1 ZINC001332339175 1048354243 /nfs/dbraw/zinc/35/42/43/1048354243.db2.gz KWRFVRQDNFAQDZ-UHFFFAOYSA-N 2 1 360.521 2.542 20 10 FFCDMP c1cc(N2CCCC2)ccc1CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC[NH2+]CC1 ZINC001332474362 1048409552 /nfs/dbraw/zinc/40/95/52/1048409552.db2.gz ZQTUAYGTNYFRIX-SZPZYZBQSA-N 2 1 354.542 2.687 20 10 FFCDMP c1cc(N2CCCC2)ccc1C[N@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC001332474362 1048409562 /nfs/dbraw/zinc/40/95/62/1048409562.db2.gz ZQTUAYGTNYFRIX-SZPZYZBQSA-N 2 1 354.542 2.687 20 10 FFCDMP c1cc(N2CCCC2)ccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC001332474362 1048409568 /nfs/dbraw/zinc/40/95/68/1048409568.db2.gz ZQTUAYGTNYFRIX-SZPZYZBQSA-N 2 1 354.542 2.687 20 10 FFCDMP C[C@H](O)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001330315404 1049129936 /nfs/dbraw/zinc/12/99/36/1049129936.db2.gz ISUIUMHVZJZQLZ-KKSFZXQISA-N 2 1 357.473 2.789 20 10 FFCDMP CCC[N@H+](C)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001341569505 1050196209 /nfs/dbraw/zinc/19/62/09/1050196209.db2.gz PQNGAUGRPMYYFC-IBGZPJMESA-N 2 1 362.537 2.741 20 10 FFCDMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001341569505 1050196214 /nfs/dbraw/zinc/19/62/14/1050196214.db2.gz PQNGAUGRPMYYFC-IBGZPJMESA-N 2 1 362.537 2.741 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCC[N@@H+]2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC001473970724 1065429302 /nfs/dbraw/zinc/42/93/02/1065429302.db2.gz ZLDMBYZNYHOFAV-HXUWFJFHSA-N 2 1 360.546 2.565 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCC[N@H+]2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC001473970724 1065429306 /nfs/dbraw/zinc/42/93/06/1065429306.db2.gz ZLDMBYZNYHOFAV-HXUWFJFHSA-N 2 1 360.546 2.565 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809275 509305787 /nfs/dbraw/zinc/30/57/87/509305787.db2.gz DXFFJDSHGKHVET-DXIQSLLYSA-N 2 1 374.573 2.526 20 10 FFCDMP CCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)c(O)c1 ZINC000179517245 509491664 /nfs/dbraw/zinc/49/16/64/509491664.db2.gz VUNSKTKDUDHJHS-INIZCTEOSA-N 2 1 350.503 2.706 20 10 FFCDMP COc1cc(Br)cc(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c1O ZINC000366536665 512077572 /nfs/dbraw/zinc/07/75/72/512077572.db2.gz SPYWKHJTDJNQRU-MRXNPFEDSA-N 2 1 355.276 2.691 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC(C)(C)C[NH+](C)C)C1 ZINC000457249288 515755179 /nfs/dbraw/zinc/75/51/79/515755179.db2.gz TWKFSMUNWDQQTH-UHFFFAOYSA-N 2 1 370.541 2.864 20 10 FFCDMP Oc1c(Br)cccc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530249740 517656350 /nfs/dbraw/zinc/65/63/50/517656350.db2.gz YKJOCGVIDPINHQ-HNNXBMFYSA-N 2 1 369.303 2.745 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)c1 ZINC000810252270 741401771 /nfs/dbraw/zinc/40/17/71/741401771.db2.gz MVAKJMPLWBUNMP-ZDUSSCGKSA-N 2 1 352.500 2.657 20 10 FFCDMP COc1cc(C[NH2+]C2(CCO)CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850340770 749344654 /nfs/dbraw/zinc/34/46/54/749344654.db2.gz ZWBITHWLTRMXLX-UHFFFAOYSA-N 2 1 350.503 2.635 20 10 FFCDMP CCc1[nH+]ccn1[C@H](C)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891245338 962556362 /nfs/dbraw/zinc/55/63/62/962556362.db2.gz CVQTWQJTIUUSSC-APWZRJJASA-N 2 1 371.529 2.882 20 10 FFCDMP COc1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1Cn1cccn1 ZINC000873042770 1013360305 /nfs/dbraw/zinc/36/03/05/1013360305.db2.gz IZQJHJASIUXHAL-MRXNPFEDSA-N 2 1 353.470 2.871 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(I)cc2O)CCC[C@@H]1C[NH3+] ZINC001206014488 1032106832 /nfs/dbraw/zinc/10/68/32/1032106832.db2.gz WXHFNSGQAPMGPR-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1 ZINC000922391239 988549138 /nfs/dbraw/zinc/54/91/38/988549138.db2.gz AEVNPGIDRYPAOH-PBASOCQRSA-N 2 1 362.514 2.750 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811518199 995162755 /nfs/dbraw/zinc/16/27/55/995162755.db2.gz GSDMGGMAYZBFTC-SFTDATJTSA-N 2 1 355.526 2.972 20 10 FFCDMP CCOc1ccc(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000741257665 999716932 /nfs/dbraw/zinc/71/69/32/999716932.db2.gz ICJVLLRVPNHZCV-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1ccc(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(O)c1 ZINC000741257665 999716934 /nfs/dbraw/zinc/71/69/34/999716934.db2.gz ICJVLLRVPNHZCV-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)C1 ZINC000769379709 1000504175 /nfs/dbraw/zinc/50/41/75/1000504175.db2.gz DZCALHQYXPVYME-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3ccc(N4CCCCC4)cc3)CC2)C1 ZINC000769379709 1000504178 /nfs/dbraw/zinc/50/41/78/1000504178.db2.gz DZCALHQYXPVYME-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccccc4[C@H]3CO)cc2)CC1 ZINC000775699611 1003706074 /nfs/dbraw/zinc/70/60/74/1003706074.db2.gz AWWNBVASJWQLKQ-JOCHJYFZSA-N 2 1 351.494 2.530 20 10 FFCDMP Cc1noc([C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000775654546 1004963390 /nfs/dbraw/zinc/96/33/90/1004963390.db2.gz LOXMJICUOAJZJB-GOSISDBHSA-N 2 1 355.486 2.509 20 10 FFCDMP C[C@H](C(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+](C)Cc1ccccc1O ZINC000111235261 1006362900 /nfs/dbraw/zinc/36/29/00/1006362900.db2.gz WFDKFFHSEQJUSC-XLIONFOSSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235261 1006362910 /nfs/dbraw/zinc/36/29/10/1006362910.db2.gz WFDKFFHSEQJUSC-XLIONFOSSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235261 1006362921 /nfs/dbraw/zinc/36/29/21/1006362921.db2.gz WFDKFFHSEQJUSC-XLIONFOSSA-N 2 1 367.493 2.603 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC000817902534 1007804488 /nfs/dbraw/zinc/80/44/88/1007804488.db2.gz SPRADVLULSFUEL-HMXCVIKNSA-N 2 1 374.548 2.978 20 10 FFCDMP [NH3+][C@@H]1CCCCC[C@@H]1NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918329 1007809952 /nfs/dbraw/zinc/80/99/52/1007809952.db2.gz YRSHSKREEJTCKF-YADHBBJMSA-N 2 1 356.558 2.968 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940261 1007817520 /nfs/dbraw/zinc/81/75/20/1007817520.db2.gz FCBMLSRKQWZQFB-WTNAPCKOSA-N 2 1 367.541 2.648 20 10 FFCDMP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1c(O)cccc1F ZINC000886520328 1008714514 /nfs/dbraw/zinc/71/45/14/1008714514.db2.gz BIWXUEXCTSVOAE-AWEZNQCLSA-N 2 1 359.445 2.674 20 10 FFCDMP CC[NH+](CC)CC[C@H](CO)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001179067712 1009246905 /nfs/dbraw/zinc/24/69/05/1009246905.db2.gz VXOYHMLUKWQTNE-MRXNPFEDSA-N 2 1 352.519 2.881 20 10 FFCDMP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116448861 1021224014 /nfs/dbraw/zinc/22/40/14/1021224014.db2.gz BJZKKPAHOVJKGB-MOPGFXCFSA-N 2 1 360.521 2.636 20 10 FFCDMP CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116448861 1021224020 /nfs/dbraw/zinc/22/40/20/1021224020.db2.gz BJZKKPAHOVJKGB-MOPGFXCFSA-N 2 1 360.521 2.636 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC001120072575 1023230429 /nfs/dbraw/zinc/23/04/29/1023230429.db2.gz XHBKQSKFQLHNEF-GBESFXJTSA-N 2 1 361.505 2.824 20 10 FFCDMP C[N@@H+](Cc1ccco1)[C@@H]1COC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001141157489 1025537967 /nfs/dbraw/zinc/53/79/67/1025537967.db2.gz JTUWSXNKDJGEJJ-KRWDZBQOSA-N 2 1 372.465 2.946 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccc(OC)cc1O)C2 ZINC001203623528 1030793384 /nfs/dbraw/zinc/79/33/84/1030793384.db2.gz SZSHCKBGVUQCRG-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(OC)cc1O)C2 ZINC001203623528 1030793404 /nfs/dbraw/zinc/79/34/04/1030793404.db2.gz SZSHCKBGVUQCRG-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(OC)cc1O)C2 ZINC001203623528 1030793421 /nfs/dbraw/zinc/79/34/21/1030793421.db2.gz SZSHCKBGVUQCRG-NQIIRXRSSA-N 2 1 360.498 2.581 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c(C(F)(F)F)c1 ZINC000843125238 1031194062 /nfs/dbraw/zinc/19/40/62/1031194062.db2.gz OSFRWHGVBBRHQV-OAHLLOKOSA-N 2 1 371.447 2.959 20 10 FFCDMP C[C@@H](CC[NH+](C)C)C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353249 1031702935 /nfs/dbraw/zinc/70/29/35/1031702935.db2.gz CRRRYPYBVMVUCF-YOEHRIQHSA-N 2 1 367.921 2.714 20 10 FFCDMP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000832272946 1034693912 /nfs/dbraw/zinc/69/39/12/1034693912.db2.gz KHNSLJWFNSLXCA-RTWAWAEBSA-N 2 1 366.509 2.533 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](Oc4cccnc4)C3)cc2)CC1 ZINC001139408601 1035092809 /nfs/dbraw/zinc/09/28/09/1035092809.db2.gz AOAQBYMXUPNKBA-QFIPXVFZSA-N 2 1 366.509 2.877 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](Oc4ccncc4)C3)cc2)CC1 ZINC001139411404 1035095393 /nfs/dbraw/zinc/09/53/93/1035095393.db2.gz KAXCWEZTOZBVPI-JOCHJYFZSA-N 2 1 366.509 2.877 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](CCO)Cc3ccccc3)cc2)CC1 ZINC001140300418 1035423893 /nfs/dbraw/zinc/42/38/93/1035423893.db2.gz OVKSZFPLPBNCAW-UHFFFAOYSA-N 2 1 353.510 2.823 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1O ZINC001140747867 1036045828 /nfs/dbraw/zinc/04/58/28/1036045828.db2.gz BUZNKDDOKKRUDB-UHFFFAOYSA-N 2 1 370.497 2.647 20 10 FFCDMP Cc1ccc(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c(O)c1 ZINC001140949500 1036543773 /nfs/dbraw/zinc/54/37/73/1036543773.db2.gz DDUISYWZTXPDCI-UHFFFAOYSA-N 2 1 354.498 2.941 20 10 FFCDMP c1c(C[N@@H+]2CCOC[C@@]3(CCC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001235007025 1037298607 /nfs/dbraw/zinc/29/86/07/1037298607.db2.gz JEWVZZHEFNZZBX-JOCHJYFZSA-N 2 1 355.526 2.587 20 10 FFCDMP c1c(C[N@H+]2CCOC[C@@]3(CCC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001235007025 1037298625 /nfs/dbraw/zinc/29/86/25/1037298625.db2.gz JEWVZZHEFNZZBX-JOCHJYFZSA-N 2 1 355.526 2.587 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158844 1037390339 /nfs/dbraw/zinc/39/03/39/1037390339.db2.gz WGFGCXMJKSNBFY-QFIPXVFZSA-N 3 1 374.548 2.932 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158844 1037390353 /nfs/dbraw/zinc/39/03/53/1037390353.db2.gz WGFGCXMJKSNBFY-QFIPXVFZSA-N 2 1 374.548 2.932 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)c(F)c2)CC1 ZINC001235158844 1037390367 /nfs/dbraw/zinc/39/03/67/1037390367.db2.gz WGFGCXMJKSNBFY-QFIPXVFZSA-N 2 1 374.548 2.932 20 10 FFCDMP c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CN3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235839457 1037783647 /nfs/dbraw/zinc/78/36/47/1037783647.db2.gz AYBRIZQTLVDPHZ-GOTSBHOMSA-N 2 1 362.521 2.555 20 10 FFCDMP c1ccc(CN2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235839457 1037783660 /nfs/dbraw/zinc/78/36/60/1037783660.db2.gz AYBRIZQTLVDPHZ-GOTSBHOMSA-N 2 1 362.521 2.555 20 10 FFCDMP c1ccc(CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235839457 1037783673 /nfs/dbraw/zinc/78/36/73/1037783673.db2.gz AYBRIZQTLVDPHZ-GOTSBHOMSA-N 2 1 362.521 2.555 20 10 FFCDMP CC(C)(C)c1cc(O)c(C[N@H+]2CCC[C@@H](N3CC([NH3+])C3)C2)cc1Cl ZINC001236079816 1037923711 /nfs/dbraw/zinc/92/37/11/1037923711.db2.gz YZUVUIRZUFZWSM-OAHLLOKOSA-N 2 1 351.922 2.950 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374569 1038059619 /nfs/dbraw/zinc/05/96/19/1038059619.db2.gz FDWHFLRVBGVRIQ-FQEVSTJZSA-N 2 1 356.558 2.840 20 10 FFCDMP CCCN(CCC[NH+](C)C)Cc1ccc(N2CCN(C)CC2)cc1F ZINC001236947437 1038374176 /nfs/dbraw/zinc/37/41/76/1038374176.db2.gz SABXIAYPMNVNHX-UHFFFAOYSA-N 3 1 350.526 2.741 20 10 FFCDMP CCOC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@@H]1C ZINC001237114164 1038447503 /nfs/dbraw/zinc/44/75/03/1038447503.db2.gz CKAKZFZITGDDBQ-HKUYNNGSSA-N 2 1 359.514 2.507 20 10 FFCDMP O=c1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2O)CC3)[nH]1 ZINC001278551856 1041115644 /nfs/dbraw/zinc/11/56/44/1041115644.db2.gz NISYUUCMAYZKBE-UHFFFAOYSA-N 2 1 353.466 2.981 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cc2F)CC1 ZINC001261579063 1041314667 /nfs/dbraw/zinc/31/46/67/1041314667.db2.gz WWVYWIRWLJJMBC-FQEVSTJZSA-N 3 1 374.548 2.789 20 10 FFCDMP COc1cc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c(OC)c1 ZINC001237675175 1043302849 /nfs/dbraw/zinc/30/28/49/1043302849.db2.gz BCQBRTAHNAURIC-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c(OC)c1 ZINC001237675175 1043302856 /nfs/dbraw/zinc/30/28/56/1043302856.db2.gz BCQBRTAHNAURIC-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(O)c(OC)c1 ZINC001237675175 1043302863 /nfs/dbraw/zinc/30/28/63/1043302863.db2.gz BCQBRTAHNAURIC-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(O)c(OC)c1 ZINC001237675175 1043302869 /nfs/dbraw/zinc/30/28/69/1043302869.db2.gz BCQBRTAHNAURIC-KDURUIRLSA-N 2 1 368.477 2.973 20 10 FFCDMP COCCOC[N@@H+]1CCC2(C1)CC[NH+](Cc1cc(F)cc(C)c1O)CC2 ZINC001280028871 1044105335 /nfs/dbraw/zinc/10/53/35/1044105335.db2.gz ZRZBZEYBJPJBSC-UHFFFAOYSA-N 2 1 366.477 2.748 20 10 FFCDMP COCCOC[N@H+]1CCC2(C1)CC[NH+](Cc1cc(F)cc(C)c1O)CC2 ZINC001280028871 1044105343 /nfs/dbraw/zinc/10/53/43/1044105343.db2.gz ZRZBZEYBJPJBSC-UHFFFAOYSA-N 2 1 366.477 2.748 20 10 FFCDMP Cc1ccc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001322149045 1045968564 /nfs/dbraw/zinc/96/85/64/1045968564.db2.gz MFCZFWCTEHSHJE-OAQYLSRUSA-N 2 1 357.473 2.709 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cc2F)CC1 ZINC001324758160 1046208161 /nfs/dbraw/zinc/20/81/61/1046208161.db2.gz ANRJFEWROHWOSD-UHFFFAOYSA-N 3 1 360.521 2.542 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3[C@H]3CCCOC3)cc2F)CC1 ZINC001327121413 1047196387 /nfs/dbraw/zinc/19/63/87/1047196387.db2.gz QMFHTJYYUTVJET-ICSRJNTNSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3[C@H]3CCCOC3)cc2F)CC1 ZINC001327121413 1047196392 /nfs/dbraw/zinc/19/63/92/1047196392.db2.gz QMFHTJYYUTVJET-ICSRJNTNSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@](C)(O)c3ccsc3)cc2F)CC1 ZINC001329251386 1048635870 /nfs/dbraw/zinc/63/58/70/1048635870.db2.gz DSTLRACXBXGVFJ-LJQANCHMSA-N 2 1 363.502 2.636 20 10 FFCDMP CC[NH+](CC)C1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001341536930 1050166565 /nfs/dbraw/zinc/16/65/65/1050166565.db2.gz AQUCGYPFJJLOLG-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP COc1ccccc1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001473910446 1065418525 /nfs/dbraw/zinc/41/85/25/1065418525.db2.gz OONQUGHKMLEUBX-UHFFFAOYSA-N 2 1 357.473 2.918 20 10 FFCDMP CC[C@@H]1[C@@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@H+]1C ZINC001571388425 1077249801 /nfs/dbraw/zinc/24/98/01/1077249801.db2.gz PYBNYYMDMXOBTH-NZSAHSFTSA-N 2 1 361.530 2.670 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CCC[N@@H+]3CCCO[C@@H](C)C3)CC2)cc1 ZINC000365330473 511384057 /nfs/dbraw/zinc/38/40/57/511384057.db2.gz LUQRMDOYXKCFSW-SFHVURJKSA-N 2 1 361.530 2.755 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CCC[N@H+]3CCCO[C@@H](C)C3)CC2)cc1 ZINC000365330473 511384064 /nfs/dbraw/zinc/38/40/64/511384064.db2.gz LUQRMDOYXKCFSW-SFHVURJKSA-N 2 1 361.530 2.755 20 10 FFCDMP CCC1(CC)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[S@@]1=O ZINC000769558208 737541876 /nfs/dbraw/zinc/54/18/76/737541876.db2.gz UAZASGZXEURAGL-VWLOTQADSA-N 2 1 363.571 2.562 20 10 FFCDMP CCC1(CC)C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[S@@]1=O ZINC000769558208 737541879 /nfs/dbraw/zinc/54/18/79/737541879.db2.gz UAZASGZXEURAGL-VWLOTQADSA-N 2 1 363.571 2.562 20 10 FFCDMP C[NH+](C)CCCCC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000771057402 737689801 /nfs/dbraw/zinc/68/98/01/737689801.db2.gz IYELTURJEIPCJU-QGZVFWFLSA-N 2 1 367.921 2.858 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](n4cc(Cl)cn4)C3)cc2)CC1 ZINC000811520145 741533290 /nfs/dbraw/zinc/53/32/90/741533290.db2.gz KILMKNHTZDESNI-IBGZPJMESA-N 2 1 359.905 2.735 20 10 FFCDMP Fc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146279 746787998 /nfs/dbraw/zinc/78/79/98/746787998.db2.gz BFAXQTOIVUOZCF-CVEARBPZSA-N 2 1 351.441 2.518 20 10 FFCDMP Fc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146279 746788001 /nfs/dbraw/zinc/78/80/01/746788001.db2.gz BFAXQTOIVUOZCF-CVEARBPZSA-N 2 1 351.441 2.518 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000840759665 972959678 /nfs/dbraw/zinc/95/96/78/972959678.db2.gz ZTVNWQMKRAVLJQ-AYOQOUSVSA-N 2 1 365.468 2.764 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126121 986557638 /nfs/dbraw/zinc/55/76/38/986557638.db2.gz GRVUJYMCZHRKFT-RTWAWAEBSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126121 986557647 /nfs/dbraw/zinc/55/76/47/986557647.db2.gz GRVUJYMCZHRKFT-RTWAWAEBSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126121 986557654 /nfs/dbraw/zinc/55/76/54/986557654.db2.gz GRVUJYMCZHRKFT-RTWAWAEBSA-N 2 1 356.558 2.650 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515482 998627140 /nfs/dbraw/zinc/62/71/40/998627140.db2.gz PZLQAGGYENWKOX-SJORKVTESA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515482 998627143 /nfs/dbraw/zinc/62/71/43/998627143.db2.gz PZLQAGGYENWKOX-SJORKVTESA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001144515482 998627148 /nfs/dbraw/zinc/62/71/48/998627148.db2.gz PZLQAGGYENWKOX-SJORKVTESA-N 2 1 354.450 2.757 20 10 FFCDMP COC(=O)c1cc2ccccc2c(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)c1O ZINC000793741392 1003489246 /nfs/dbraw/zinc/48/92/46/1003489246.db2.gz CPQWZXARCIFJDX-OAQYLSRUSA-N 2 1 354.450 2.860 20 10 FFCDMP COC(=O)c1cc2ccccc2c(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)c1O ZINC000793741392 1003489251 /nfs/dbraw/zinc/48/92/51/1003489251.db2.gz CPQWZXARCIFJDX-OAQYLSRUSA-N 2 1 354.450 2.860 20 10 FFCDMP CC[NH+](CC)CC1CC[NH+](Cc2ccc(N3CCN(C)CC3)cc2)CC1 ZINC000775652534 1004959135 /nfs/dbraw/zinc/95/91/35/1004959135.db2.gz MSOZRSCDWSLBTB-UHFFFAOYSA-N 2 1 358.574 2.992 20 10 FFCDMP C[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(N2CCCCCC2)cc1 ZINC000854231234 1006734433 /nfs/dbraw/zinc/73/44/33/1006734433.db2.gz HLOPQAFABQFHFB-OAHLLOKOSA-N 2 1 355.486 2.872 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552187 1007881892 /nfs/dbraw/zinc/88/18/92/1007881892.db2.gz IWFBJEKQFIWTDG-FQEVSTJZSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@H+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552187 1007881903 /nfs/dbraw/zinc/88/19/03/1007881903.db2.gz IWFBJEKQFIWTDG-FQEVSTJZSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](Cc3cc(OC)ccc3O)C2)ccn1 ZINC000856552187 1007881905 /nfs/dbraw/zinc/88/19/05/1007881905.db2.gz IWFBJEKQFIWTDG-FQEVSTJZSA-N 2 1 371.481 2.901 20 10 FFCDMP CC(C)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@H]1CCC[NH2+]CC1 ZINC001206598467 1032359085 /nfs/dbraw/zinc/35/90/85/1032359085.db2.gz KHOQRYRKPSLMTO-IBGZPJMESA-N 3 1 362.537 2.930 20 10 FFCDMP NC(=O)C1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000925776223 1017847728 /nfs/dbraw/zinc/84/77/28/1017847728.db2.gz FNFUJPJFSVIKCV-LEWJYISDSA-N 2 1 364.493 2.623 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc4ccccc4c3O)C[C@@H]1C[NH2+]CCC2 ZINC001222135600 1032779143 /nfs/dbraw/zinc/77/91/43/1032779143.db2.gz FRBNHYYEJGJOEN-AVRDEDQJSA-N 2 1 368.477 2.910 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](c4cccnc4)C3)cc2F)CC1 ZINC001118202270 1022116773 /nfs/dbraw/zinc/11/67/73/1022116773.db2.gz UFZJCGIPFVYJKX-LJQANCHMSA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](c4cccnc4)C3)cc2F)CC1 ZINC001118202270 1022116782 /nfs/dbraw/zinc/11/67/82/1022116782.db2.gz UFZJCGIPFVYJKX-LJQANCHMSA-N 2 1 354.473 2.962 20 10 FFCDMP CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000758028914 1023907955 /nfs/dbraw/zinc/90/79/55/1023907955.db2.gz GWRYLOOEPHVSDR-UHFFFAOYSA-N 2 1 361.530 2.992 20 10 FFCDMP CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000758028914 1023907961 /nfs/dbraw/zinc/90/79/61/1023907961.db2.gz GWRYLOOEPHVSDR-UHFFFAOYSA-N 2 1 361.530 2.992 20 10 FFCDMP Oc1ccccc1C[N@H+]1CC[C@@H]2C[NH+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001203555535 1030763283 /nfs/dbraw/zinc/76/32/83/1030763283.db2.gz CEEVYBCOPZOFLU-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@@H]2C[N@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001203555535 1030763302 /nfs/dbraw/zinc/76/33/02/1030763302.db2.gz CEEVYBCOPZOFLU-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001203555535 1030763314 /nfs/dbraw/zinc/76/33/14/1030763314.db2.gz CEEVYBCOPZOFLU-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(OC)c1O)C2 ZINC001203592677 1030775989 /nfs/dbraw/zinc/77/59/89/1030775989.db2.gz VSJMHQXZFBKCKC-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP CN(C)CC[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001204604814 1031387642 /nfs/dbraw/zinc/38/76/42/1031387642.db2.gz YIRPXHPIBNMMGC-UHFFFAOYSA-N 2 1 352.526 2.660 20 10 FFCDMP CN(C)CC[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001204604814 1031387653 /nfs/dbraw/zinc/38/76/53/1031387653.db2.gz YIRPXHPIBNMMGC-UHFFFAOYSA-N 2 1 352.526 2.660 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H](c2ccccc2)C1 ZINC001204691463 1031412322 /nfs/dbraw/zinc/41/23/22/1031412322.db2.gz FYPHVGDNRCLXET-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H](c2ccccc2)C1 ZINC001204691463 1031412331 /nfs/dbraw/zinc/41/23/31/1031412331.db2.gz FYPHVGDNRCLXET-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)[C@H](c2ccccc2)C1 ZINC001204691463 1031412346 /nfs/dbraw/zinc/41/23/46/1031412346.db2.gz FYPHVGDNRCLXET-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[C@H](CC[NH+](C)C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353241 1031703816 /nfs/dbraw/zinc/70/38/16/1031703816.db2.gz CRRRYPYBVMVUCF-RHSMWYFYSA-N 2 1 367.921 2.714 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3ccncc3C)C2)cc(C[NH+](C)C)c1O ZINC001139260017 1035031189 /nfs/dbraw/zinc/03/11/89/1035031189.db2.gz HTBLJFDGEDGUMN-SFHVURJKSA-N 2 1 371.481 2.819 20 10 FFCDMP CCOC(=O)[C@]1(C)CCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259317 1035031774 /nfs/dbraw/zinc/03/17/74/1035031774.db2.gz QYUDWGAJEWVRDL-HXUWFJFHSA-N 2 1 364.486 2.628 20 10 FFCDMP COc1cc(C[N@@H+]2CCOC[C@H]2Cc2ccccc2)cc(C[NH+](C)C)c1O ZINC001139260645 1035032042 /nfs/dbraw/zinc/03/20/42/1035032042.db2.gz OBSCNMAJUFTKMG-HXUWFJFHSA-N 2 1 370.493 2.906 20 10 FFCDMP COc1cc(C[N@H+]2CCOC[C@H]2Cc2ccccc2)cc(C[NH+](C)C)c1O ZINC001139260645 1035032048 /nfs/dbraw/zinc/03/20/48/1035032048.db2.gz OBSCNMAJUFTKMG-HXUWFJFHSA-N 2 1 370.493 2.906 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](c3nnc(C)o3)C2)cc(C[NH+](C)C)c1O ZINC001139259291 1035032225 /nfs/dbraw/zinc/03/22/25/1035032225.db2.gz PMEGWTCNYWKRRL-HNNXBMFYSA-N 2 1 360.458 2.533 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C(=O)OC)[C@H]3C)cc2)CC1 ZINC001140304289 1035426185 /nfs/dbraw/zinc/42/61/85/1035426185.db2.gz LXQWSJNGFMMIEU-XLIONFOSSA-N 2 1 359.514 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](CC(=O)OC)C3)cc2)CC1 ZINC001140305947 1035427629 /nfs/dbraw/zinc/42/76/29/1035427629.db2.gz IVDYNUXSJXXLPU-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)cc1Br ZINC001233136772 1036384210 /nfs/dbraw/zinc/38/42/10/1036384210.db2.gz CAJXLWWIWIYBSF-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(O)c(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)cc1Br ZINC001233136772 1036384225 /nfs/dbraw/zinc/38/42/25/1036384225.db2.gz CAJXLWWIWIYBSF-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)cc1Br ZINC001233136772 1036384242 /nfs/dbraw/zinc/38/42/42/1036384242.db2.gz CAJXLWWIWIYBSF-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)cc1Br ZINC001233136772 1036384259 /nfs/dbraw/zinc/38/42/59/1036384259.db2.gz CAJXLWWIWIYBSF-YPMHNXCESA-N 2 1 355.276 2.547 20 10 FFCDMP COc1ccc(Br)c(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c1O ZINC001231558259 1037682840 /nfs/dbraw/zinc/68/28/40/1037682840.db2.gz ZYRRHGZMGCDLDV-MRXNPFEDSA-N 2 1 355.276 2.691 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714025 1037706115 /nfs/dbraw/zinc/70/61/15/1037706115.db2.gz FPLYMTBLKSNNOU-QGZVFWFLSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714025 1037706129 /nfs/dbraw/zinc/70/61/29/1037706129.db2.gz FPLYMTBLKSNNOU-QGZVFWFLSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714025 1037706140 /nfs/dbraw/zinc/70/61/40/1037706140.db2.gz FPLYMTBLKSNNOU-QGZVFWFLSA-N 2 1 367.493 2.581 20 10 FFCDMP COc1cc(C[N@H+]2C[C@H]3C[NH+](Cc4ccc(C)cc4)C[C@H]3C2)c(O)cc1O ZINC001231634432 1037756363 /nfs/dbraw/zinc/75/63/63/1037756363.db2.gz IUAMOVAUNJWKFZ-KDURUIRLSA-N 2 1 368.477 2.979 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccc(C)cc4)C[C@H]3C2)c(O)cc1O ZINC001231634432 1037756381 /nfs/dbraw/zinc/75/63/81/1037756381.db2.gz IUAMOVAUNJWKFZ-KDURUIRLSA-N 2 1 368.477 2.979 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccc(C)cc4)C[C@H]3C2)c(O)cc1O ZINC001231634432 1037756397 /nfs/dbraw/zinc/75/63/97/1037756397.db2.gz IUAMOVAUNJWKFZ-KDURUIRLSA-N 2 1 368.477 2.979 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@H+](Cc4ccc(C)cc4)C[C@H]3C2)c(O)cc1O ZINC001231634432 1037756413 /nfs/dbraw/zinc/75/64/13/1037756413.db2.gz IUAMOVAUNJWKFZ-KDURUIRLSA-N 2 1 368.477 2.979 20 10 FFCDMP COc1cc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)cc1O ZINC001231635822 1037759602 /nfs/dbraw/zinc/75/96/02/1037759602.db2.gz MPSJGJSWOFIUBB-HDICACEKSA-N 2 1 354.450 2.670 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)cc1O ZINC001231635822 1037759610 /nfs/dbraw/zinc/75/96/10/1037759610.db2.gz MPSJGJSWOFIUBB-HDICACEKSA-N 2 1 354.450 2.670 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(O)cc1O ZINC001231635822 1037759625 /nfs/dbraw/zinc/75/96/25/1037759625.db2.gz MPSJGJSWOFIUBB-HDICACEKSA-N 2 1 354.450 2.670 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(O)cc1O ZINC001231635822 1037759633 /nfs/dbraw/zinc/75/96/33/1037759633.db2.gz MPSJGJSWOFIUBB-HDICACEKSA-N 2 1 354.450 2.670 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCN[C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855683 1037796716 /nfs/dbraw/zinc/79/67/16/1037796716.db2.gz UWISPNSENINJAZ-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH2+][C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855683 1037796735 /nfs/dbraw/zinc/79/67/35/1037796735.db2.gz UWISPNSENINJAZ-JOCHJYFZSA-N 2 1 350.510 2.585 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3ccc4ccccc4c3O)C[C@H]1C[NH2+]CC2 ZINC001236041373 1037903781 /nfs/dbraw/zinc/90/37/81/1037903781.db2.gz ROKYWXOVSFRNFV-DYESRHJHSA-N 2 1 354.450 2.520 20 10 FFCDMP COC(=O)[C@@H]([NH3+])C1CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001236068537 1037913042 /nfs/dbraw/zinc/91/30/42/1037913042.db2.gz VHAXFPWHJYHHFC-FQEVSTJZSA-N 2 1 355.482 2.806 20 10 FFCDMP Cc1ccnc(O[C@H]2CCC[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)c1 ZINC001236533687 1038121844 /nfs/dbraw/zinc/12/18/44/1038121844.db2.gz YBLQIURFTUWBII-SFHVURJKSA-N 2 1 369.465 2.621 20 10 FFCDMP CCc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001236787168 1038269645 /nfs/dbraw/zinc/26/96/45/1038269645.db2.gz JNVYNSZCHUXEFA-UYAOXDASSA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[N@@H+]2C[C@H]3C[NH+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001236787168 1038269658 /nfs/dbraw/zinc/26/96/58/1038269658.db2.gz JNVYNSZCHUXEFA-UYAOXDASSA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001236787168 1038269665 /nfs/dbraw/zinc/26/96/65/1038269665.db2.gz JNVYNSZCHUXEFA-UYAOXDASSA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c(O)c1 ZINC001236787168 1038269673 /nfs/dbraw/zinc/26/96/73/1038269673.db2.gz JNVYNSZCHUXEFA-UYAOXDASSA-N 2 1 354.498 2.642 20 10 FFCDMP Cc1cccc(O[C@@H]2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)n1 ZINC001236847302 1038306081 /nfs/dbraw/zinc/30/60/81/1038306081.db2.gz IZIFXWGCDBSHAY-OAQYLSRUSA-N 2 1 366.509 2.843 20 10 FFCDMP CO[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)C[C@@H]21 ZINC001236937750 1038366823 /nfs/dbraw/zinc/36/68/23/1038366823.db2.gz DUKQBXFOJXJIEL-LKUPVBHCSA-N 2 1 361.505 2.824 20 10 FFCDMP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2O)CC[N@H+]1C1CCCCC1 ZINC001237250791 1043074859 /nfs/dbraw/zinc/07/48/59/1043074859.db2.gz XYYVUGXCSVVXDO-SFHVURJKSA-N 2 1 372.557 2.641 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@@H+](Cc1ccc(C(F)(F)F)cc1O)C2 ZINC001279513414 1043208900 /nfs/dbraw/zinc/20/89/00/1043208900.db2.gz DWMSJANZEODHFG-UHFFFAOYSA-N 2 1 371.447 2.870 20 10 FFCDMP CC(C)c1ccc(C[NH+]2CCC3(C[NH+](CC(=O)N(C)C)C3)CC2)c(O)c1 ZINC001279673364 1043443582 /nfs/dbraw/zinc/44/35/82/1043443582.db2.gz KWLIXGLKJHNNOL-UHFFFAOYSA-N 2 1 359.514 2.502 20 10 FFCDMP CN1CCCC(C)(C)[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001320990809 1045508111 /nfs/dbraw/zinc/50/81/11/1045508111.db2.gz LWQSBFILZQKJKI-FQEVSTJZSA-N 2 1 362.537 2.788 20 10 FFCDMP C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001328086414 1048171212 /nfs/dbraw/zinc/17/12/12/1048171212.db2.gz SDVBVVKEEJTOSJ-JTSKRJEESA-N 2 1 371.500 2.832 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3Cc4ccccc4O3)cc2F)CC1 ZINC001200161963 1055908553 /nfs/dbraw/zinc/90/85/53/1055908553.db2.gz UMOMTRJOGOSHRE-GOSISDBHSA-N 2 1 355.457 2.671 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CCO)c3ccccc3)cc2F)CC1 ZINC001339414624 1056429449 /nfs/dbraw/zinc/42/94/49/1056429449.db2.gz OSTAKKXYJAOVPG-HXUWFJFHSA-N 2 1 357.473 2.791 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)[C@H](c2ccccc2)[NH+](C)C)[NH+](C)C)cc1 ZINC001456927143 1060229555 /nfs/dbraw/zinc/22/95/55/1060229555.db2.gz ALHWDBKMCTZFMN-RTWAWAEBSA-N 2 1 368.525 2.774 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cc1C ZINC001474019579 1065439915 /nfs/dbraw/zinc/43/99/15/1065439915.db2.gz DQLNEPJZDBIPOO-LEWJYISDSA-N 2 1 354.494 2.976 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1C ZINC001474019579 1065439921 /nfs/dbraw/zinc/43/99/21/1065439921.db2.gz DQLNEPJZDBIPOO-LEWJYISDSA-N 2 1 354.494 2.976 20 10 FFCDMP Cc1c(C[C@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cnn1C ZINC001579529546 1078639666 /nfs/dbraw/zinc/63/96/66/1078639666.db2.gz KRHINDKWSWJHMP-LJQANCHMSA-N 2 1 355.530 2.578 20 10 FFCDMP COc1ccc(N2CCC[N@@H+](CCCN3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000192724087 509615972 /nfs/dbraw/zinc/61/59/72/509615972.db2.gz QJIPWUWUWFVXPR-UHFFFAOYSA-N 2 1 374.573 2.623 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1 ZINC000273420096 511525181 /nfs/dbraw/zinc/52/51/81/511525181.db2.gz RWZQLUUQIWDFSY-HNNXBMFYSA-N 2 1 372.465 2.970 20 10 FFCDMP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000750837626 735819206 /nfs/dbraw/zinc/81/92/06/735819206.db2.gz LPYHROHPSNOUEO-KRWDZBQOSA-N 2 1 352.450 2.667 20 10 FFCDMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000750837626 735819208 /nfs/dbraw/zinc/81/92/08/735819208.db2.gz LPYHROHPSNOUEO-KRWDZBQOSA-N 2 1 352.450 2.667 20 10 FFCDMP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cc(Cl)ccc1O ZINC000775502162 738097557 /nfs/dbraw/zinc/09/75/57/738097557.db2.gz PDJPOMRMWGYCQI-CJNGLKHVSA-N 2 1 353.894 2.674 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000846222143 748433333 /nfs/dbraw/zinc/43/33/33/748433333.db2.gz GPLIQQNDALUQKR-QANKJYHBSA-N 2 1 366.889 2.967 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000846222143 748433335 /nfs/dbraw/zinc/43/33/35/748433335.db2.gz GPLIQQNDALUQKR-QANKJYHBSA-N 2 1 366.889 2.967 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000127941549 975552178 /nfs/dbraw/zinc/55/21/78/975552178.db2.gz CCPZFBYICSNTBH-QUCCMNQESA-N 2 1 372.557 2.915 20 10 FFCDMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)c2)c(O)c1 ZINC000877028374 1014454996 /nfs/dbraw/zinc/45/49/96/1014454996.db2.gz VYBQPSARJOWPFI-HXUWFJFHSA-N 2 1 367.493 2.688 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCC(N3CC[NH+](C)CC3)CC2)cc1F ZINC000877747528 1014706005 /nfs/dbraw/zinc/70/60/05/1014706005.db2.gz PGMJBJHKVHYDIL-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@@H]3CC[N@@H+](C)[C@@H]3C)C2)cc1C ZINC001086700324 995317905 /nfs/dbraw/zinc/31/79/05/995317905.db2.gz KJVBNHBXOJFUID-GSEOLPGOSA-N 2 1 373.541 2.718 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)OCCC[NH+](C)C)C1 ZINC000792185737 1002938011 /nfs/dbraw/zinc/93/80/11/1002938011.db2.gz POWGWWZJCZPNBR-UHFFFAOYSA-N 2 1 357.498 2.903 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCCO)Cc3ccccc3)cc2)CC1 ZINC000775681715 1003635499 /nfs/dbraw/zinc/63/54/99/1003635499.db2.gz RYSHOJZYWVNHJL-UHFFFAOYSA-N 2 1 353.510 2.823 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721250 1003792425 /nfs/dbraw/zinc/79/24/25/1003792425.db2.gz UUFJOPPBRSYGRN-NRFANRHFSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721250 1003792434 /nfs/dbraw/zinc/79/24/34/1003792434.db2.gz UUFJOPPBRSYGRN-NRFANRHFSA-N 2 1 356.558 2.746 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1n1ccnc1 ZINC000775738145 1003930105 /nfs/dbraw/zinc/93/01/05/1003930105.db2.gz UFXMLDGXRQWLFC-GHTZIAJQSA-N 2 1 353.514 2.718 20 10 FFCDMP COc1ccc(OCC[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775647305 1004914344 /nfs/dbraw/zinc/91/43/44/1004914344.db2.gz UNZHALOFJNUBJZ-UHFFFAOYSA-N 2 1 369.509 2.958 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000853093069 1006293203 /nfs/dbraw/zinc/29/32/03/1006293203.db2.gz AUEFUQKXLMOKAT-OAQYLSRUSA-N 3 1 356.558 2.650 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC[C@H]3CCC[N@H+](CC4CC4)C3)cc2)CC1 ZINC000853093069 1006293208 /nfs/dbraw/zinc/29/32/08/1006293208.db2.gz AUEFUQKXLMOKAT-OAQYLSRUSA-N 2 1 356.558 2.650 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC[C@H]3CCC[N@@H+](CC4CC4)C3)cc2)CC1 ZINC000853093069 1006293214 /nfs/dbraw/zinc/29/32/14/1006293214.db2.gz AUEFUQKXLMOKAT-OAQYLSRUSA-N 2 1 356.558 2.650 20 10 FFCDMP C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116437522 1021215626 /nfs/dbraw/zinc/21/56/26/1021215626.db2.gz OYBBYRQSLKINEW-UHFFFAOYSA-N 2 1 371.456 2.938 20 10 FFCDMP C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001116437522 1021215631 /nfs/dbraw/zinc/21/56/31/1021215631.db2.gz OYBBYRQSLKINEW-UHFFFAOYSA-N 2 1 371.456 2.938 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@H]2C1 ZINC001120072577 1023229854 /nfs/dbraw/zinc/22/98/54/1023229854.db2.gz XHBKQSKFQLHNEF-IPMKNSEASA-N 2 1 361.505 2.824 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000756482921 1023718044 /nfs/dbraw/zinc/71/80/44/1023718044.db2.gz LBCUWBLPVZYGKL-XHSDSOJGSA-N 2 1 364.486 2.719 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000756482921 1023718050 /nfs/dbraw/zinc/71/80/50/1023718050.db2.gz LBCUWBLPVZYGKL-XHSDSOJGSA-N 2 1 364.486 2.719 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548171 1023725736 /nfs/dbraw/zinc/72/57/36/1023725736.db2.gz JAXCOQHTKNZDCE-NVXWUHKLSA-N 2 1 355.482 2.783 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2CCC(=O)N(CC[NH+](C)C)CC2)c2ccccc21 ZINC001204240190 1031182194 /nfs/dbraw/zinc/18/21/94/1031182194.db2.gz KVTHKNZJHMDRTA-UHFFFAOYSA-N 2 1 368.525 2.502 20 10 FFCDMP Cc1c(C[NH+]2CCC([NH+]3CCC(C(N)=O)CC3)CC2)c2ccccc2n1C ZINC001138257960 1034029075 /nfs/dbraw/zinc/02/90/75/1034029075.db2.gz FRHQDIWLCUXBIF-UHFFFAOYSA-N 2 1 368.525 2.648 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@]1(O)C(F)(F)F ZINC001139408026 1035092339 /nfs/dbraw/zinc/09/23/39/1035092339.db2.gz ITKASEKKCZTDRG-QAPCUYQASA-N 2 1 371.447 2.574 20 10 FFCDMP CCO[C@@H]1CO[C@@]2(C1)CCC[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001139408434 1035092404 /nfs/dbraw/zinc/09/24/04/1035092404.db2.gz VMLACOGWNJXRGS-FCHUYYIVSA-N 2 1 373.541 2.598 20 10 FFCDMP Cc1ccc(C[N@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949656 1036545540 /nfs/dbraw/zinc/54/55/40/1036545540.db2.gz GFTITOLJXDYTTK-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(C[NH+]2CC[C@@H]3C[N@H+](Cc4cccnc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949656 1036545550 /nfs/dbraw/zinc/54/55/50/1036545550.db2.gz GFTITOLJXDYTTK-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949656 1036545556 /nfs/dbraw/zinc/54/55/56/1036545556.db2.gz GFTITOLJXDYTTK-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076223 1036924677 /nfs/dbraw/zinc/92/46/77/1036924677.db2.gz NIFRNUIZBBPEFG-UHFFFAOYSA-N 2 1 373.541 2.702 20 10 FFCDMP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076223 1036924688 /nfs/dbraw/zinc/92/46/88/1036924688.db2.gz NIFRNUIZBBPEFG-UHFFFAOYSA-N 2 1 373.541 2.702 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429422 1037543433 /nfs/dbraw/zinc/54/34/33/1037543433.db2.gz UENRAZQRDUTYKQ-OALUTQOASA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429422 1037543445 /nfs/dbraw/zinc/54/34/45/1037543445.db2.gz UENRAZQRDUTYKQ-OALUTQOASA-N 2 1 374.548 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)c(F)c2)CC1 ZINC001235429422 1037543458 /nfs/dbraw/zinc/54/34/58/1037543458.db2.gz UENRAZQRDUTYKQ-OALUTQOASA-N 2 1 374.548 2.789 20 10 FFCDMP c1csc(CCN2CC[NH+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)c1 ZINC001235691310 1037689256 /nfs/dbraw/zinc/68/92/56/1037689256.db2.gz IVPXDERYSYRPKL-UHFFFAOYSA-N 2 1 370.566 2.518 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(Br)c1 ZINC001236321665 1038046071 /nfs/dbraw/zinc/04/60/71/1038046071.db2.gz VIJSKNUCENLHND-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4cccnc4)C3)c(F)c2)CC1 ZINC001236941216 1038371299 /nfs/dbraw/zinc/37/12/99/1038371299.db2.gz YEOIJZWGOTWXDD-HXUWFJFHSA-N 2 1 370.472 2.626 20 10 FFCDMP C[NH+]1CCN(c2cc(C[N@@H+]3CCc4cccc(O)c4C3)ccc2F)CC1 ZINC001236968763 1038386125 /nfs/dbraw/zinc/38/61/25/1038386125.db2.gz VCFQNLOGTXCHHL-UHFFFAOYSA-N 2 1 355.457 2.841 20 10 FFCDMP C[NH+]1CCN(c2cc(C[N@H+]3CCc4cccc(O)c4C3)ccc2F)CC1 ZINC001236968763 1038386128 /nfs/dbraw/zinc/38/61/28/1038386128.db2.gz VCFQNLOGTXCHHL-UHFFFAOYSA-N 2 1 355.457 2.841 20 10 FFCDMP CCOc1cccc(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c1O ZINC001278576039 1041233851 /nfs/dbraw/zinc/23/38/51/1041233851.db2.gz DEYCLWMEJOQAOB-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP CCOc1cccc(C[NH+]2CCC3(CCN(CC[NH+](C)C)C3)CC2)c1O ZINC001278576039 1041233871 /nfs/dbraw/zinc/23/38/71/1041233871.db2.gz DEYCLWMEJOQAOB-UHFFFAOYSA-N 2 1 361.530 2.640 20 10 FFCDMP C[NH+](C)CCN1CCC[C@]2(CCC[N@H+](Cc3c(O)ccc(F)c3F)C2)C1 ZINC001279490987 1043178147 /nfs/dbraw/zinc/17/81/47/1043178147.db2.gz SNHGZVDAEOQYJR-FQEVSTJZSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+](C)CCN1CCC[C@]2(CCC[N@@H+](Cc3c(O)ccc(F)c3F)C2)C1 ZINC001279490987 1043178151 /nfs/dbraw/zinc/17/81/51/1043178151.db2.gz SNHGZVDAEOQYJR-FQEVSTJZSA-N 2 1 367.484 2.910 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237485314 1043199301 /nfs/dbraw/zinc/19/93/01/1043199301.db2.gz NVGWVKPEERMTOD-QGZVFWFLSA-N 2 1 360.498 2.940 20 10 FFCDMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)c(Cl)c3)C[C@H]2CC1 ZINC001279558937 1043254666 /nfs/dbraw/zinc/25/46/66/1043254666.db2.gz HTQKTGYLUFCOGL-HDICACEKSA-N 2 1 363.933 2.950 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(Cl)c3)C[C@H]2CC1 ZINC001279558937 1043254670 /nfs/dbraw/zinc/25/46/70/1043254670.db2.gz HTQKTGYLUFCOGL-HDICACEKSA-N 2 1 363.933 2.950 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(Cl)c3)C[C@H]2CC1 ZINC001279558937 1043254679 /nfs/dbraw/zinc/25/46/79/1043254679.db2.gz HTQKTGYLUFCOGL-HDICACEKSA-N 2 1 363.933 2.950 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)cc1Cl ZINC001279571105 1043274185 /nfs/dbraw/zinc/27/41/85/1043274185.db2.gz DLVKOSKEIAFLQT-UHFFFAOYSA-N 2 1 367.921 2.514 20 10 FFCDMP CN(C)c1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319025374 1044989991 /nfs/dbraw/zinc/98/99/91/1044989991.db2.gz BVQQAIGJXRYGEQ-UHFFFAOYSA-N 2 1 356.489 2.933 20 10 FFCDMP C[C@@H](CC(=O)OC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001318340399 1045275048 /nfs/dbraw/zinc/27/50/48/1045275048.db2.gz NLNXMJZSJQAXSU-HNNXBMFYSA-N 2 1 365.493 2.787 20 10 FFCDMP CN(C)[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccco1 ZINC001318347118 1045277326 /nfs/dbraw/zinc/27/73/26/1045277326.db2.gz YIOPHLGEGRTOFM-LJQANCHMSA-N 2 1 360.477 2.563 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4ccccn4)C3)cc2F)CC1 ZINC001321153413 1045565052 /nfs/dbraw/zinc/56/50/52/1045565052.db2.gz AJYNFVNDRFPYGO-SFHVURJKSA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4ccccn4)C3)cc2F)CC1 ZINC001321153413 1045565058 /nfs/dbraw/zinc/56/50/58/1045565058.db2.gz AJYNFVNDRFPYGO-SFHVURJKSA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCN3C3CCCC3)cc2F)CC1 ZINC001328699350 1048426296 /nfs/dbraw/zinc/42/62/96/1048426296.db2.gz HCNPUGAXBQGTCV-LJQANCHMSA-N 2 1 360.521 2.684 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](CO)c1ccccc1 ZINC001330533489 1049194723 /nfs/dbraw/zinc/19/47/23/1049194723.db2.gz OHLAKDLSYCYLTL-NRFANRHFSA-N 2 1 357.473 2.743 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](CO)c1ccccc1 ZINC001330533489 1049194726 /nfs/dbraw/zinc/19/47/26/1049194726.db2.gz OHLAKDLSYCYLTL-NRFANRHFSA-N 2 1 357.473 2.743 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@](C)(O)c1ccccc1 ZINC001349568109 1055343750 /nfs/dbraw/zinc/34/37/50/1055343750.db2.gz FCEIPOMJQJLNCK-VGOFRKELSA-N 2 1 371.500 2.963 20 10 FFCDMP COc1ccccc1OCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001460995473 1061183242 /nfs/dbraw/zinc/18/32/42/1061183242.db2.gz MSZHRRKAJYBSKD-UHFFFAOYSA-N 2 1 373.472 2.755 20 10 FFCDMP C[C@@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001472281310 1064998270 /nfs/dbraw/zinc/99/82/70/1064998270.db2.gz VBFIUUQCQZBJNV-PFRQMTDMSA-N 2 1 360.546 2.733 20 10 FFCDMP CC(C)[NH+]1CC(NC(=O)Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)C1 ZINC001567757654 1077051029 /nfs/dbraw/zinc/05/10/29/1077051029.db2.gz CZNNUSGXEWBCFS-UHFFFAOYSA-N 2 1 368.525 2.617 20 10 FFCDMP CC(C)[NH+]1CC(NC(=O)Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)C1 ZINC001567757654 1077051035 /nfs/dbraw/zinc/05/10/35/1077051035.db2.gz CZNNUSGXEWBCFS-UHFFFAOYSA-N 2 1 368.525 2.617 20 10 FFCDMP COc1c(O)c(C[NH2+]CCCC[NH+]2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000278566587 510998413 /nfs/dbraw/zinc/99/84/13/510998413.db2.gz BXJUWAMZOLEBOQ-UHFFFAOYSA-N 2 1 351.447 2.911 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000273437698 511526707 /nfs/dbraw/zinc/52/67/07/511526707.db2.gz XPYYCMVDTUQBDE-HNNXBMFYSA-N 2 1 372.465 2.970 20 10 FFCDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@@H](C)C1 ZINC000894256430 734825954 /nfs/dbraw/zinc/82/59/54/734825954.db2.gz QIASBHGHTJGSMA-WMZOPIPTSA-N 2 1 350.503 2.936 20 10 FFCDMP COCC[NH+](CCOC)C1CC[NH+](Cc2cc(C)cc(C)c2O)CC1 ZINC000795713087 740055180 /nfs/dbraw/zinc/05/51/80/740055180.db2.gz BGMHPFDJBPTHEE-UHFFFAOYSA-N 2 1 350.503 2.568 20 10 FFCDMP CC[C@@H]([NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1ccc(F)cc1O ZINC000796894463 740194351 /nfs/dbraw/zinc/19/43/51/740194351.db2.gz WAILNBBJKTZRML-SJORKVTESA-N 2 1 353.482 2.665 20 10 FFCDMP CN(Cc1cccs1)c1ccc(C[NH2+]C[C@@H](O)C[NH+]2CCCC2)cc1 ZINC000823697448 742963533 /nfs/dbraw/zinc/96/35/33/742963533.db2.gz KAQFNTXDFYPYAC-LJQANCHMSA-N 2 1 359.539 2.931 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000894297905 964318792 /nfs/dbraw/zinc/31/87/92/964318792.db2.gz KEJGLISWTGMXPH-PMACEKPBSA-N 2 1 370.493 2.682 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000894297905 964318802 /nfs/dbraw/zinc/31/88/02/964318802.db2.gz KEJGLISWTGMXPH-PMACEKPBSA-N 2 1 370.493 2.682 20 10 FFCDMP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000178671853 977698537 /nfs/dbraw/zinc/69/85/37/977698537.db2.gz XPKKKBARDFLEHO-LJQANCHMSA-N 2 1 372.557 2.882 20 10 FFCDMP COC(=O)c1c(CNC[C@@H]2CC[N@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172205 978098235 /nfs/dbraw/zinc/09/82/35/978098235.db2.gz DPNIQKTZBBWVTI-ZDUSSCGKSA-N 2 1 359.445 2.678 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172205 978098239 /nfs/dbraw/zinc/09/82/39/978098239.db2.gz DPNIQKTZBBWVTI-ZDUSSCGKSA-N 2 1 359.445 2.678 20 10 FFCDMP COC(=O)c1c(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cc(F)ccc2n1C ZINC000894172205 978098247 /nfs/dbraw/zinc/09/82/47/978098247.db2.gz DPNIQKTZBBWVTI-ZDUSSCGKSA-N 2 1 359.445 2.678 20 10 FFCDMP C[C@H](NC(=O)CC1([NH3+])CC[NH+](Cc2ccccc2)CC1)c1ccccc1O ZINC000877256692 1014528674 /nfs/dbraw/zinc/52/86/74/1014528674.db2.gz COBYMYITPWLBRO-KRWDZBQOSA-N 2 1 367.493 2.953 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](OCc4ccccn4)C3)cc2)CC1 ZINC000877645488 1014657883 /nfs/dbraw/zinc/65/78/83/1014657883.db2.gz MSZNOTSFWZZYPF-QFIPXVFZSA-N 2 1 366.509 2.625 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126119 986557065 /nfs/dbraw/zinc/55/70/65/986557065.db2.gz GRVUJYMCZHRKFT-NHCUHLMSSA-N 3 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126119 986557071 /nfs/dbraw/zinc/55/70/71/986557071.db2.gz GRVUJYMCZHRKFT-NHCUHLMSSA-N 2 1 356.558 2.650 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2)CC1 ZINC000843126119 986557082 /nfs/dbraw/zinc/55/70/82/986557082.db2.gz GRVUJYMCZHRKFT-NHCUHLMSSA-N 2 1 356.558 2.650 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000922391154 988547345 /nfs/dbraw/zinc/54/73/45/988547345.db2.gz UCYGIXDYAVJXDK-JZYPVNQISA-N 2 1 357.542 2.835 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCC4)[C@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811518196 995162621 /nfs/dbraw/zinc/16/26/21/995162621.db2.gz GSDMGGMAYZBFTC-LEWJYISDSA-N 2 1 355.526 2.972 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)cc2)CC1 ZINC000824695648 997058094 /nfs/dbraw/zinc/05/80/94/997058094.db2.gz AGEIYAZUZNJBDX-BDTNDASRSA-N 2 1 357.542 2.954 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)CC[C@H]2CCCC[N@H+]2C)[NH+](C)C)cc1 ZINC001184426893 1002611875 /nfs/dbraw/zinc/61/18/75/1002611875.db2.gz POUJKGIIBXITMR-WOJBJXKFSA-N 2 1 360.546 2.736 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccccc4[C@@H]3CO)cc2)CC1 ZINC000775699617 1003706183 /nfs/dbraw/zinc/70/61/83/1003706183.db2.gz AWWNBVASJWQLKQ-QFIPXVFZSA-N 2 1 351.494 2.530 20 10 FFCDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775657997 1004980801 /nfs/dbraw/zinc/98/08/01/1004980801.db2.gz KJOOMPIVDPDETH-UHFFFAOYSA-N 3 1 358.574 2.991 20 10 FFCDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N3CCN(C)CC3)cc2)CC1 ZINC000775657997 1004980805 /nfs/dbraw/zinc/98/08/05/1004980805.db2.gz KJOOMPIVDPDETH-UHFFFAOYSA-N 2 1 358.574 2.991 20 10 FFCDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(N3CCN(C)CC3)cc2)CC1 ZINC000775657997 1004980811 /nfs/dbraw/zinc/98/08/11/1004980811.db2.gz KJOOMPIVDPDETH-UHFFFAOYSA-N 2 1 358.574 2.991 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc(O)cc4CC3)cc2)CC1 ZINC000775666382 1005007677 /nfs/dbraw/zinc/00/76/77/1005007677.db2.gz XETZQPDDLAPQOG-UHFFFAOYSA-N 2 1 351.494 2.745 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](Cc4ccccc4)C3)cc2)CC1 ZINC000776690637 1006524647 /nfs/dbraw/zinc/52/46/47/1006524647.db2.gz GRLZIHJMXSFCIU-QHCPKHFHSA-N 2 1 365.521 2.882 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c2ncnn21 ZINC000925677195 1017813869 /nfs/dbraw/zinc/81/38/69/1017813869.db2.gz ORXZDSWFDHHEAO-JXFKEZNVSA-N 2 1 366.513 2.606 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CNc4ccccc4C3)cc2F)CC1 ZINC001118236649 1022135264 /nfs/dbraw/zinc/13/52/64/1022135264.db2.gz XFFLDAPEDLEDGQ-SFHVURJKSA-N 2 1 354.473 2.704 20 10 FFCDMP C[NH+](C)[C@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]2C1 ZINC001120070883 1023228957 /nfs/dbraw/zinc/22/89/57/1023228957.db2.gz CPVQVNSJMPUQAL-VWPQPMDRSA-N 3 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@H]([NH+](C)C)C[C@@H]4C3)cc2)CC1 ZINC001120070883 1023228961 /nfs/dbraw/zinc/22/89/61/1023228961.db2.gz CPVQVNSJMPUQAL-VWPQPMDRSA-N 2 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@H]([NH+](C)C)C[C@@H]4C3)cc2)CC1 ZINC001120070883 1023228966 /nfs/dbraw/zinc/22/89/66/1023228966.db2.gz CPVQVNSJMPUQAL-VWPQPMDRSA-N 2 1 356.558 2.601 20 10 FFCDMP CCOc1ccc(O)c(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1 ZINC000092665991 1027394007 /nfs/dbraw/zinc/39/40/07/1027394007.db2.gz CXACXAWTASMWFI-QZTJIDSGSA-N 2 1 361.530 2.781 20 10 FFCDMP c1c2c(nnc1N1CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]31)CC[NH2+]C2 ZINC001155640840 1028831375 /nfs/dbraw/zinc/83/13/75/1028831375.db2.gz OMSNAZGUKCSCNH-HKBKIPCKSA-N 2 1 365.525 2.522 20 10 FFCDMP CCOCc1cc(C[NH2+]C2CCC(N3CC[NH2+]CC3)CC2)ccc1OC ZINC000841087164 1030027414 /nfs/dbraw/zinc/02/74/14/1030027414.db2.gz JRBLJGFINAOTAO-UHFFFAOYSA-N 2 1 361.530 2.538 20 10 FFCDMP CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2C[NH+](Cc3ccccc3O)CC[C@@H]21 ZINC001203552625 1030762051 /nfs/dbraw/zinc/76/20/51/1030762051.db2.gz PBRJBAXYNIOFLX-AABGKKOBSA-N 2 1 354.498 2.962 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@H+](Cc3ccccc3O)CC[C@@H]21 ZINC001203552625 1030762066 /nfs/dbraw/zinc/76/20/66/1030762066.db2.gz PBRJBAXYNIOFLX-AABGKKOBSA-N 2 1 354.498 2.962 20 10 FFCDMP CC(C)[NH+]1[C@H](Cn2cccn2)C[C@@H]2C[N@@H+](Cc3ccccc3O)CC[C@@H]21 ZINC001203552625 1030762080 /nfs/dbraw/zinc/76/20/80/1030762080.db2.gz PBRJBAXYNIOFLX-AABGKKOBSA-N 2 1 354.498 2.962 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753568 1030907112 /nfs/dbraw/zinc/90/71/12/1030907112.db2.gz FKYFNVLBFUAYAN-CEWLAPEOSA-N 3 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753568 1030907124 /nfs/dbraw/zinc/90/71/24/1030907124.db2.gz FKYFNVLBFUAYAN-CEWLAPEOSA-N 2 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753568 1030907132 /nfs/dbraw/zinc/90/71/32/1030907132.db2.gz FKYFNVLBFUAYAN-CEWLAPEOSA-N 2 1 374.548 2.930 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC[C@H]3Cc3ccccc3)cc2)CC1 ZINC001139411088 1035095530 /nfs/dbraw/zinc/09/55/30/1035095530.db2.gz UGTROMPBLQRQFN-HSZRJFAPSA-N 2 1 365.521 2.882 20 10 FFCDMP CN(C)c1ccc(/C=C/C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000835052738 1035493134 /nfs/dbraw/zinc/49/31/34/1035493134.db2.gz HIESVNJOSZHDHE-IOUFHMPJSA-N 2 1 356.558 2.866 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc(Cl)cc(C)c3O)C[C@@H]1CC[NH2+]CC2 ZINC001235349489 1037495042 /nfs/dbraw/zinc/49/50/42/1037495042.db2.gz PTWWLQNZOXKELK-KXBFYZLASA-N 2 1 366.889 2.719 20 10 FFCDMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(I)cc1O ZINC001235718349 1037709529 /nfs/dbraw/zinc/70/95/29/1037709529.db2.gz ZJNSQPXFLMCMAD-UHFFFAOYSA-N 2 1 374.266 2.818 20 10 FFCDMP COCCC[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@H]1CCC[NH2+]C1 ZINC001235805998 1037756033 /nfs/dbraw/zinc/75/60/33/1037756033.db2.gz HYWZHKFMCKYSLT-IBGZPJMESA-N 2 1 373.541 2.682 20 10 FFCDMP COCCC[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@H]1CCC[NH2+]C1 ZINC001235805998 1037756048 /nfs/dbraw/zinc/75/60/48/1037756048.db2.gz HYWZHKFMCKYSLT-IBGZPJMESA-N 2 1 373.541 2.682 20 10 FFCDMP [NH3+]C1CN([C@H]2CCC[N@@H+](Cc3cc(-c4ccc(F)cc4)ccc3O)C2)C1 ZINC001236077489 1037919272 /nfs/dbraw/zinc/91/92/72/1037919272.db2.gz IFVOCQRETYESPV-FQEVSTJZSA-N 2 1 355.457 2.806 20 10 FFCDMP c1ccc(C[C@@H]2COCC[N@H+]2Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001236304690 1038035087 /nfs/dbraw/zinc/03/50/87/1038035087.db2.gz OIFWYWRKNFTUKH-JOCHJYFZSA-N 2 1 351.494 2.540 20 10 FFCDMP CCc1ccc(C[N@H+]2CCCn3cnc(COCC[NH+](C)C)c3C2)c(O)c1 ZINC001236788734 1038269257 /nfs/dbraw/zinc/26/92/57/1038269257.db2.gz NZHGGYGUKWIMFX-UHFFFAOYSA-N 2 1 372.513 2.635 20 10 FFCDMP Fc1ccc(N2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CC2)cc1 ZINC001236859881 1038313671 /nfs/dbraw/zinc/31/36/71/1038313671.db2.gz ONZVFKSKUUHIOS-UHFFFAOYSA-N 2 1 368.500 2.948 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC3(C[NH+](Cc4cccc(=O)[nH]4)C3)CC2)c1 ZINC001278615117 1038817677 /nfs/dbraw/zinc/81/76/77/1038817677.db2.gz KZSPQRCZSOZWND-UHFFFAOYSA-N 2 1 353.466 2.899 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CCC3(CC[N@@H+](CCn4ccnc4)C3)CC2)c1 ZINC001278616740 1038838606 /nfs/dbraw/zinc/83/86/06/1038838606.db2.gz BIHXWXCVVQSUNP-UHFFFAOYSA-N 2 1 354.498 2.885 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4ccc[nH]4)C3)CC2)c(O)c1 ZINC001278428921 1039234623 /nfs/dbraw/zinc/23/46/23/1039234623.db2.gz WYERAVSGRPWDRN-UHFFFAOYSA-N 2 1 357.454 2.620 20 10 FFCDMP c1ccc(C[C@H]2C[C@H](NCc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246173841 1039266739 /nfs/dbraw/zinc/26/67/39/1039266739.db2.gz MZGDPLDZJJLQDU-YADHBBJMSA-N 2 1 364.537 2.549 20 10 FFCDMP CC1(C)C=Cc2c(O)c(C[NH+]3CCN(CC[NH+]4CCCC4)CC3)ccc2O1 ZINC001249252491 1040653925 /nfs/dbraw/zinc/65/39/25/1040653925.db2.gz LNXRFZNONPPDHJ-UHFFFAOYSA-N 2 1 371.525 2.790 20 10 FFCDMP C[C@H]1C[C@@H]([NH+]2CCCC2)CN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001261182128 1041053682 /nfs/dbraw/zinc/05/36/82/1041053682.db2.gz KKHJKDCSXKZSDN-PKOBYXMFSA-N 2 1 360.521 2.636 20 10 FFCDMP Oc1ccc([C@@H](O)C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255382894 1041310854 /nfs/dbraw/zinc/31/08/54/1041310854.db2.gz YDJYRHVAUKMVSE-NQIIRXRSSA-N 2 1 356.466 2.776 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC001279532987 1043231126 /nfs/dbraw/zinc/23/11/26/1043231126.db2.gz ASLVPHJGHYXKBJ-IRLDBZIGSA-N 2 1 356.558 2.745 20 10 FFCDMP CC[N@@H+](CCCN(C)C)Cc1cccc(I)c1[O-] ZINC001237785557 1043357633 /nfs/dbraw/zinc/35/76/33/1043357633.db2.gz HBCBJSDLPQECCZ-UHFFFAOYSA-N 2 1 362.255 2.770 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1c(O)ccc(Cl)c1Cl)C2 ZINC001279676331 1043449273 /nfs/dbraw/zinc/44/92/73/1043449273.db2.gz AJJKLNJZHUKAAP-OLZOCXBDSA-N 2 1 358.313 2.767 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C2 ZINC001279676331 1043449278 /nfs/dbraw/zinc/44/92/78/1043449278.db2.gz AJJKLNJZHUKAAP-OLZOCXBDSA-N 2 1 358.313 2.767 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)cc2F)CC1 ZINC001318724659 1044840427 /nfs/dbraw/zinc/84/04/27/1044840427.db2.gz RMPANCDQNUSZPX-DBVUQKKJSA-N 2 1 361.505 2.871 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCC3SCCS3)cc2F)CC1 ZINC001329563833 1048778528 /nfs/dbraw/zinc/77/85/28/1048778528.db2.gz BCPUVDRTHQMNTJ-UHFFFAOYSA-N 2 1 355.548 2.863 20 10 FFCDMP COc1ccc(N(C)CC[N@@H+](C)Cc2ccnn2-c2cc[nH+]cc2)cc1 ZINC001330818359 1049343234 /nfs/dbraw/zinc/34/32/34/1049343234.db2.gz OOKHFERRZIEVRD-UHFFFAOYSA-N 2 1 351.454 2.844 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CO)CCc3ccccc3)cc2F)CC1 ZINC001308525384 1052465231 /nfs/dbraw/zinc/46/52/31/1052465231.db2.gz GMSNQTYWCGAJBA-HXUWFJFHSA-N 2 1 371.500 2.661 20 10 FFCDMP Cn1ccnc1[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001343927560 1052493639 /nfs/dbraw/zinc/49/36/39/1052493639.db2.gz PCNWSWZWYGWQJX-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001343927560 1052493644 /nfs/dbraw/zinc/49/36/44/1052493644.db2.gz PCNWSWZWYGWQJX-GOSISDBHSA-N 2 1 371.504 2.691 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnn(CC4CCC4)c3)cc2F)CC1 ZINC001352098329 1055189903 /nfs/dbraw/zinc/18/99/03/1055189903.db2.gz UHPVLFVIOWJSBI-UHFFFAOYSA-N 2 1 371.504 2.864 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)C[N@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC001558723789 1076063756 /nfs/dbraw/zinc/06/37/56/1076063756.db2.gz VMWIDNNSTMDKFG-NRFANRHFSA-N 2 1 368.525 2.604 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)C[N@@H+](C)Cc2ccccc2)[NH+](C)C)cc1 ZINC001558723789 1076063763 /nfs/dbraw/zinc/06/37/63/1076063763.db2.gz VMWIDNNSTMDKFG-NRFANRHFSA-N 2 1 368.525 2.604 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1O ZINC000371848261 512601704 /nfs/dbraw/zinc/60/17/04/512601704.db2.gz YNVKNMGWYUUFHV-OWCLPIDISA-N 2 1 354.878 2.738 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1O ZINC000371848261 512601706 /nfs/dbraw/zinc/60/17/06/512601706.db2.gz YNVKNMGWYUUFHV-OWCLPIDISA-N 2 1 354.878 2.738 20 10 FFCDMP COc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000377632527 512366730 /nfs/dbraw/zinc/36/67/30/512366730.db2.gz STKREOPPFMOXOC-KRWDZBQOSA-N 2 1 367.921 2.655 20 10 FFCDMP C[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cc(Br)ccc1O ZINC000282357500 510943813 /nfs/dbraw/zinc/94/38/13/510943813.db2.gz PNJQHGLLYOCJKZ-ZDUSSCGKSA-N 2 1 370.335 2.831 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1 ZINC000273420098 511524728 /nfs/dbraw/zinc/52/47/28/511524728.db2.gz RWZQLUUQIWDFSY-OAHLLOKOSA-N 2 1 372.465 2.970 20 10 FFCDMP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883120995 733338216 /nfs/dbraw/zinc/33/82/16/733338216.db2.gz TXMMYGCEXQAQQI-UHFFFAOYSA-N 2 1 351.397 2.686 20 10 FFCDMP CCc1nn(C)c(Cl)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883283775 733359941 /nfs/dbraw/zinc/35/99/41/733359941.db2.gz SNACDGZIKPKNAQ-UHFFFAOYSA-N 2 1 361.921 2.678 20 10 FFCDMP COc1cccc(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)c1O ZINC000725841685 734396055 /nfs/dbraw/zinc/39/60/55/734396055.db2.gz URPWKIPSVXHIPR-MRXNPFEDSA-N 2 1 361.511 2.541 20 10 FFCDMP CC[C@H]([NH2+]C[C@]1(COC)CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817975010 742226224 /nfs/dbraw/zinc/22/62/24/742226224.db2.gz PTXXMQATVDFFQH-HOCLYGCPSA-N 2 1 357.292 2.964 20 10 FFCDMP CN(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001177066346 1013842206 /nfs/dbraw/zinc/84/22/06/1013842206.db2.gz UFGWSPQYWPHYAZ-QFIPXVFZSA-N 2 1 370.516 2.970 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc(F)ccc2n1C ZINC000894188083 978124619 /nfs/dbraw/zinc/12/46/19/978124619.db2.gz QGCCOBTVZBQEFX-LSDHHAIUSA-N 2 1 359.445 2.820 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc(F)ccc2n1C ZINC000894188083 978124623 /nfs/dbraw/zinc/12/46/23/978124623.db2.gz QGCCOBTVZBQEFX-LSDHHAIUSA-N 2 1 359.445 2.820 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1O ZINC001206011265 1032107310 /nfs/dbraw/zinc/10/73/10/1032107310.db2.gz BDDIDKWUPGYLKO-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1O ZINC001206011266 1032107838 /nfs/dbraw/zinc/10/78/38/1032107838.db2.gz BDDIDKWUPGYLKO-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP CC(C)n1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn1 ZINC000808401211 994112136 /nfs/dbraw/zinc/11/21/36/994112136.db2.gz HMRBMTNATHVKAL-UHFFFAOYSA-N 2 1 368.529 2.681 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@](O)(C(F)(F)F)CC3)cc2)CC1 ZINC000809705600 994586192 /nfs/dbraw/zinc/58/61/92/994586192.db2.gz WEDUJKIDTDOTAE-GOSISDBHSA-N 2 1 371.447 2.718 20 10 FFCDMP Oc1ccccc1C[N@@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000903893115 1016291443 /nfs/dbraw/zinc/29/14/43/1016291443.db2.gz QNSZWNVPLKBWBG-SFHVURJKSA-N 2 1 355.486 2.853 20 10 FFCDMP COc1cccc(O)c1C[NH+]1CCN(CC[N@@H+](C)Cc2ccccc2)CC1 ZINC000769329899 1000493771 /nfs/dbraw/zinc/49/37/71/1000493771.db2.gz WELISEYFGHFYBM-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)[C@@H]3CCc4ccccc43)cc2)CC1 ZINC000775697266 1003705237 /nfs/dbraw/zinc/70/52/37/1003705237.db2.gz XZNFZRSMOZDOGO-HSZRJFAPSA-N 2 1 365.521 2.920 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721251 1003791812 /nfs/dbraw/zinc/79/18/12/1003791812.db2.gz UUFJOPPBRSYGRN-OAQYLSRUSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000775721251 1003791817 /nfs/dbraw/zinc/79/18/17/1003791817.db2.gz UUFJOPPBRSYGRN-OAQYLSRUSA-N 2 1 356.558 2.746 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCCC[C@]3(CCCC[NH2+]C3)C1)C[NH2+]CCO2 ZINC001222173939 1032801969 /nfs/dbraw/zinc/80/19/69/1032801969.db2.gz ZUVLMZYZMVSAGN-NRFANRHFSA-N 3 1 359.514 2.620 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@H](n3cc(C[NH3+])nn3)C2)cc1F ZINC000841099721 1030034722 /nfs/dbraw/zinc/03/47/22/1030034722.db2.gz NZUDNHFZWABVQP-KRWDZBQOSA-N 2 1 360.481 2.559 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203931613 1030989744 /nfs/dbraw/zinc/98/97/44/1030989744.db2.gz KCPBLWKKBSFOFZ-UNMCSNQZSA-N 2 1 357.542 2.933 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203931613 1030989757 /nfs/dbraw/zinc/98/97/57/1030989757.db2.gz KCPBLWKKBSFOFZ-UNMCSNQZSA-N 2 1 357.542 2.933 20 10 FFCDMP Cc1ccc(C[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c(O)c1 ZINC001204755976 1031428659 /nfs/dbraw/zinc/42/86/59/1031428659.db2.gz HBCIDRBRUZBVHH-UHFFFAOYSA-N 2 1 353.510 2.950 20 10 FFCDMP COc1ccc(Br)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1O ZINC001205627466 1031885446 /nfs/dbraw/zinc/88/54/46/1031885446.db2.gz PQZLSFPWICTYQZ-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP [NH3+]C[C@H]1C[N@@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC1(F)F ZINC001205769779 1031983510 /nfs/dbraw/zinc/98/35/10/1031983510.db2.gz KOFZAPUQRVKJHF-HNNXBMFYSA-N 2 1 351.441 2.507 20 10 FFCDMP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H](c2cccc(Cl)c2)[NH+](C)C)cc1 ZINC000832273568 1034693743 /nfs/dbraw/zinc/69/37/43/1034693743.db2.gz OTMPAECTTGMCST-RTBURBONSA-N 2 1 374.916 2.825 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4cc(CO)ccc4C3)cc2)CC1 ZINC001140302056 1035424910 /nfs/dbraw/zinc/42/49/10/1035424910.db2.gz IZWBXUGCSZPIHG-UHFFFAOYSA-N 2 1 365.521 2.879 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](N4CCCCC4)C3)cc2)CC1 ZINC001140304095 1035426045 /nfs/dbraw/zinc/42/60/45/1035426045.db2.gz HXKPKZBDCXGWLV-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](N4CCCCC4)C3)cc2)CC1 ZINC001140304095 1035426048 /nfs/dbraw/zinc/42/60/48/1035426048.db2.gz HXKPKZBDCXGWLV-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](c4nnc(C)o4)C3)cc2)CC1 ZINC001140306001 1035427515 /nfs/dbraw/zinc/42/75/15/1035427515.db2.gz KADQWQWBFLXHHT-IBGZPJMESA-N 2 1 369.513 2.900 20 10 FFCDMP C[NH+]1CCC2(C[NH+](Cc3ccc(I)cc3O)C2)CC1 ZINC001232979689 1036213874 /nfs/dbraw/zinc/21/38/74/1036213874.db2.gz IGGZWRWLKRLVED-UHFFFAOYSA-N 2 1 372.250 2.524 20 10 FFCDMP CCOC(=O)c1c(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)c2ccccc2n1C ZINC001233271147 1036478712 /nfs/dbraw/zinc/47/87/12/1036478712.db2.gz OLSDRKBSPHUDMI-CVEARBPZSA-N 2 1 355.482 2.739 20 10 FFCDMP CCOC(=O)c1c(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)c2ccccc2n1C ZINC001233271147 1036478719 /nfs/dbraw/zinc/47/87/19/1036478719.db2.gz OLSDRKBSPHUDMI-CVEARBPZSA-N 2 1 355.482 2.739 20 10 FFCDMP CCOC(=O)c1c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c2ccccc2n1C ZINC001233271147 1036478727 /nfs/dbraw/zinc/47/87/27/1036478727.db2.gz OLSDRKBSPHUDMI-CVEARBPZSA-N 2 1 355.482 2.739 20 10 FFCDMP CC[N@@H+](C)CCC(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1 ZINC001229523206 1036720883 /nfs/dbraw/zinc/72/08/83/1036720883.db2.gz DJGOHUFFGIGZEH-RTBURBONSA-N 2 1 361.530 2.862 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCCCC34CC[NH2+]CC4)cc2)CC1 ZINC001235190170 1037402412 /nfs/dbraw/zinc/40/24/12/1037402412.db2.gz VDKZJJLAGLJNLP-UHFFFAOYSA-N 3 1 356.558 2.937 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714023 1037704413 /nfs/dbraw/zinc/70/44/13/1037704413.db2.gz FPLYMTBLKSNNOU-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714023 1037704432 /nfs/dbraw/zinc/70/44/32/1037704432.db2.gz FPLYMTBLKSNNOU-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP C[C@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235714023 1037704452 /nfs/dbraw/zinc/70/44/52/1037704452.db2.gz FPLYMTBLKSNNOU-KRWDZBQOSA-N 2 1 367.493 2.581 20 10 FFCDMP CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235776531 1037737226 /nfs/dbraw/zinc/73/72/26/1037737226.db2.gz SWZDEGPNIJOXKI-LJQANCHMSA-N 2 1 359.514 2.792 20 10 FFCDMP CC(C)(C)OC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235776531 1037737237 /nfs/dbraw/zinc/73/72/37/1037737237.db2.gz SWZDEGPNIJOXKI-LJQANCHMSA-N 2 1 359.514 2.792 20 10 FFCDMP CCc1ccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001236787162 1038268087 /nfs/dbraw/zinc/26/80/87/1038268087.db2.gz JNVYNSZCHUXEFA-QUCCMNQESA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[N@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001236787162 1038268095 /nfs/dbraw/zinc/26/80/95/1038268095.db2.gz JNVYNSZCHUXEFA-QUCCMNQESA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001236787162 1038268103 /nfs/dbraw/zinc/26/81/03/1038268103.db2.gz JNVYNSZCHUXEFA-QUCCMNQESA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001236787162 1038268112 /nfs/dbraw/zinc/26/81/12/1038268112.db2.gz JNVYNSZCHUXEFA-QUCCMNQESA-N 2 1 354.498 2.642 20 10 FFCDMP CCc1ccc(C[NH+]2CCC([NH+]3CCC(C(=O)N(C)C)CC3)CC2)c(O)c1 ZINC001236790306 1038270769 /nfs/dbraw/zinc/27/07/69/1038270769.db2.gz VOSLEXBUARXINT-UHFFFAOYSA-N 2 1 373.541 2.719 20 10 FFCDMP C[NH+]1CCN(C(=O)C2CC[NH+](Cc3cc4ccccc4cc3O)CC2)CC1 ZINC001236831212 1038296216 /nfs/dbraw/zinc/29/62/16/1038296216.db2.gz GBAPSAHHBZPBFE-UHFFFAOYSA-N 2 1 367.493 2.531 20 10 FFCDMP CN(C)c1ccc(C[NH+]2CCC3(C[NH+](Cc4ccc[nH]4)C3)CC2)c(O)c1 ZINC001278923493 1038456581 /nfs/dbraw/zinc/45/65/81/1038456581.db2.gz FLDXSRFYZDSWFX-UHFFFAOYSA-N 2 1 354.498 2.884 20 10 FFCDMP COCCOC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N(C)C)c(C)c1 ZINC001278685906 1039763263 /nfs/dbraw/zinc/76/32/63/1039763263.db2.gz GOTYVPVMHUFMQT-IHWFROFDSA-N 2 1 361.530 2.767 20 10 FFCDMP COCCOC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N(C)C)c(C)c1 ZINC001278685906 1039763275 /nfs/dbraw/zinc/76/32/75/1039763275.db2.gz GOTYVPVMHUFMQT-IHWFROFDSA-N 2 1 361.530 2.767 20 10 FFCDMP C[C@@H]1C[C@H]([NH+]2CCCC2)CN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001261182127 1041052656 /nfs/dbraw/zinc/05/26/56/1041052656.db2.gz KKHJKDCSXKZSDN-MJGOQNOKSA-N 2 1 360.521 2.636 20 10 FFCDMP COc1cccc(C[N@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001278562237 1041179659 /nfs/dbraw/zinc/17/96/59/1041179659.db2.gz AUIRPUMECDPIIV-OAQYLSRUSA-N 2 1 361.530 2.640 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+](CCC[NH3+])Cc3ccccc3)cc2F)CC1 ZINC001261483278 1041262708 /nfs/dbraw/zinc/26/27/08/1041262708.db2.gz ORSXASVCOZBOMQ-UHFFFAOYSA-N 2 1 370.516 2.929 20 10 FFCDMP Cc1cccc(C[N@H+]2CCC[C@@]3(CC[NH+](CCn4ccnc4)C3)C2)c1O ZINC001279290439 1042985992 /nfs/dbraw/zinc/98/59/92/1042985992.db2.gz OPMHYLOZLAVPTD-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1cccc(C[NH+]2CCC[C@@]3(CC[N@H+](CCn4ccnc4)C3)C2)c1O ZINC001279290439 1042985993 /nfs/dbraw/zinc/98/59/93/1042985993.db2.gz OPMHYLOZLAVPTD-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP Cc1cccc(C[NH+]2CCC[C@@]3(CC[N@@H+](CCn4ccnc4)C3)C2)c1O ZINC001279290439 1042985996 /nfs/dbraw/zinc/98/59/96/1042985996.db2.gz OPMHYLOZLAVPTD-NRFANRHFSA-N 2 1 354.498 2.885 20 10 FFCDMP C[NH+](C)CC1CC[NH+](Cc2cccc(I)c2O)CC1 ZINC001237780847 1043352968 /nfs/dbraw/zinc/35/29/68/1043352968.db2.gz YLQJQKXLFFQUKY-UHFFFAOYSA-N 2 1 374.266 2.770 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(Br)c1 ZINC001279674346 1043445091 /nfs/dbraw/zinc/44/50/91/1043445091.db2.gz IHEKTLXJIFRYAX-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@@H]3CC[N@@H+](C)CC[C@@H]3C2)c(Br)c1 ZINC001279674346 1043445096 /nfs/dbraw/zinc/44/50/96/1043445096.db2.gz IHEKTLXJIFRYAX-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)c(Br)c1 ZINC001279674346 1043445103 /nfs/dbraw/zinc/44/51/03/1043445103.db2.gz IHEKTLXJIFRYAX-BETUJISGSA-N 2 1 369.303 2.937 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@@H+](Cc1c(O)ccc(F)c1Cl)C2 ZINC001279683606 1043462055 /nfs/dbraw/zinc/46/20/55/1043462055.db2.gz GIWXHDSGLMDUPH-UHFFFAOYSA-N 2 1 355.885 2.644 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)CCc3ccccc3)cc2F)CC1 ZINC001320047056 1045337366 /nfs/dbraw/zinc/33/73/66/1045337366.db2.gz PCPPENKUMSILFC-FQEVSTJZSA-N 2 1 371.500 2.661 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(C)CCO[C@@H]3C3CC3)cc2F)CC1 ZINC001320413567 1045403812 /nfs/dbraw/zinc/40/38/12/1045403812.db2.gz CMGUSLZYRVMVEI-RTWAWAEBSA-N 2 1 361.505 2.872 20 10 FFCDMP C[C@@H]1CC2(C[N@H+]1Cc1ccc(N3CCN(C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919361 1048095412 /nfs/dbraw/zinc/09/54/12/1048095412.db2.gz ZPIXTBBLVVSNJG-QGZVFWFLSA-N 3 1 360.521 2.542 20 10 FFCDMP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919361 1048095426 /nfs/dbraw/zinc/09/54/26/1048095426.db2.gz ZPIXTBBLVVSNJG-QGZVFWFLSA-N 3 1 360.521 2.542 20 10 FFCDMP C[C@@H]1CC2(C[N@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CC[NH2+]CC2 ZINC001327919361 1048095437 /nfs/dbraw/zinc/09/54/37/1048095437.db2.gz ZPIXTBBLVVSNJG-QGZVFWFLSA-N 3 1 360.521 2.542 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCCC[C@@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC001332340043 1048354352 /nfs/dbraw/zinc/35/43/52/1048354352.db2.gz UYXUBOWWYRWWMT-TZIWHRDSSA-N 2 1 360.521 2.684 20 10 FFCDMP CC[NH+]1CCN(CCC[NH2+]Cc2cc(C)cc(Br)c2O)CC1 ZINC001461056445 1061198791 /nfs/dbraw/zinc/19/87/91/1061198791.db2.gz SSFYLHLAKWEJNR-UHFFFAOYSA-N 2 1 370.335 2.580 20 10 FFCDMP COc1c(O)c(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000278548888 510999224 /nfs/dbraw/zinc/99/92/24/510999224.db2.gz YTBIPGLMQRXLIC-CQSZACIVSA-N 2 1 351.447 2.767 20 10 FFCDMP COc1c(O)c(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000278548888 510999226 /nfs/dbraw/zinc/99/92/26/510999226.db2.gz YTBIPGLMQRXLIC-CQSZACIVSA-N 2 1 351.447 2.767 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[NH+](C)C2CC2)C1 ZINC000444020582 514102665 /nfs/dbraw/zinc/10/26/65/514102665.db2.gz FOVQYHYDOAZYFL-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NCC[N@H+](C)C2CC2)C1 ZINC000444020582 514102673 /nfs/dbraw/zinc/10/26/73/514102673.db2.gz FOVQYHYDOAZYFL-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)NCC[N@@H+](C)C2CC2)C1 ZINC000444020582 514102681 /nfs/dbraw/zinc/10/26/81/514102681.db2.gz FOVQYHYDOAZYFL-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP C[NH2+][C@@H](C)Cc1noc(Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)n1 ZINC000572521771 518231425 /nfs/dbraw/zinc/23/14/25/518231425.db2.gz SHNSRDUKQPVGEJ-HNNXBMFYSA-N 2 1 367.497 2.990 20 10 FFCDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc(OC)ccc2O)CC1 ZINC000180547861 729218148 /nfs/dbraw/zinc/21/81/48/729218148.db2.gz RKGUQVNXSJGUAC-UHFFFAOYSA-N 2 1 350.503 2.971 20 10 FFCDMP COCCC1([NH2+]Cc2cc(C)cc(Br)c2O)CC[NH2+]CC1 ZINC000873224961 731892589 /nfs/dbraw/zinc/89/25/89/731892589.db2.gz OEOJDKFUUVQKSM-UHFFFAOYSA-N 2 1 357.292 2.711 20 10 FFCDMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H](C)C1 ZINC000839144708 746787673 /nfs/dbraw/zinc/78/76/73/746787673.db2.gz JRKPGYMCMFAHKT-KSSFIOAISA-N 2 1 353.457 2.621 20 10 FFCDMP CC[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H](C)C1 ZINC000839144708 746787676 /nfs/dbraw/zinc/78/76/76/746787676.db2.gz JRKPGYMCMFAHKT-KSSFIOAISA-N 2 1 353.457 2.621 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c1O ZINC000839183563 746797056 /nfs/dbraw/zinc/79/70/56/746797056.db2.gz YPEMIBHFMWEGEX-GFCCVEGCSA-N 2 1 357.292 2.985 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902496 748132338 /nfs/dbraw/zinc/13/23/38/748132338.db2.gz OABNKSZPCOYCAH-RCBQFDQVSA-N 2 1 354.878 2.773 20 10 FFCDMP C[NH+](C)CCN1CCC[C@@]2(CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279106863 960397658 /nfs/dbraw/zinc/39/76/58/960397658.db2.gz GPTSNHBXIRVTCE-HXUWFJFHSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+](C)CCN1CCC[C@@]2(CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279106863 960397669 /nfs/dbraw/zinc/39/76/69/960397669.db2.gz GPTSNHBXIRVTCE-HXUWFJFHSA-N 2 1 367.484 2.910 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCC[NH+](C)C2)C1 ZINC000683479818 960768314 /nfs/dbraw/zinc/76/83/14/960768314.db2.gz LUUKJYKJZLTWAM-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCC[N@H+](C)C2)C1 ZINC000683479818 960768330 /nfs/dbraw/zinc/76/83/30/960768330.db2.gz LUUKJYKJZLTWAM-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCC[N@@H+](C)C2)C1 ZINC000683479818 960768341 /nfs/dbraw/zinc/76/83/41/960768341.db2.gz LUUKJYKJZLTWAM-QGZVFWFLSA-N 2 1 368.525 2.618 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4nc[nH]c4C34CCC4)cc2)CC1 ZINC000895068484 967365091 /nfs/dbraw/zinc/36/50/91/967365091.db2.gz BORURLVLGGIYMX-UHFFFAOYSA-N 2 1 351.498 2.599 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(Br)c1 ZINC001206024980 1032111853 /nfs/dbraw/zinc/11/18/53/1032111853.db2.gz LWBYVGJYWDBUOY-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@H]([NH2+][C@@H](C)c1ccccc1O)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000879650587 1015626067 /nfs/dbraw/zinc/62/60/67/1015626067.db2.gz IKETWWAAGJMAIB-LNLFQRSKSA-N 2 1 367.493 2.822 20 10 FFCDMP CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1N[C@H](C)[C@@H]1C[NH2+]CCO1)N=[N+]=[N-] ZINC001170563404 994315744 /nfs/dbraw/zinc/31/57/44/994315744.db2.gz LWCWQTGMCYXKDP-NFVJRJMQSA-N 2 1 374.445 2.702 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1O ZINC000846141881 1000217520 /nfs/dbraw/zinc/21/75/20/1000217520.db2.gz BGTDEOPYFQHPSK-KRWDZBQOSA-N 2 1 369.509 2.999 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775725294 1003835306 /nfs/dbraw/zinc/83/53/06/1003835306.db2.gz RTYIMFQZBCKQCW-SFHVURJKSA-N 2 1 359.514 2.602 20 10 FFCDMP C[C@H](C(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+](C)Cc1ccccc1O ZINC000111235259 1006362440 /nfs/dbraw/zinc/36/24/40/1006362440.db2.gz WFDKFFHSEQJUSC-YLJYHZDGSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235259 1006362454 /nfs/dbraw/zinc/36/24/54/1006362454.db2.gz WFDKFFHSEQJUSC-YLJYHZDGSA-N 2 1 367.493 2.603 20 10 FFCDMP C[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1O ZINC000111235259 1006362467 /nfs/dbraw/zinc/36/24/67/1006362467.db2.gz WFDKFFHSEQJUSC-YLJYHZDGSA-N 2 1 367.493 2.603 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3nccn3-c3ccccc3)cc2)CC1 ZINC000883283389 1006730587 /nfs/dbraw/zinc/73/05/87/1006730587.db2.gz CXGAHHWIIQDQAU-UHFFFAOYSA-N 2 1 361.493 2.914 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc2n(n1)CCCC2 ZINC000883290700 1006736131 /nfs/dbraw/zinc/73/61/31/1006736131.db2.gz CRUXHAMUCYLKCE-KRWDZBQOSA-N 2 1 353.514 2.822 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167517 1032797653 /nfs/dbraw/zinc/79/76/53/1032797653.db2.gz NALGAQXTMSMXER-QFIPXVFZSA-N 3 1 372.557 2.548 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c2c1c(F)ccc2O ZINC000756561698 1023729342 /nfs/dbraw/zinc/72/93/42/1023729342.db2.gz HCGOTFIXGBXMRC-CZUORRHYSA-N 2 1 363.477 2.612 20 10 FFCDMP CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)[C@@H]([NH3+])CC[NH3+] ZINC001160930850 1027928347 /nfs/dbraw/zinc/92/83/47/1027928347.db2.gz UWGBKDLXKMTHRV-QFIPXVFZSA-N 2 1 363.505 2.742 20 10 FFCDMP C[N@H+]1C[C@H](COCC2CC2)[C@]2(CCN(Cc3cc(F)c(F)cc3O)C2)C1 ZINC001142517268 1030566442 /nfs/dbraw/zinc/56/64/42/1030566442.db2.gz GZUIEOVJRGDUOF-OXQOHEQNSA-N 2 1 366.452 2.851 20 10 FFCDMP Oc1ccc(Cl)cc1C[N@@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001203656833 1030808134 /nfs/dbraw/zinc/80/81/34/1030808134.db2.gz ZDJZKEQBGKOTOF-UHFFFAOYSA-N 2 1 360.889 2.896 20 10 FFCDMP CC[N@@H+](C)[C@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1 ZINC000832281723 1034698983 /nfs/dbraw/zinc/69/89/83/1034698983.db2.gz VWJSDHRARUKKQD-UXHICEINSA-N 2 1 354.498 2.562 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2ccc3c(c2)OCCO3)cc(C[NH+](C)C)c1O ZINC001139253349 1035029969 /nfs/dbraw/zinc/02/99/69/1035029969.db2.gz RSVGQEZPVMPTKU-UHFFFAOYSA-N 2 1 372.465 2.866 20 10 FFCDMP CCOC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139413648 1035097325 /nfs/dbraw/zinc/09/73/25/1035097325.db2.gz XIBXVYHPTGLHPU-YLJYHZDGSA-N 2 1 359.514 2.602 20 10 FFCDMP CCOC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139413648 1035097334 /nfs/dbraw/zinc/09/73/34/1035097334.db2.gz XIBXVYHPTGLHPU-YLJYHZDGSA-N 2 1 359.514 2.602 20 10 FFCDMP COC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673250 1035194328 /nfs/dbraw/zinc/19/43/28/1035194328.db2.gz FJPAYOKCRZTHMT-LJQANCHMSA-N 2 1 373.541 2.910 20 10 FFCDMP COC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccc(N(C)C)c(C)c3)CC2)C1 ZINC001139673250 1035194329 /nfs/dbraw/zinc/19/43/29/1035194329.db2.gz FJPAYOKCRZTHMT-LJQANCHMSA-N 2 1 373.541 2.910 20 10 FFCDMP Oc1ccc(F)cc1C[N@@H+]1CCc2ncc(C[NH+]3CCCCC3)n2CC1 ZINC001140054693 1035323266 /nfs/dbraw/zinc/32/32/66/1035323266.db2.gz WTBKEOCSVMAYRT-UHFFFAOYSA-N 2 1 358.461 2.772 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cc2)CC1 ZINC001235043767 1037324726 /nfs/dbraw/zinc/32/47/26/1037324726.db2.gz HDTWUVOOADUCQG-JOCHJYFZSA-N 3 1 356.558 2.937 20 10 FFCDMP COc1ccc(N2CCOC[C@@]3(CCC[N@@H+](CC4CC[NH2+]CC4)C3)C2)cc1 ZINC001207435381 1037437168 /nfs/dbraw/zinc/43/71/68/1037437168.db2.gz MXWMAONNDUNJCI-JOCHJYFZSA-N 2 1 373.541 2.614 20 10 FFCDMP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@@H+](Cc1ccc(C)cc1O)C2 ZINC001235322482 1037475936 /nfs/dbraw/zinc/47/59/36/1037475936.db2.gz YFKUULLOAFFBAQ-SIKLNZKXSA-N 2 1 372.509 2.846 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3c(O)ccc(F)c3Cl)C[C@@H]1CC[NH2+]CC2 ZINC001235352241 1037497285 /nfs/dbraw/zinc/49/72/85/1037497285.db2.gz NHVYGMVZJBXMCR-SGTLLEGYSA-N 2 1 370.852 2.549 20 10 FFCDMP Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001235674552 1037677250 /nfs/dbraw/zinc/67/72/50/1037677250.db2.gz KADJVWZNMPTZSP-GOSISDBHSA-N 2 1 354.450 2.836 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCC[C@@H](Oc3ccccc3)C1)C[NH2+]CCO2 ZINC001235693213 1037687343 /nfs/dbraw/zinc/68/73/43/1037687343.db2.gz WCKMYSYLJFDBAM-LJQANCHMSA-N 2 1 354.450 2.918 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@@H](C[NH+]4CCCCC4)C3)cc2F)CC1 ZINC001324750452 1046205803 /nfs/dbraw/zinc/20/58/03/1046205803.db2.gz ILYBZPBBJMVEBC-FQEVSTJZSA-N 2 1 374.548 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ccncn4)CC3)cc2F)CC1 ZINC001325242415 1046433221 /nfs/dbraw/zinc/43/32/21/1046433221.db2.gz QABHFJNIPQHZDS-UHFFFAOYSA-N 2 1 369.488 2.747 20 10 FFCDMP CCOC(=O)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(C)C ZINC001327194917 1047229924 /nfs/dbraw/zinc/22/99/24/1047229924.db2.gz JBHXCFXRDBPUCV-UHFFFAOYSA-N 2 1 365.493 2.741 20 10 FFCDMP CCOC(=O)CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(C)C ZINC001327194917 1047229933 /nfs/dbraw/zinc/22/99/33/1047229933.db2.gz JBHXCFXRDBPUCV-UHFFFAOYSA-N 2 1 365.493 2.741 20 10 FFCDMP CN(C)c1cc(F)c(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1F ZINC001329155490 1048599033 /nfs/dbraw/zinc/59/90/33/1048599033.db2.gz BHUZNEMLWSKBQF-UHFFFAOYSA-N 2 1 364.440 2.656 20 10 FFCDMP CCC[N@H+](C)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001341569506 1050196967 /nfs/dbraw/zinc/19/69/67/1050196967.db2.gz PQNGAUGRPMYYFC-LJQANCHMSA-N 2 1 362.537 2.741 20 10 FFCDMP CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001341569506 1050196977 /nfs/dbraw/zinc/19/69/77/1050196977.db2.gz PQNGAUGRPMYYFC-LJQANCHMSA-N 2 1 362.537 2.741 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cc2)CC1 ZINC000849350574 1056835301 /nfs/dbraw/zinc/83/53/01/1056835301.db2.gz QUEKZBDACKIILZ-OAQYLSRUSA-N 2 1 356.558 2.650 20 10 FFCDMP C[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001472281308 1064998568 /nfs/dbraw/zinc/99/85/68/1064998568.db2.gz VBFIUUQCQZBJNV-AXVVYFOYSA-N 2 1 360.546 2.733 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3nc4c(s3)CCC4)cc2F)CC1 ZINC001560582295 1076281227 /nfs/dbraw/zinc/28/12/27/1076281227.db2.gz AHLWJIXJBHXHFE-UHFFFAOYSA-N 2 1 374.529 2.855 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)C[NH+](C)C)C1 ZINC000584521097 518380300 /nfs/dbraw/zinc/38/03/00/518380300.db2.gz FGEDJAAIFWRDQL-KRWDZBQOSA-N 2 1 370.541 2.722 20 10 FFCDMP CC[N@H+](Cc1cc(Br)ccc1O)C[C@H]1C[C@@]2(CC[NH2+]C2)CO1 ZINC000903732237 736161396 /nfs/dbraw/zinc/16/13/96/736161396.db2.gz DLZILQSMORGGCX-NVXWUHKLSA-N 2 1 369.303 2.745 20 10 FFCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)c1O ZINC000808693099 741252958 /nfs/dbraw/zinc/25/29/58/741252958.db2.gz WAPVYKFEGHJBID-ZIAGYGMSSA-N 2 1 353.894 2.592 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@@H+](C)CCCN(C)CC[NH+](C)C)c1 ZINC000809788883 741343918 /nfs/dbraw/zinc/34/39/18/741343918.db2.gz XDOYZFFAEVSFGH-UHFFFAOYSA-N 2 1 372.351 2.778 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@H+](C)CCCN(C)CC[NH+](C)C)c1 ZINC000809788883 741343922 /nfs/dbraw/zinc/34/39/22/741343922.db2.gz XDOYZFFAEVSFGH-UHFFFAOYSA-N 2 1 372.351 2.778 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1O ZINC000843125309 747777427 /nfs/dbraw/zinc/77/74/27/747777427.db2.gz RUHHKOOHCFBBLU-STQMWFEESA-N 2 1 369.303 2.985 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH+]2CCC([C@@H]3OCC[C@H]3[NH3+])CC2)c1 ZINC000843124681 747777795 /nfs/dbraw/zinc/77/77/95/747777795.db2.gz FFPDFKUSUZMILE-WBVHZDCISA-N 2 1 369.303 2.791 20 10 FFCDMP C[NH+](C)CCC[C@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCO1 ZINC000853625821 750117677 /nfs/dbraw/zinc/11/76/77/750117677.db2.gz ZCVOTJSJCZRPRK-KRWDZBQOSA-N 2 1 350.503 2.938 20 10 FFCDMP C[NH+](C)CCC[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCO1 ZINC000853625821 750117679 /nfs/dbraw/zinc/11/76/79/750117679.db2.gz ZCVOTJSJCZRPRK-KRWDZBQOSA-N 2 1 350.503 2.938 20 10 FFCDMP C[C@H](c1ccccc1)[N@@H+](CC(=O)N1CCN(C)CC1)Cc1ccccc1O ZINC000176680303 966597295 /nfs/dbraw/zinc/59/72/95/966597295.db2.gz QWXNIIDKNZQXCS-GOSISDBHSA-N 2 1 367.493 2.729 20 10 FFCDMP C[C@H](c1ccccc1)N(CC(=O)N1CCN(C)CC1)Cc1ccccc1O ZINC000176680303 966597304 /nfs/dbraw/zinc/59/73/04/966597304.db2.gz QWXNIIDKNZQXCS-GOSISDBHSA-N 2 1 367.493 2.729 20 10 FFCDMP OC1CCN(c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000876771003 1014386267 /nfs/dbraw/zinc/38/62/67/1014386267.db2.gz SISHHXBECUKUTH-FQEVSTJZSA-N 2 1 357.542 2.956 20 10 FFCDMP c1cc(N2CCCCC2)ccc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC000171924779 985427179 /nfs/dbraw/zinc/42/71/79/985427179.db2.gz QSCQBAURXFJRBQ-UHFFFAOYSA-N 2 1 356.558 2.890 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000922391156 988547872 /nfs/dbraw/zinc/54/78/72/988547872.db2.gz UCYGIXDYAVJXDK-QPSOZROKSA-N 2 1 357.542 2.835 20 10 FFCDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)CC1 ZINC000809755207 994604780 /nfs/dbraw/zinc/60/47/80/994604780.db2.gz ICKUMBBQWLNZDD-OAQYLSRUSA-N 3 1 356.558 2.602 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CC[C@@H](C4CC[NH+](C)CC4)C3)cc2)CC1 ZINC000809755207 994604786 /nfs/dbraw/zinc/60/47/86/994604786.db2.gz ICKUMBBQWLNZDD-OAQYLSRUSA-N 2 1 356.558 2.602 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CC[C@@H](C4CC[NH+](C)CC4)C3)cc2)CC1 ZINC000809755207 994604788 /nfs/dbraw/zinc/60/47/88/994604788.db2.gz ICKUMBBQWLNZDD-OAQYLSRUSA-N 2 1 356.558 2.602 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903878510 1016283163 /nfs/dbraw/zinc/28/31/63/1016283163.db2.gz WJLFPTFGPOQEPD-LJQANCHMSA-N 2 1 357.546 2.824 20 10 FFCDMP CC(C)[N@@H+](CC(=O)NC1CC[NH+](C(C)C)CC1)Cc1ccc(N(C)C)cc1 ZINC000734058176 999186917 /nfs/dbraw/zinc/18/69/17/999186917.db2.gz IWALQDWLLVGRRK-UHFFFAOYSA-N 2 1 374.573 2.952 20 10 FFCDMP CC(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768530145 1000285315 /nfs/dbraw/zinc/28/53/15/1000285315.db2.gz ZGIYUOASMPLVEI-HXUWFJFHSA-N 2 1 373.541 2.992 20 10 FFCDMP CC[NH+]1CCC(N2CCC[N@@H+](Cc3cc(OC)c(C)cc3O)CC2)CC1 ZINC000817373357 1007567410 /nfs/dbraw/zinc/56/74/10/1007567410.db2.gz OVTIFUOTPJGMMU-UHFFFAOYSA-N 2 1 361.530 2.701 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)CC2)cc1 ZINC000858090919 1008300188 /nfs/dbraw/zinc/30/01/88/1008300188.db2.gz VPQAAGLGJVPZEJ-IBGZPJMESA-N 2 1 374.573 2.670 20 10 FFCDMP CC1(C)[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925689927 1017819166 /nfs/dbraw/zinc/81/91/66/1017819166.db2.gz DQSQNFDOMDVQJG-CCKFTAQKSA-N 2 1 365.468 2.668 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@@H+]1Cc1cc(Cl)cc(C)c1O)CC[NH2+]CC2 ZINC001222230608 1032839538 /nfs/dbraw/zinc/83/95/38/1032839538.db2.gz BIMFXVQDJMBSML-INIZCTEOSA-N 2 1 366.889 2.861 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(C)c1O)CC[NH2+]CC2 ZINC001222230608 1032839556 /nfs/dbraw/zinc/83/95/56/1032839556.db2.gz BIMFXVQDJMBSML-INIZCTEOSA-N 2 1 366.889 2.861 20 10 FFCDMP CCOc1cccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1O ZINC000092665205 1027395117 /nfs/dbraw/zinc/39/51/17/1027395117.db2.gz AVTDYCBWXMIEOZ-QZTJIDSGSA-N 2 1 361.530 2.781 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)c(F)c2)CC1 ZINC001204742711 1031423295 /nfs/dbraw/zinc/42/32/95/1031423295.db2.gz REMMUPDGJGHGQB-UHFFFAOYSA-N 3 1 360.521 2.543 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)c(F)c2)CC1 ZINC001204742711 1031423300 /nfs/dbraw/zinc/42/33/00/1031423300.db2.gz REMMUPDGJGHGQB-UHFFFAOYSA-N 2 1 360.521 2.543 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)c(F)c2)CC1 ZINC001204742711 1031423304 /nfs/dbraw/zinc/42/33/04/1031423304.db2.gz REMMUPDGJGHGQB-UHFFFAOYSA-N 2 1 360.521 2.543 20 10 FFCDMP CCOC(=O)[C@H]1CCCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259621 1035031165 /nfs/dbraw/zinc/03/11/65/1035031165.db2.gz YXZVNSKIEYQOFG-INIZCTEOSA-N 2 1 364.486 2.628 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001140744971 1036036685 /nfs/dbraw/zinc/03/66/85/1036036685.db2.gz RHFSBMOXGUKSIG-MJGOQNOKSA-N 2 1 353.466 2.755 20 10 FFCDMP Cc1c(O)ccc(C[N@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001140744971 1036036705 /nfs/dbraw/zinc/03/67/05/1036036705.db2.gz RHFSBMOXGUKSIG-MJGOQNOKSA-N 2 1 353.466 2.755 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2C[C@H]3CC[N@H+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001140744971 1036036727 /nfs/dbraw/zinc/03/67/27/1036036727.db2.gz RHFSBMOXGUKSIG-MJGOQNOKSA-N 2 1 353.466 2.755 20 10 FFCDMP Cc1c(O)ccc(C[NH+]2C[C@H]3CC[N@@H+](Cc4ccncc4)C[C@H]3C2)c1O ZINC001140744971 1036036750 /nfs/dbraw/zinc/03/67/50/1036036750.db2.gz RHFSBMOXGUKSIG-MJGOQNOKSA-N 2 1 353.466 2.755 20 10 FFCDMP CN(C)c1ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001232839461 1036095191 /nfs/dbraw/zinc/09/51/91/1036095191.db2.gz QWHIWFHWNYJJRJ-DENIHFKCSA-N 2 1 373.541 2.639 20 10 FFCDMP C[NH+]1CCN(c2ccccc2C[N@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001140975886 1036608303 /nfs/dbraw/zinc/60/83/03/1036608303.db2.gz YZELUNNWYCZCHZ-UHFFFAOYSA-N 2 1 367.493 2.798 20 10 FFCDMP CCOC(=O)c1c(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c2ccccc2n1C ZINC001235092233 1037360603 /nfs/dbraw/zinc/36/06/03/1037360603.db2.gz IVXIIDMZISHYLL-UHFFFAOYSA-N 2 1 355.482 2.931 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3cc(Cl)c(C)cc3O)C[C@@H]1CC[NH2+]CC2 ZINC001235353239 1037499986 /nfs/dbraw/zinc/49/99/86/1037499986.db2.gz XNAFXBGTCCADDC-KXBFYZLASA-N 2 1 366.889 2.719 20 10 FFCDMP Cc1cc(Br)c([O-])c(CN2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)c1 ZINC001235409301 1037531873 /nfs/dbraw/zinc/53/18/73/1037531873.db2.gz WAXLTEJTGROOEA-ZBFHGGJFSA-N 2 1 357.267 2.987 20 10 FFCDMP COCCN1CCOC[C@]2(CCC[N@@H+](Cc3c(C)cc(C)cc3O)C2)C1 ZINC001231844984 1037942582 /nfs/dbraw/zinc/94/25/82/1037942582.db2.gz VBUCIAGYARZBRC-OAQYLSRUSA-N 2 1 362.514 2.570 20 10 FFCDMP COC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)cc(C)cc3O)CC2)C1 ZINC001231850696 1037946830 /nfs/dbraw/zinc/94/68/30/1037946830.db2.gz UCDHNBZNWQAYAI-QGZVFWFLSA-N 2 1 360.498 2.858 20 10 FFCDMP Oc1cc2c(cc1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1)C[NH2+]CCO2 ZINC001236300417 1038029887 /nfs/dbraw/zinc/02/98/87/1038029887.db2.gz AVZMILAVAXYPAI-UHFFFAOYSA-N 3 1 367.493 2.628 20 10 FFCDMP Oc1cc2c(cc1CN(Cc1ccccc1)C1CC[NH2+]CC1)C[NH2+]CCO2 ZINC001236300417 1038029895 /nfs/dbraw/zinc/02/98/95/1038029895.db2.gz AVZMILAVAXYPAI-UHFFFAOYSA-N 2 1 367.493 2.628 20 10 FFCDMP C[NH+]1CCN(c2cccc(C[N@H+]3CCCc4cc(O)c(O)cc4C3)c2)CC1 ZINC001236894648 1038340950 /nfs/dbraw/zinc/34/09/50/1038340950.db2.gz RXZMIAFNGSTFQP-UHFFFAOYSA-N 2 1 367.493 2.798 20 10 FFCDMP Cn1nccc1[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001253996356 1040499767 /nfs/dbraw/zinc/49/97/67/1040499767.db2.gz CECUTEIFWYBXLP-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001253996356 1040499774 /nfs/dbraw/zinc/49/97/74/1040499774.db2.gz CECUTEIFWYBXLP-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC2(CCC[N@@H+](CCn3ccnc3)C2)CC1 ZINC001278551293 1041109739 /nfs/dbraw/zinc/10/97/39/1041109739.db2.gz GGDPUSMEGKRJRW-UHFFFAOYSA-N 2 1 354.498 2.967 20 10 FFCDMP Oc1ccc(C[NH+]2CCC3(CCC[N@@H+](Cc4cn[nH]c4)C3)CC2)cc1O ZINC001279142166 1042916045 /nfs/dbraw/zinc/91/60/45/1042916045.db2.gz PFQQCKQCQUGWJX-UHFFFAOYSA-N 2 1 356.470 2.699 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c(Cl)c1 ZINC001279333950 1043007911 /nfs/dbraw/zinc/00/79/11/1043007911.db2.gz UTVXPISDWJMOAZ-UHFFFAOYSA-N 2 1 364.965 2.865 20 10 FFCDMP Oc1c(F)cccc1C[NH2+][C@@]12CC[C@@]([NH2+]CCn3ccnc3)(C1)CCC2 ZINC001279529404 1043228486 /nfs/dbraw/zinc/22/84/86/1043228486.db2.gz QCLZPTTUGJDDSW-UXHICEINSA-N 2 1 358.461 2.953 20 10 FFCDMP COC(=O)c1c(C[N@@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c2ccccc2n1C ZINC001279595452 1043312065 /nfs/dbraw/zinc/31/20/65/1043312065.db2.gz LXYOHSYSPYLZNX-IYBDPMFKSA-N 2 1 355.482 2.739 20 10 FFCDMP COC(=O)c1c(C[NH+]2C[C@@H]3CC[N@@H+](C)CC[C@@H]3C2)c2ccccc2n1C ZINC001279595452 1043312066 /nfs/dbraw/zinc/31/20/66/1043312066.db2.gz LXYOHSYSPYLZNX-IYBDPMFKSA-N 2 1 355.482 2.739 20 10 FFCDMP COC(=O)c1c(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)c2ccccc2n1C ZINC001279595452 1043312074 /nfs/dbraw/zinc/31/20/74/1043312074.db2.gz LXYOHSYSPYLZNX-IYBDPMFKSA-N 2 1 355.482 2.739 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc(Cl)cc(C)c3O)CC[C@@H]2C1 ZINC001237686575 1043312645 /nfs/dbraw/zinc/31/26/45/1043312645.db2.gz RYTIMCKZRFZSFJ-CRAIPNDOSA-N 2 1 368.905 2.523 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc(Cl)cc(C)c3O)CC[C@@H]2C1 ZINC001237686575 1043312652 /nfs/dbraw/zinc/31/26/52/1043312652.db2.gz RYTIMCKZRFZSFJ-CRAIPNDOSA-N 2 1 368.905 2.523 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc(Cl)cc(C)c3O)CC[C@@H]2C1 ZINC001237686575 1043312658 /nfs/dbraw/zinc/31/26/58/1043312658.db2.gz RYTIMCKZRFZSFJ-CRAIPNDOSA-N 2 1 368.905 2.523 20 10 FFCDMP COc1cc(C)c(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001279667765 1043433311 /nfs/dbraw/zinc/43/33/11/1043433311.db2.gz PKNXQYKMHBYTSB-UHFFFAOYSA-N 2 1 361.530 2.559 20 10 FFCDMP COc1cc(C)c(C[NH+]2CCC3(CCN(CC[NH+](C)C)C3)CC2)c(O)c1 ZINC001279667765 1043433316 /nfs/dbraw/zinc/43/33/16/1043433316.db2.gz PKNXQYKMHBYTSB-UHFFFAOYSA-N 2 1 361.530 2.559 20 10 FFCDMP COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319835915 1045282475 /nfs/dbraw/zinc/28/24/75/1045282475.db2.gz GXGMGJOPIHVGND-HXUWFJFHSA-N 2 1 371.500 2.925 20 10 FFCDMP COCC[N@H+](Cc1ccc(Br)cc1O)CC1CC[NH+](C)CC1 ZINC001308894181 1052513824 /nfs/dbraw/zinc/51/38/24/1052513824.db2.gz AXQZWGBSTRULAP-UHFFFAOYSA-N 2 1 371.319 2.945 20 10 FFCDMP COc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C[C@H]4CCCO4)CC3)C2)cc1 ZINC000848552449 1060263932 /nfs/dbraw/zinc/26/39/32/1060263932.db2.gz BMDHXBSDAODKEA-PGRDOPGGSA-N 2 1 373.541 2.755 20 10 FFCDMP COc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C[C@@H]4CCCO4)CC3)C2)cc1 ZINC000848552448 1060265816 /nfs/dbraw/zinc/26/58/16/1060265816.db2.gz BMDHXBSDAODKEA-GCJKJVERSA-N 2 1 373.541 2.755 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cc1C ZINC001474019580 1065441865 /nfs/dbraw/zinc/44/18/65/1065441865.db2.gz DQLNEPJZDBIPOO-NHCUHLMSSA-N 2 1 354.494 2.976 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1C ZINC001474019580 1065441871 /nfs/dbraw/zinc/44/18/71/1065441871.db2.gz DQLNEPJZDBIPOO-NHCUHLMSSA-N 2 1 354.494 2.976 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CSCCS3)cc2F)CC1 ZINC001474042879 1065445291 /nfs/dbraw/zinc/44/52/91/1065445291.db2.gz QDUQRQDBZXCBJC-HNNXBMFYSA-N 2 1 355.548 2.516 20 10 FFCDMP CCC[NH2+][C@@H](C)C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001577551308 1078375809 /nfs/dbraw/zinc/37/58/09/1078375809.db2.gz OSIAMALYUUOUDH-BBRMVZONSA-N 2 1 353.894 2.514 20 10 FFCDMP CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722855 1076063264 /nfs/dbraw/zinc/06/32/64/1076063264.db2.gz DFEIEGXJVXGLSG-AZUAARDMSA-N 2 1 360.546 2.594 20 10 FFCDMP COc1cc(Br)cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1O ZINC000725846020 734395956 /nfs/dbraw/zinc/39/59/56/734395956.db2.gz UMFJXVVGZYUDFZ-UONOGXRCSA-N 2 1 355.276 2.880 20 10 FFCDMP CC(C)[NH+]1CCC([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1 ZINC000839146831 746788288 /nfs/dbraw/zinc/78/82/88/746788288.db2.gz WRRPSXHMSSLVRU-UHFFFAOYSA-N 2 1 353.457 2.764 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(Br)c3O)CC2)C1 ZINC000841102868 747270240 /nfs/dbraw/zinc/27/02/40/747270240.db2.gz ANJVBDXAUPZILU-GDBMZVCRSA-N 2 1 369.303 2.873 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c1 ZINC000843125071 747777878 /nfs/dbraw/zinc/77/78/78/747777878.db2.gz MWOFPRPKYOIZMS-CQSZACIVSA-N 2 1 369.303 2.650 20 10 FFCDMP Cc1cc(Br)c(O)c(C[N@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c1 ZINC000843125071 747777886 /nfs/dbraw/zinc/77/78/86/747777886.db2.gz MWOFPRPKYOIZMS-CQSZACIVSA-N 2 1 369.303 2.650 20 10 FFCDMP COc1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1Cn1cccn1 ZINC000873016150 1013350171 /nfs/dbraw/zinc/35/01/71/1013350171.db2.gz HFMCNDMWNVBNGM-UHFFFAOYSA-N 2 1 354.498 2.904 20 10 FFCDMP Oc1cc(F)c(F)cc1C[NH+]1CCC2(CC[N@H+](Cc3cn[nH]c3)C2)CC1 ZINC001279107826 962949860 /nfs/dbraw/zinc/94/98/60/962949860.db2.gz RWFHEKIXLGBKQB-UHFFFAOYSA-N 2 1 362.424 2.882 20 10 FFCDMP Oc1cc(F)c(F)cc1C[NH+]1CCC2(CC[N@@H+](Cc3cn[nH]c3)C2)CC1 ZINC001279107826 962949875 /nfs/dbraw/zinc/94/98/75/962949875.db2.gz RWFHEKIXLGBKQB-UHFFFAOYSA-N 2 1 362.424 2.882 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOc4cc(O)ccc4C3)cc2)CC1 ZINC000809704823 994587546 /nfs/dbraw/zinc/58/75/46/994587546.db2.gz IAOBZVCMKFAVHY-UHFFFAOYSA-N 2 1 353.466 2.539 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCOc4cc(O)ccc4C3)cc2)CC1 ZINC000809704823 994587555 /nfs/dbraw/zinc/58/75/55/994587555.db2.gz IAOBZVCMKFAVHY-UHFFFAOYSA-N 2 1 353.466 2.539 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515480 998627217 /nfs/dbraw/zinc/62/72/17/998627217.db2.gz PZLQAGGYENWKOX-IAGOWNOFSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515480 998627220 /nfs/dbraw/zinc/62/72/20/998627220.db2.gz PZLQAGGYENWKOX-IAGOWNOFSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515480 998627225 /nfs/dbraw/zinc/62/72/25/998627225.db2.gz PZLQAGGYENWKOX-IAGOWNOFSA-N 2 1 354.450 2.757 20 10 FFCDMP C[C@H]1CC[N@H+](Cc2cccc(I)c2O)CC[C@@H]1C[NH3+] ZINC001205651462 1004637326 /nfs/dbraw/zinc/63/73/26/1004637326.db2.gz FLNPOUKSSJBKHF-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2cccc(I)c2O)CC[C@@H]1C[NH3+] ZINC001205651462 1004637330 /nfs/dbraw/zinc/63/73/30/1004637330.db2.gz FLNPOUKSSJBKHF-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1CC[N@H+](Cc2cccc(I)c2O)CC[C@@H]1C[NH3+] ZINC001205651464 1004637387 /nfs/dbraw/zinc/63/73/87/1004637387.db2.gz FLNPOUKSSJBKHF-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H]1CC[N@@H+](Cc2cccc(I)c2O)CC[C@@H]1C[NH3+] ZINC001205651464 1004637390 /nfs/dbraw/zinc/63/73/90/1004637390.db2.gz FLNPOUKSSJBKHF-VXGBXAGGSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677364 1005003678 /nfs/dbraw/zinc/00/36/78/1005003678.db2.gz ALYUPMOOZROXIG-AQNXPRMDSA-N 2 1 358.574 2.894 20 10 FFCDMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001201625549 1005245592 /nfs/dbraw/zinc/24/55/92/1005245592.db2.gz BNNVBCLYPYCLCH-OAQYLSRUSA-N 2 1 352.478 2.868 20 10 FFCDMP CCN1CCC([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000775420939 1007848324 /nfs/dbraw/zinc/84/83/24/1007848324.db2.gz HARMBUXSOREHRB-UHFFFAOYSA-N 2 1 356.558 2.793 20 10 FFCDMP C[N@H+](CCOCC[NH3+])CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000863554667 1010253426 /nfs/dbraw/zinc/25/34/26/1010253426.db2.gz DZGZIRXKPLULIG-UHFFFAOYSA-N 2 1 355.442 2.948 20 10 FFCDMP C[N@@H+](CCOCC[NH3+])CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 ZINC000863554667 1010253433 /nfs/dbraw/zinc/25/34/33/1010253433.db2.gz DZGZIRXKPLULIG-UHFFFAOYSA-N 2 1 355.442 2.948 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3Cc4c[nH]nc4CC(C)(C)C3)cc2)CC1 ZINC000828013789 1032579272 /nfs/dbraw/zinc/57/92/72/1032579272.db2.gz KOJUURSOEBGWCV-UHFFFAOYSA-N 2 1 353.514 2.746 20 10 FFCDMP C[C@@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc(C(F)(F)F)c1O ZINC000925852996 1017875135 /nfs/dbraw/zinc/87/51/35/1017875135.db2.gz XNHGHNCZFOKNBR-NEPJUHHUSA-N 2 1 372.387 2.747 20 10 FFCDMP CCOC(=O)c1c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222148068 1032787733 /nfs/dbraw/zinc/78/77/33/1032787733.db2.gz IXGNANNUKMZFMX-OAQYLSRUSA-N 2 1 355.482 2.931 20 10 FFCDMP CCOC(=O)c1c(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222148068 1032787739 /nfs/dbraw/zinc/78/77/39/1032787739.db2.gz IXGNANNUKMZFMX-OAQYLSRUSA-N 2 1 355.482 2.931 20 10 FFCDMP C[C@@H](CC[NH+](C)C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001150353246 1031703880 /nfs/dbraw/zinc/70/38/80/1031703880.db2.gz CRRRYPYBVMVUCF-WMLDXEAASA-N 2 1 367.921 2.714 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1O ZINC001205627465 1031884580 /nfs/dbraw/zinc/88/45/80/1031884580.db2.gz PQZLSFPWICTYQZ-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cc1Br ZINC001205638274 1031896364 /nfs/dbraw/zinc/89/63/64/1031896364.db2.gz LVAZEYYOJNZBHH-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001205690985 1031938188 /nfs/dbraw/zinc/93/81/88/1031938188.db2.gz ZTSKNPYJALYQIG-OAQYLSRUSA-N 2 1 356.466 2.647 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139259181 1035032328 /nfs/dbraw/zinc/03/23/28/1035032328.db2.gz LPEDXHVTSWCVRZ-SFHVURJKSA-N 2 1 357.454 2.511 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC(C4CC[NH+](C)CC4)CC3)cc2)CC1 ZINC001139409302 1035094251 /nfs/dbraw/zinc/09/42/51/1035094251.db2.gz HFKAYYJLMGIJJP-UHFFFAOYSA-N 2 1 370.585 2.992 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCN(C)c4ncccc4C3)cc2)CC1 ZINC001140305447 1035427475 /nfs/dbraw/zinc/42/74/75/1035427475.db2.gz YYCDOVVFOJVPJB-UHFFFAOYSA-N 2 1 365.525 2.676 20 10 FFCDMP CCCC[N@H+](CC(=O)OCC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306830 1035428251 /nfs/dbraw/zinc/42/82/51/1035428251.db2.gz YTKSUBBHKYMUKN-UHFFFAOYSA-N 2 1 361.530 2.994 20 10 FFCDMP CCCC[N@@H+](CC(=O)OCC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306830 1035428252 /nfs/dbraw/zinc/42/82/52/1035428252.db2.gz YTKSUBBHKYMUKN-UHFFFAOYSA-N 2 1 361.530 2.994 20 10 FFCDMP CCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309875 1035429715 /nfs/dbraw/zinc/42/97/15/1035429715.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP CCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309875 1035429716 /nfs/dbraw/zinc/42/97/16/1035429716.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP CCC[NH+]1C[C@@H]2C[N@H+](Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@@H]2C1 ZINC001140309875 1035429719 /nfs/dbraw/zinc/42/97/19/1035429719.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 3 1 356.558 2.602 20 10 FFCDMP CCC[N@H+]1C[C@H]2CN(Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@H]2C1 ZINC001140309875 1035429720 /nfs/dbraw/zinc/42/97/20/1035429720.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 2 1 356.558 2.602 20 10 FFCDMP CCC[N@@H+]1C[C@H]2CN(Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@H]2C1 ZINC001140309875 1035429722 /nfs/dbraw/zinc/42/97/22/1035429722.db2.gz XZPADNBKTOLSGF-OYRHEFFESA-N 2 1 356.558 2.602 20 10 FFCDMP CN(C)c1ccc(CN2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093284 /nfs/dbraw/zinc/09/32/84/1036093284.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 1 373.541 2.781 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093303 /nfs/dbraw/zinc/09/33/03/1036093303.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 1 373.541 2.781 20 10 FFCDMP CN(C)c1ccc(C[N@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093325 /nfs/dbraw/zinc/09/33/25/1036093325.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 1 373.541 2.781 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093340 /nfs/dbraw/zinc/09/33/40/1036093340.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 1 373.541 2.781 20 10 FFCDMP CN(C)c1ccc(C[NH+]2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c(O)c1 ZINC001232839255 1036093353 /nfs/dbraw/zinc/09/33/53/1036093353.db2.gz ZEPXJOHRVUTWLY-SIKLNZKXSA-N 2 1 373.541 2.781 20 10 FFCDMP Oc1cc(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)cc(O)c1O ZINC001233012661 1036247651 /nfs/dbraw/zinc/24/76/51/1036247651.db2.gz MLPSLKHLSLNZNU-UHFFFAOYSA-N 2 1 369.465 2.687 20 10 FFCDMP Oc1ccc(F)c(F)c1C[NH+]1CCC(COCC[NH+]2CCCC2)CC1 ZINC001233331734 1036538006 /nfs/dbraw/zinc/53/80/06/1036538006.db2.gz IZBQYXIHRMEBRJ-UHFFFAOYSA-N 2 1 354.441 2.995 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(N4CCCC4)cc3)C[C@@H]1CC[NH2+]CC2 ZINC001235349283 1037495685 /nfs/dbraw/zinc/49/56/85/1037495685.db2.gz LRQXMNSBZNGCQD-UGKGYDQZSA-N 2 1 371.525 2.652 20 10 FFCDMP CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235767956 1037729649 /nfs/dbraw/zinc/72/96/49/1037729649.db2.gz BRMNIZDPOSFXHT-MRXNPFEDSA-N 2 1 362.470 2.570 20 10 FFCDMP CC(C)(C)OC(=O)[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235767956 1037729666 /nfs/dbraw/zinc/72/96/66/1037729666.db2.gz BRMNIZDPOSFXHT-MRXNPFEDSA-N 2 1 362.470 2.570 20 10 FFCDMP Cc1ccc([C@]2(C)C[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)CCO2)cc1 ZINC001235948385 1037850465 /nfs/dbraw/zinc/85/04/65/1037850465.db2.gz MXTQUROUJLMPOZ-QFIPXVFZSA-N 2 1 368.477 2.930 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@H](N3CC(C[NH3+])C3)C2)cc1 ZINC001236078739 1037919717 /nfs/dbraw/zinc/91/97/17/1037919717.db2.gz JPHDZRQGEYMGAW-QFIPXVFZSA-N 2 1 352.526 2.949 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]C[C@@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256521036 1038541596 /nfs/dbraw/zinc/54/15/96/1038541596.db2.gz XNNOWYHZQMBZDO-FQELHTAISA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]C[C@@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256521036 1038541601 /nfs/dbraw/zinc/54/16/01/1038541601.db2.gz XNNOWYHZQMBZDO-FQELHTAISA-N 2 1 356.466 2.774 20 10 FFCDMP CN(C)CC[N@H+]1CCC2(C1)CC[NH+](Cc1c(O)cccc1Cl)CC2 ZINC001278491664 1039894644 /nfs/dbraw/zinc/89/46/44/1039894644.db2.gz YEBHTRPVAJARDQ-UHFFFAOYSA-N 2 1 351.922 2.895 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2CCC[C@]3(CCN(Cc4cn[nH]c4)C3)C2)c1 ZINC001278571142 1041217214 /nfs/dbraw/zinc/21/72/14/1041217214.db2.gz PCYJUGWSXJKIHH-FQEVSTJZSA-N 2 1 356.470 2.612 20 10 FFCDMP Cc1ncsc1C[NH+]1CC2(C1)CC[NH+](Cc1ccc(O)c(O)c1)CC2 ZINC001279141884 1042916102 /nfs/dbraw/zinc/91/61/02/1042916102.db2.gz JNTKSDURPGSYLL-UHFFFAOYSA-N 2 1 359.495 2.961 20 10 FFCDMP Cc1cccc(O)c1C[N@@H+]1CC[C@@H]2[C@H]1CCC(=O)N2CC1CC[NH+](C)CC1 ZINC001237487915 1043200566 /nfs/dbraw/zinc/20/05/66/1043200566.db2.gz GCQFTBXPZDPRFE-WOJBJXKFSA-N 2 1 371.525 2.608 20 10 FFCDMP CC(C)CC[C@](C)(O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001318664629 1044798135 /nfs/dbraw/zinc/79/81/35/1044798135.db2.gz ZLWNHQPBIWFYJQ-FQEVSTJZSA-N 2 1 351.510 2.854 20 10 FFCDMP COc1ccc(C[N@@H+](C)Cc2ccc(N3CCN(C)CC3)c(F)c2)cc1O ZINC001319933520 1045306684 /nfs/dbraw/zinc/30/66/84/1045306684.db2.gz VAMBLRRKWAPHDV-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP COc1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1O ZINC001319933520 1045306699 /nfs/dbraw/zinc/30/66/99/1045306699.db2.gz VAMBLRRKWAPHDV-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc4c[nH]nc4c3)cc2F)CC1 ZINC001323360923 1045560257 /nfs/dbraw/zinc/56/02/57/1045560257.db2.gz CURUEYUCOUJZJF-UHFFFAOYSA-N 2 1 367.472 2.786 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H](O)C[C@H]3c3ccccc3)cc2F)CC1 ZINC001331397781 1047913686 /nfs/dbraw/zinc/91/36/86/1047913686.db2.gz FLLARMMAIKDCNV-KNQAVFIVSA-N 2 1 369.484 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H](O)C[C@H]3c3ccccc3)cc2F)CC1 ZINC001331397781 1047913694 /nfs/dbraw/zinc/91/36/94/1047913694.db2.gz FLLARMMAIKDCNV-KNQAVFIVSA-N 2 1 369.484 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)OCC[NH2+]C4)cc2F)CC1 ZINC001330167549 1049065882 /nfs/dbraw/zinc/06/58/82/1049065882.db2.gz DMAYANLBTNPSQJ-UHFFFAOYSA-N 2 1 370.472 2.672 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c3OCCO4)cc2F)CC1 ZINC001343057732 1051674771 /nfs/dbraw/zinc/67/47/71/1051674771.db2.gz IVWKCOJJBYHWJH-UHFFFAOYSA-N 2 1 371.456 2.639 20 10 FFCDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@@H](C)C1 ZINC001334956362 1053165264 /nfs/dbraw/zinc/16/52/64/1053165264.db2.gz PGWCRUSPMBWRAF-RDJZCZTQSA-N 2 1 366.502 2.636 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)Nc1ccccc1 ZINC001200365690 1056488797 /nfs/dbraw/zinc/48/87/97/1056488797.db2.gz NEBSCHZAOAEYFC-INIZCTEOSA-N 2 1 370.472 2.694 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(=O)N(C)C)cc1 ZINC001473970723 1065429349 /nfs/dbraw/zinc/42/93/49/1065429349.db2.gz ZLDMBYZNYHOFAV-FQEVSTJZSA-N 2 1 360.546 2.565 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(=O)N(C)C)cc1 ZINC001473970723 1065429352 /nfs/dbraw/zinc/42/93/52/1065429352.db2.gz ZLDMBYZNYHOFAV-FQEVSTJZSA-N 2 1 360.546 2.565 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066518 508038750 /nfs/dbraw/zinc/03/87/50/508038750.db2.gz JWBQLYQBLVSSJW-KNQAVFIVSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066518 508038752 /nfs/dbraw/zinc/03/87/52/508038752.db2.gz JWBQLYQBLVSSJW-KNQAVFIVSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066518 508038755 /nfs/dbraw/zinc/03/87/55/508038755.db2.gz JWBQLYQBLVSSJW-KNQAVFIVSA-N 2 1 355.526 2.972 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)C[C@H]2C)C1 ZINC000444231399 514162700 /nfs/dbraw/zinc/16/27/00/514162700.db2.gz DPZFZAAMKPKWED-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)C[C@H]2C)C1 ZINC000444231399 514162708 /nfs/dbraw/zinc/16/27/08/514162708.db2.gz DPZFZAAMKPKWED-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@H+](C)C[C@H]2C)C1 ZINC000444231399 514162714 /nfs/dbraw/zinc/16/27/14/514162714.db2.gz DPZFZAAMKPKWED-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@@H+](C)C[C@H]2C)C1 ZINC000444231399 514162721 /nfs/dbraw/zinc/16/27/21/514162721.db2.gz DPZFZAAMKPKWED-QGZVFWFLSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)C[C@@H]2C)C1 ZINC000444231398 514162772 /nfs/dbraw/zinc/16/27/72/514162772.db2.gz DPZFZAAMKPKWED-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CC[NH+](C)C[C@@H]2C)C1 ZINC000444231398 514162777 /nfs/dbraw/zinc/16/27/77/514162777.db2.gz DPZFZAAMKPKWED-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@H+](C)C[C@@H]2C)C1 ZINC000444231398 514162782 /nfs/dbraw/zinc/16/27/82/514162782.db2.gz DPZFZAAMKPKWED-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CC[N@@H+](C)C[C@@H]2C)C1 ZINC000444231398 514162785 /nfs/dbraw/zinc/16/27/85/514162785.db2.gz DPZFZAAMKPKWED-KRWDZBQOSA-N 2 1 368.525 2.570 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC[C@H](C)[NH+](C)C)C1 ZINC000617758419 520705085 /nfs/dbraw/zinc/70/50/85/520705085.db2.gz OYIFTLQQEIYLMX-KRWDZBQOSA-N 2 1 370.541 2.864 20 10 FFCDMP C[NH2+]C1(CNC(=O)Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)CCC1 ZINC000630004430 522579113 /nfs/dbraw/zinc/57/91/13/522579113.db2.gz XVWOIUMFJDPYAO-UHFFFAOYSA-N 2 1 368.525 2.666 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1O ZINC000858245390 730420721 /nfs/dbraw/zinc/42/07/21/730420721.db2.gz RVZDVVLCJROWEA-LBPRGKRZSA-N 2 1 357.292 2.985 20 10 FFCDMP C[NH+]1CCN([C@H](C[NH2+]Cc2ccc3c(c2)CCO3)c2cccs2)CC1 ZINC000917392884 737755603 /nfs/dbraw/zinc/75/56/03/737755603.db2.gz RTPPHCQVSMOYBE-GOSISDBHSA-N 2 1 357.523 2.761 20 10 FFCDMP CC(=O)c1cc(Cl)cc(C[NH+]2CCC3(CO[C@@H](C[NH3+])C3)CC2)c1O ZINC000923455694 738285595 /nfs/dbraw/zinc/28/55/95/738285595.db2.gz MIHHMYNRYNNEAG-OAHLLOKOSA-N 2 1 352.862 2.578 20 10 FFCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)c1O ZINC000808696392 741252974 /nfs/dbraw/zinc/25/29/74/741252974.db2.gz VNEAWNOESQECEX-AWEZNQCLSA-N 2 1 367.921 2.947 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901918 748131848 /nfs/dbraw/zinc/13/18/48/748131848.db2.gz IWIDOMYMRZTBGS-XGWLTEMNSA-N 2 1 369.303 2.873 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1O ZINC001205996038 1032100015 /nfs/dbraw/zinc/10/00/15/1032100015.db2.gz UBZLOASGUMMLBV-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206011531 1032108024 /nfs/dbraw/zinc/10/80/24/1032108024.db2.gz DGPJJNKOOHXZKZ-RDJZCZTQSA-N 2 1 351.922 2.983 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(O)cc1Br ZINC001206025645 1032112844 /nfs/dbraw/zinc/11/28/44/1032112844.db2.gz OPQHEGFPEZRGIR-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP CC[N@@H+](CC(=O)N1CCCCCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809713765 994589907 /nfs/dbraw/zinc/58/99/07/994589907.db2.gz LFNOWCSJVKFOMB-UHFFFAOYSA-N 2 1 372.557 2.663 20 10 FFCDMP COc1ccc([C@H](C[NH3+])C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)cc1 ZINC000844221190 997714350 /nfs/dbraw/zinc/71/43/50/997714350.db2.gz AESJJIVHKPOAGR-LJQANCHMSA-N 2 1 369.509 2.958 20 10 FFCDMP Oc1ccc(Br)cc1CNc1[nH+]cccc1N1CC[NH2+]CC1 ZINC001171174073 998459623 /nfs/dbraw/zinc/45/96/23/998459623.db2.gz GJYTWVRGHPPUTE-UHFFFAOYSA-N 2 1 363.259 2.571 20 10 FFCDMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccccc2O)C2CCCC2)CC1 ZINC000733613163 999028132 /nfs/dbraw/zinc/02/81/32/999028132.db2.gz AXICFJCULVABSW-UHFFFAOYSA-N 2 1 359.514 2.737 20 10 FFCDMP CC(C)[N@@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc(N(C)C)cc1 ZINC000903884135 1016287346 /nfs/dbraw/zinc/28/73/46/1016287346.db2.gz SMWUZPCIXPRRNY-IBGZPJMESA-N 2 1 356.518 2.679 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)CC[C@@H]2CCCC[N@H+]2C)[NH+](C)C)cc1 ZINC001184426888 1002611557 /nfs/dbraw/zinc/61/15/57/1002611557.db2.gz POUJKGIIBXITMR-PMACEKPBSA-N 2 1 360.546 2.736 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)ccc1O ZINC000775647837 1004922303 /nfs/dbraw/zinc/92/23/03/1004922303.db2.gz CMLCOLXNUDEWMB-UHFFFAOYSA-N 2 1 355.482 2.785 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](NC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000775648792 1004931492 /nfs/dbraw/zinc/93/14/92/1004931492.db2.gz XKAYQHDXTKCKTR-GOSISDBHSA-N 2 1 374.529 2.537 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850508069 1005819250 /nfs/dbraw/zinc/81/92/50/1005819250.db2.gz KDGYCNHDYQUEST-YJBOKZPZSA-N 2 1 356.466 2.818 20 10 FFCDMP Cn1ncc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c1Cl ZINC000815133172 1006526659 /nfs/dbraw/zinc/52/66/59/1006526659.db2.gz GJOLBAWENSPTHC-UHFFFAOYSA-N 2 1 373.932 2.895 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@](O)(c4ccc(F)cc4)C3)cc2)CC1 ZINC000777439481 1011293285 /nfs/dbraw/zinc/29/32/85/1011293285.db2.gz HZSPTAAADDUHKZ-JOCHJYFZSA-N 2 1 369.484 2.671 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC([NH2+]C2CCN(CC(F)(F)F)CC2)CC1 ZINC001173664514 1012851308 /nfs/dbraw/zinc/85/13/08/1012851308.db2.gz VBUOYJHYWGHQBH-UHFFFAOYSA-N 2 1 371.447 2.973 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@H+]1Cc1c(C)n(C)c3ccccc31)CC[NH2+]CC2 ZINC001222220826 1032832908 /nfs/dbraw/zinc/83/29/08/1032832908.db2.gz HQAVYXWOZNIYHA-FQEVSTJZSA-N 2 1 369.509 2.994 20 10 FFCDMP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001116565356 1021287998 /nfs/dbraw/zinc/28/79/98/1021287998.db2.gz PWPHRPWJULUIRW-WBVHZDCISA-N 2 1 359.514 2.781 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(O)ccc4C3)cc2F)CC1 ZINC001116824456 1021438692 /nfs/dbraw/zinc/43/86/92/1021438692.db2.gz XANDGDPKJKTATA-LJQANCHMSA-N 2 1 369.484 2.930 20 10 FFCDMP Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)c1 ZINC001117642202 1021791554 /nfs/dbraw/zinc/79/15/54/1021791554.db2.gz VEGWVMXOLSNKNO-SFHVURJKSA-N 2 1 357.477 2.529 20 10 FFCDMP Cc1cnn([C@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)c1 ZINC001117642202 1021791563 /nfs/dbraw/zinc/79/15/63/1021791563.db2.gz VEGWVMXOLSNKNO-SFHVURJKSA-N 2 1 357.477 2.529 20 10 FFCDMP CN(C)c1ccc([C@@H]([NH3+])CNCc2ccc(N3CCOCC3)c(F)c2)cc1 ZINC000841041204 1029996294 /nfs/dbraw/zinc/99/62/94/1029996294.db2.gz BVFIIJVAOZGMDA-FQEVSTJZSA-N 2 1 372.488 2.518 20 10 FFCDMP COc1ccc(O)c(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1 ZINC001203673382 1030822698 /nfs/dbraw/zinc/82/26/98/1030822698.db2.gz XDYMKGKGTUOLOV-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2C[C@H]3CC[NH+](Cc4ccncc4)C[C@H]3C2)c1 ZINC001203673382 1030822713 /nfs/dbraw/zinc/82/27/13/1030822713.db2.gz XDYMKGKGTUOLOV-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(O)c(C[NH+]2C[C@H]3CC[N@H+](Cc4ccncc4)C[C@H]3C2)c1 ZINC001203673382 1030822730 /nfs/dbraw/zinc/82/27/30/1030822730.db2.gz XDYMKGKGTUOLOV-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP COc1ccc(O)c(C[NH+]2C[C@H]3CC[N@@H+](Cc4ccncc4)C[C@H]3C2)c1 ZINC001203673382 1030822748 /nfs/dbraw/zinc/82/27/48/1030822748.db2.gz XDYMKGKGTUOLOV-MJGOQNOKSA-N 2 1 353.466 2.750 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753585 1030906871 /nfs/dbraw/zinc/90/68/71/1030906871.db2.gz FKYFNVLBFUAYAN-TYPHKJRUSA-N 3 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753585 1030906885 /nfs/dbraw/zinc/90/68/85/1030906885.db2.gz FKYFNVLBFUAYAN-TYPHKJRUSA-N 2 1 374.548 2.930 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@H]43)cc2F)CC1 ZINC000796753585 1030906901 /nfs/dbraw/zinc/90/69/01/1030906901.db2.gz FKYFNVLBFUAYAN-TYPHKJRUSA-N 2 1 374.548 2.930 20 10 FFCDMP CCCN(CCC)c1ccc(C[N@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)cc1 ZINC000843048279 1031159348 /nfs/dbraw/zinc/15/93/48/1031159348.db2.gz WVKKZUXBHYMIIC-LJQANCHMSA-N 2 1 360.546 2.600 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128883 1031196182 /nfs/dbraw/zinc/19/61/82/1031196182.db2.gz YIXGTLZIKMJBAJ-OALUTQOASA-N 2 1 361.505 2.874 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CC4(C3)CC[N@@H+](CC3CC3)C4)cc2)CC1 ZINC001140303710 1035426349 /nfs/dbraw/zinc/42/63/49/1035426349.db2.gz QWJLJCGQXKACEF-UHFFFAOYSA-N 2 1 368.569 2.746 20 10 FFCDMP Cc1ccc(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccncc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949954 1036545071 /nfs/dbraw/zinc/54/50/71/1036545071.db2.gz LCNGOGAYDOTAJA-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccncc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949954 1036545081 /nfs/dbraw/zinc/54/50/81/1036545081.db2.gz LCNGOGAYDOTAJA-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccncc4)CCO[C@@H]3C2)c(O)c1 ZINC001140949954 1036545090 /nfs/dbraw/zinc/54/50/90/1036545090.db2.gz LCNGOGAYDOTAJA-IFMALSPDSA-N 2 1 367.493 2.819 20 10 FFCDMP FC(F)(F)[C@]12C[NH2+]C[C@H]1C[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235231054 1037424230 /nfs/dbraw/zinc/42/42/30/1037424230.db2.gz MYPGIMALIQJIFH-HKUYNNGSSA-N 2 1 365.443 2.969 20 10 FFCDMP FC(F)(F)[C@]12C[NH2+]C[C@H]1C[N@@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235231054 1037424237 /nfs/dbraw/zinc/42/42/37/1037424237.db2.gz MYPGIMALIQJIFH-HKUYNNGSSA-N 2 1 365.443 2.969 20 10 FFCDMP Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235423696 1037541412 /nfs/dbraw/zinc/54/14/12/1037541412.db2.gz GJFKMRLIVCSYRZ-ROUUACIJSA-N 2 1 361.505 2.874 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001235693086 1037689231 /nfs/dbraw/zinc/68/92/31/1037689231.db2.gz RCLOVJLMUISFOI-OAQYLSRUSA-N 2 1 367.493 2.845 20 10 FFCDMP CCOC(=O)c1cc2c(cc(C)[nH+]c2-c2cnn(CCC[NH+](C)C)c2)n1C ZINC001236150448 1037952032 /nfs/dbraw/zinc/95/20/32/1037952032.db2.gz XIBMTGWJYOZPJC-UHFFFAOYSA-N 2 1 369.469 2.874 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1Br ZINC001236321885 1038044363 /nfs/dbraw/zinc/04/43/63/1038044363.db2.gz OUOGLKRUGFNPOV-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP COc1ccc2c(c1)C[N@H+](Cc1cc3c(cc1O)OCC[NH2+]C3)CCC2 ZINC001236433496 1038086554 /nfs/dbraw/zinc/08/65/54/1038086554.db2.gz IWNJYMUGBJURKJ-UHFFFAOYSA-N 2 1 354.450 2.831 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001237110498 1038446521 /nfs/dbraw/zinc/44/65/21/1038446521.db2.gz FEUIUWKKAIIKAR-LSDHHAIUSA-N 2 1 373.419 2.501 20 10 FFCDMP CCOC(=O)[C@]1(C)CCCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001209845937 1039260191 /nfs/dbraw/zinc/26/01/91/1039260191.db2.gz PNLLZHHCGKZLCR-OAQYLSRUSA-N 2 1 359.514 2.652 20 10 FFCDMP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c(O)c1 ZINC001249201222 1040626450 /nfs/dbraw/zinc/62/64/50/1040626450.db2.gz LBDDXYPMAOKXEI-LJQANCHMSA-N 2 1 360.498 2.948 20 10 FFCDMP C[N@H+]1CCC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001254510235 1040759733 /nfs/dbraw/zinc/75/97/33/1040759733.db2.gz UAIUJWAJKNWZOM-IPHXSNPTSA-N 2 1 355.482 2.913 20 10 FFCDMP C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001261182126 1041053111 /nfs/dbraw/zinc/05/31/11/1041053111.db2.gz KKHJKDCSXKZSDN-IEBWSBKVSA-N 2 1 360.521 2.636 20 10 FFCDMP CCOC(=O)[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC12C[NH2+]C2 ZINC001237428549 1043155063 /nfs/dbraw/zinc/15/50/63/1043155063.db2.gz AYHJIOROMQVLAD-GFCCVEGCSA-N 2 1 373.280 2.674 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC12C[NH2+]C2 ZINC001237428549 1043155064 /nfs/dbraw/zinc/15/50/64/1043155064.db2.gz AYHJIOROMQVLAD-GFCCVEGCSA-N 2 1 373.280 2.674 20 10 FFCDMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3Cl)C[C@H]2CC1 ZINC001279657041 1043414929 /nfs/dbraw/zinc/41/49/29/1043414929.db2.gz GGMNKVVAICTXCP-CALCHBBNSA-N 2 1 363.933 2.950 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3Cl)C[C@H]2CC1 ZINC001279657041 1043414939 /nfs/dbraw/zinc/41/49/39/1043414939.db2.gz GGMNKVVAICTXCP-CALCHBBNSA-N 2 1 363.933 2.950 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3Cl)C[C@H]2CC1 ZINC001279657041 1043414946 /nfs/dbraw/zinc/41/49/46/1043414946.db2.gz GGMNKVVAICTXCP-CALCHBBNSA-N 2 1 363.933 2.950 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)cc2F)CC1 ZINC001318724661 1044839236 /nfs/dbraw/zinc/83/92/36/1044839236.db2.gz RMPANCDQNUSZPX-PWIZWCRZSA-N 2 1 361.505 2.871 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@H]3C[NH+]3CCCC3)cc2F)CC1 ZINC001319947360 1045310190 /nfs/dbraw/zinc/31/01/90/1045310190.db2.gz KPENFXVUESWVKD-IBGZPJMESA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCCN3C3CC3)cc2F)CC1 ZINC001320798264 1045470711 /nfs/dbraw/zinc/47/07/11/1045470711.db2.gz AYBVVYFFHIZFCN-IBGZPJMESA-N 2 1 360.521 2.684 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001322573829 1046138492 /nfs/dbraw/zinc/13/84/92/1046138492.db2.gz CEBLPGFMXNQABJ-UHFFFAOYSA-N 2 1 374.548 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001322573829 1046138498 /nfs/dbraw/zinc/13/84/98/1046138498.db2.gz CEBLPGFMXNQABJ-UHFFFAOYSA-N 3 1 374.548 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2F)CC1 ZINC001322573829 1046138500 /nfs/dbraw/zinc/13/85/00/1046138500.db2.gz CEBLPGFMXNQABJ-UHFFFAOYSA-N 3 1 374.548 2.885 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCN4CCCC[C@H]34)cc2F)CC1 ZINC001329113374 1048581348 /nfs/dbraw/zinc/58/13/48/1048581348.db2.gz JPZVYMRKBCITCX-PZJWPPBQSA-N 2 1 360.521 2.684 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769727 1051689903 /nfs/dbraw/zinc/68/99/03/1051689903.db2.gz ZFVHTKKODYQKHE-SFTDATJTSA-N 2 1 372.557 2.879 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3C[C@@H](c4ccccc4)[C@H]([NH3+])C3)cc2F)CC1 ZINC001349326098 1055192583 /nfs/dbraw/zinc/19/25/83/1055192583.db2.gz SYPYZLPYSHNGRH-PZJWPPBQSA-N 2 1 368.500 2.504 20 10 FFCDMP Cc1noc(C)c1C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001200639696 1058901615 /nfs/dbraw/zinc/90/16/15/1058901615.db2.gz JSSAYHUIOPZJKL-AWEZNQCLSA-N 2 1 360.477 2.903 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)C[N@@H+](C)C(C)C)C2)cc1C ZINC001479494692 1062484405 /nfs/dbraw/zinc/48/44/05/1062484405.db2.gz KTWTVEGWEGLDBD-RBUKOAKNSA-N 2 1 361.530 2.718 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]2CCC[C@H]21 ZINC000375785954 512505555 /nfs/dbraw/zinc/50/55/55/512505555.db2.gz CPFQATZMWZXYSJ-BHIFYINESA-N 2 1 357.542 2.858 20 10 FFCDMP CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263737 728729346 /nfs/dbraw/zinc/72/93/46/728729346.db2.gz FSLQNYCSAUXYQY-AEFFLSMTSA-N 2 1 367.921 2.712 20 10 FFCDMP CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263737 728729347 /nfs/dbraw/zinc/72/93/47/728729347.db2.gz FSLQNYCSAUXYQY-AEFFLSMTSA-N 2 1 367.921 2.712 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3c(Cl)n[nH]c3C3CC3)cc2)CC1 ZINC000922332490 738123223 /nfs/dbraw/zinc/12/32/23/738123223.db2.gz GXLFGZXQLSWTHG-UHFFFAOYSA-N 2 1 359.905 2.982 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1O ZINC000843059183 747757580 /nfs/dbraw/zinc/75/75/80/747757580.db2.gz FNXMXIARYOLRTI-LEWSCRJBSA-N 2 1 355.276 2.723 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1O ZINC000843059182 747757757 /nfs/dbraw/zinc/75/77/57/747757757.db2.gz FNXMXIARYOLRTI-GDLCADMTSA-N 2 1 355.276 2.723 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781454 1014391217 /nfs/dbraw/zinc/39/12/17/1014391217.db2.gz LTYUPTDJRWPICM-FQEVSTJZSA-N 2 1 357.542 2.811 20 10 FFCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781454 1014391224 /nfs/dbraw/zinc/39/12/24/1014391224.db2.gz LTYUPTDJRWPICM-FQEVSTJZSA-N 2 1 357.542 2.811 20 10 FFCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876781454 1014391236 /nfs/dbraw/zinc/39/12/36/1014391236.db2.gz LTYUPTDJRWPICM-FQEVSTJZSA-N 2 1 357.542 2.811 20 10 FFCDMP Cc1noc(C[C@@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)n1 ZINC000897579000 982310037 /nfs/dbraw/zinc/31/00/37/982310037.db2.gz LQWVCWBTJLXYFB-IBGZPJMESA-N 2 1 369.513 2.585 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(Br)c1 ZINC001206024977 1032112519 /nfs/dbraw/zinc/11/25/19/1032112519.db2.gz LWBYVGJYWDBUOY-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1ccc(N2CCN(CCNc3nc(C)nc(C)c3C)CC2)cc1 ZINC000761886860 987961929 /nfs/dbraw/zinc/96/19/29/987961929.db2.gz MZMOHFCJPSCSQE-UHFFFAOYSA-N 2 1 355.486 2.645 20 10 FFCDMP COc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)CCO2 ZINC000824910412 997134274 /nfs/dbraw/zinc/13/42/74/997134274.db2.gz WKUJUDNQATTWJX-UHFFFAOYSA-N 2 1 367.493 2.842 20 10 FFCDMP COc1ccc2c(c1)C[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)CCO2 ZINC000824910412 997134279 /nfs/dbraw/zinc/13/42/79/997134279.db2.gz WKUJUDNQATTWJX-UHFFFAOYSA-N 2 1 367.493 2.842 20 10 FFCDMP O=C(C[N@H+](Cc1ccccc1O)C1CCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000731845595 998271754 /nfs/dbraw/zinc/27/17/54/998271754.db2.gz FOZBYJLUFUBGHB-UHFFFAOYSA-N 2 1 371.525 2.880 20 10 FFCDMP CN(C)c1ccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000850357756 1005811015 /nfs/dbraw/zinc/81/10/15/1005811015.db2.gz ULRBINCKYKMRBP-LJQANCHMSA-N 2 1 357.473 2.748 20 10 FFCDMP C[C@@H]1CCC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1CCC[NH3+] ZINC000852759991 1006171291 /nfs/dbraw/zinc/17/12/91/1006171291.db2.gz SVBFSAHAHJPUEH-YLJYHZDGSA-N 2 1 360.546 2.550 20 10 FFCDMP Fc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1N1CCOCC1 ZINC000853094167 1006295421 /nfs/dbraw/zinc/29/54/21/1006295421.db2.gz ZQOLNAQGIWVEMA-IBGZPJMESA-N 2 1 361.505 2.874 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC000809750456 1013019576 /nfs/dbraw/zinc/01/95/76/1013019576.db2.gz XCKGYUJEONFFLH-IBGZPJMESA-N 2 1 373.541 2.992 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)cc2)CC1 ZINC001222314085 1032887276 /nfs/dbraw/zinc/88/72/76/1032887276.db2.gz BXHGMCQMWCXYDA-QFIPXVFZSA-N 3 1 356.558 2.937 20 10 FFCDMP COc1cccc(C[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)c1O ZINC000093104979 1027606525 /nfs/dbraw/zinc/60/65/25/1027606525.db2.gz FZXQTDSXPWILQO-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@H](C(=O)OC)CC[C@H]3C)cc2)CC1 ZINC001140302003 1035425128 /nfs/dbraw/zinc/42/51/28/1035425128.db2.gz HEPGLZLGFQWBIL-IEBWSBKVSA-N 2 1 359.514 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@](C)(C(=O)OC)C3)cc2)CC1 ZINC001140303841 1035426018 /nfs/dbraw/zinc/42/60/18/1035426018.db2.gz BNROVDFICJMJPA-OAQYLSRUSA-N 2 1 359.514 2.604 20 10 FFCDMP C[NH+](C)CC(=O)N[C@@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996414 1037287516 /nfs/dbraw/zinc/28/75/16/1037287516.db2.gz CLELSUKILPNNND-LJQANCHMSA-N 2 1 367.493 2.701 20 10 FFCDMP C[NH+](C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996414 1037287525 /nfs/dbraw/zinc/28/75/25/1037287525.db2.gz CLELSUKILPNNND-LJQANCHMSA-N 2 1 367.493 2.701 20 10 FFCDMP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@@H+](Cc1cc(C)ccc1O)C2 ZINC001235319301 1037474604 /nfs/dbraw/zinc/47/46/04/1037474604.db2.gz AETCDKSBIOYCFV-SIKLNZKXSA-N 2 1 372.509 2.846 20 10 FFCDMP C[C@@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCO1 ZINC001235962116 1037861815 /nfs/dbraw/zinc/86/18/15/1037861815.db2.gz JHZCDKIYGDYXPI-QFIPXVFZSA-N 2 1 369.484 2.983 20 10 FFCDMP COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236114068 1037938199 /nfs/dbraw/zinc/93/81/99/1037938199.db2.gz ZLTZQYYMMLKOHV-KRWDZBQOSA-N 2 1 369.509 2.873 20 10 FFCDMP COc1ccc(N2CC[NH+](Cc3cc4c(s3)C[NH2+]CC4)CC2)c(OC)c1 ZINC001236410661 1038076057 /nfs/dbraw/zinc/07/60/57/1038076057.db2.gz IPILMSKEDRBJFT-UHFFFAOYSA-N 2 1 373.522 2.733 20 10 FFCDMP Oc1cc(O)c(CC[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255388000 1041313786 /nfs/dbraw/zinc/31/37/86/1041313786.db2.gz XCOVWESMVWOLNN-SFHVURJKSA-N 2 1 356.466 2.990 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1O ZINC001262110065 1041563525 /nfs/dbraw/zinc/56/35/25/1041563525.db2.gz PMRVPWQUUKLGIJ-UHFFFAOYSA-N 2 1 369.509 2.746 20 10 FFCDMP Oc1c(F)cccc1C[N@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279530342 1043229389 /nfs/dbraw/zinc/22/93/89/1043229389.db2.gz ZGIWWVPLYJGBBC-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1c(F)cccc1C[N@@H+]1C[C@@H]2CC[NH+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279530342 1043229401 /nfs/dbraw/zinc/22/94/01/1043229401.db2.gz ZGIWWVPLYJGBBC-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1c(F)cccc1C[NH+]1C[C@@H]2CC[N@@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279530342 1043229414 /nfs/dbraw/zinc/22/94/14/1043229414.db2.gz ZGIWWVPLYJGBBC-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP Oc1c(F)cccc1C[NH+]1C[C@@H]2CC[N@H+](CCn3ccnc3)CC[C@@H]2C1 ZINC001279530342 1043229426 /nfs/dbraw/zinc/22/94/26/1043229426.db2.gz ZGIWWVPLYJGBBC-CALCHBBNSA-N 2 1 358.461 2.572 20 10 FFCDMP COc1cc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c(OC)c1 ZINC001237675178 1043303907 /nfs/dbraw/zinc/30/39/07/1043303907.db2.gz BCQBRTAHNAURIC-RTBURBONSA-N 2 1 368.477 2.973 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1c(O)cccc1OC(F)(F)F ZINC001279680614 1043456738 /nfs/dbraw/zinc/45/67/38/1043456738.db2.gz FEUIUWKKAIIKAR-GJZGRUSLSA-N 2 1 373.419 2.501 20 10 FFCDMP Oc1cc(C[NH2+][C@@]23CC[C@@]([NH2+]Cc4ccc[nH]4)(C2)CCC3)cc(O)c1O ZINC001279682745 1043459587 /nfs/dbraw/zinc/45/95/87/1043459587.db2.gz VRXXOTDFROPNPY-VQTJNVASSA-N 2 1 357.454 2.856 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]4(CCC[NH+](C)C4)C3)cc2)CC1 ZINC001279709568 1043510263 /nfs/dbraw/zinc/51/02/63/1043510263.db2.gz HKAGTLVZQSYIJM-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC[C@]4(CCC[N@H+](C)C4)C3)cc2)CC1 ZINC001279709568 1043510273 /nfs/dbraw/zinc/51/02/73/1043510273.db2.gz HKAGTLVZQSYIJM-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC[C@]4(CCC[N@@H+](C)C4)C3)cc2)CC1 ZINC001279709568 1043510282 /nfs/dbraw/zinc/51/02/82/1043510282.db2.gz HKAGTLVZQSYIJM-QFIPXVFZSA-N 3 1 356.558 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)CCO[C@@H]3C3CC3)cc2F)CC1 ZINC001320413566 1045403971 /nfs/dbraw/zinc/40/39/71/1045403971.db2.gz CMGUSLZYRVMVEI-NHCUHLMSSA-N 2 1 361.505 2.872 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@](C)(O)c3ccsc3)cc2F)CC1 ZINC001329251385 1048635754 /nfs/dbraw/zinc/63/57/54/1048635754.db2.gz DSTLRACXBXGVFJ-IBGZPJMESA-N 2 1 363.502 2.636 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cc(N)ccc43)cc2F)CC1 ZINC001329353550 1048681606 /nfs/dbraw/zinc/68/16/06/1048681606.db2.gz GFMNWAMYTWKSLM-FQEVSTJZSA-N 2 1 354.473 2.937 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCC[C@H]([NH+]4CCCC4)C3)cc2F)CC1 ZINC001341540421 1050169319 /nfs/dbraw/zinc/16/93/19/1050169319.db2.gz SYXRKOMDEGNAER-IBGZPJMESA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@@H]([NH+]4CCCCC4)C3)cc2F)CC1 ZINC001337033494 1054425563 /nfs/dbraw/zinc/42/55/63/1054425563.db2.gz VRIVKDCLWORUMZ-LJQANCHMSA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4ccon4)CC3)cc2F)CC1 ZINC001350710326 1055905234 /nfs/dbraw/zinc/90/52/34/1055905234.db2.gz FZSZAEFTDWQMBV-UHFFFAOYSA-N 2 1 358.461 2.945 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC000273617810 511552697 /nfs/dbraw/zinc/55/26/97/511552697.db2.gz YAPZPCFOJIYHGN-MDKPJZGXSA-N 2 1 370.493 2.934 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC000273617810 511552704 /nfs/dbraw/zinc/55/27/04/511552704.db2.gz YAPZPCFOJIYHGN-MDKPJZGXSA-N 2 1 370.493 2.934 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000375786513 512506616 /nfs/dbraw/zinc/50/66/16/512506616.db2.gz MSVKTZYLUJLQNL-IHPCNDPISA-N 2 1 361.505 2.749 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)CC[NH+](C)C)C1 ZINC000444245529 514166704 /nfs/dbraw/zinc/16/67/04/514166704.db2.gz XPIMQFLQMCAZIG-KRWDZBQOSA-N 2 1 370.541 2.864 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N(C)CCC[NH+](C)C)C1 ZINC000571027422 518890875 /nfs/dbraw/zinc/89/08/75/518890875.db2.gz JIFWMCRLFXGGET-UHFFFAOYSA-N 2 1 370.541 2.818 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NC2CC([NH+](C)C)C2)C1 ZINC000622008575 523210674 /nfs/dbraw/zinc/21/06/74/523210674.db2.gz UGJXVGTXWDQNPG-UHFFFAOYSA-N 2 1 368.525 2.617 20 10 FFCDMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1(C)C ZINC000858176272 730418778 /nfs/dbraw/zinc/41/87/78/730418778.db2.gz SJSJOLNXHXOLOE-OAHLLOKOSA-N 2 1 353.457 2.764 20 10 FFCDMP C[N@H+]1CC[C@@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1(C)C ZINC000858176272 730418780 /nfs/dbraw/zinc/41/87/80/730418780.db2.gz SJSJOLNXHXOLOE-OAHLLOKOSA-N 2 1 353.457 2.764 20 10 FFCDMP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)c(F)c1 ZINC000925781708 738529319 /nfs/dbraw/zinc/52/93/19/738529319.db2.gz ZTGNVJVZWFESPA-UKRRQHHQSA-N 2 1 357.420 2.558 20 10 FFCDMP COCC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)CC1CC[NH+](C)CC1 ZINC000879125114 732650908 /nfs/dbraw/zinc/65/09/08/732650908.db2.gz PPJVKEUGBXCTOA-UHFFFAOYSA-N 2 1 352.450 2.524 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CCCN2CCC[N@@H+](C)CC2)c1 ZINC000781629577 738642495 /nfs/dbraw/zinc/64/24/95/738642495.db2.gz JXXGQUYMVZOKPC-UHFFFAOYSA-N 2 1 370.335 2.580 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH2+]CCCN2CCC[N@H+](C)CC2)c1 ZINC000781629577 738642496 /nfs/dbraw/zinc/64/24/96/738642496.db2.gz JXXGQUYMVZOKPC-UHFFFAOYSA-N 2 1 370.335 2.580 20 10 FFCDMP CC[N@H+](Cc1cc(Br)ccc1O)C[C@@H]1C[C@]2(CC[NH2+]C2)CO1 ZINC000903732238 736161263 /nfs/dbraw/zinc/16/12/63/736161263.db2.gz DLZILQSMORGGCX-RDJZCZTQSA-N 2 1 369.303 2.745 20 10 FFCDMP Cc1cc(Br)cc(C[N@H+](C)CCCN(C)CC[NH+](C)C)c1O ZINC000809787409 741343998 /nfs/dbraw/zinc/34/39/98/741343998.db2.gz CDOAXWPVBDKJFZ-UHFFFAOYSA-N 2 1 372.351 2.778 20 10 FFCDMP CC[C@H]([NH2+]C[C@@]1(COC)CCC[NH2+]1)c1cc(Br)ccc1O ZINC000817975009 742225983 /nfs/dbraw/zinc/22/59/83/742225983.db2.gz PTXXMQATVDFFQH-GOEBONIOSA-N 2 1 357.292 2.964 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)cc2)CC1 ZINC000895608117 970783058 /nfs/dbraw/zinc/78/30/58/970783058.db2.gz XSHUWTIJJVLXAI-UHFFFAOYSA-N 2 1 365.525 2.592 20 10 FFCDMP OCC[NH2+]C1CC[NH+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC000873218105 1013430738 /nfs/dbraw/zinc/43/07/38/1013430738.db2.gz YNMJQBMZUOIVMG-UHFFFAOYSA-N 2 1 356.466 2.518 20 10 FFCDMP COC[C@]1(C[NH2+]Cc2ccc(OCc3ccccc3)cc2O)CCC[NH2+]1 ZINC000841067939 979164556 /nfs/dbraw/zinc/16/45/56/979164556.db2.gz QUAQLOGAQORFKZ-OAQYLSRUSA-N 2 1 356.466 2.829 20 10 FFCDMP CCOc1cccc(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1O ZINC000922394143 988556509 /nfs/dbraw/zinc/55/65/09/988556509.db2.gz VNDSXXHFBSHVFO-DEPWHIHDSA-N 2 1 362.514 2.750 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1O ZINC000846144561 1000218832 /nfs/dbraw/zinc/21/88/32/1000218832.db2.gz LFUIFQMOXYZWAO-IIBYNOLFSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000846144561 1000218840 /nfs/dbraw/zinc/21/88/40/1000218840.db2.gz LFUIFQMOXYZWAO-IIBYNOLFSA-N 2 1 356.466 2.688 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000775652622 1004959200 /nfs/dbraw/zinc/95/92/00/1004959200.db2.gz OFSOZMNTZNPIQV-UHFFFAOYSA-N 2 1 354.454 2.979 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](Cc4ccccc4)C3)cc2)CC1 ZINC000776690622 1006523943 /nfs/dbraw/zinc/52/39/43/1006523943.db2.gz GRLZIHJMXSFCIU-HSZRJFAPSA-N 2 1 365.521 2.882 20 10 FFCDMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(I)cc2O)CC1 ZINC001206319003 1032222924 /nfs/dbraw/zinc/22/29/24/1032222924.db2.gz XGZXGERQRPSCSL-HNNXBMFYSA-N 2 1 374.266 2.948 20 10 FFCDMP Cn1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)c(Cl)n1 ZINC000856776497 1007973686 /nfs/dbraw/zinc/97/36/86/1007973686.db2.gz TZABKYZNEPLMEF-UHFFFAOYSA-N 2 1 373.932 2.895 20 10 FFCDMP C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177830548 1008761207 /nfs/dbraw/zinc/76/12/07/1008761207.db2.gz XRKVVYBIATXJCB-UWJYYQICSA-N 2 1 371.500 2.832 20 10 FFCDMP Oc1ccc(-c2ccc(F)cc2)cc1C[N@H+]1CCN[C@H]2CC[NH2+]CC[C@@H]21 ZINC001222510914 1033020968 /nfs/dbraw/zinc/02/09/68/1033020968.db2.gz KIOKWBVDRHLMLG-PMACEKPBSA-N 2 1 355.457 2.724 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CNc4ccccc4C3)cc2F)CC1 ZINC001118236640 1022135486 /nfs/dbraw/zinc/13/54/86/1022135486.db2.gz XFFLDAPEDLEDGQ-GOSISDBHSA-N 2 1 354.473 2.704 20 10 FFCDMP CCOc1cccc(C[N@@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1O ZINC001203608323 1030783586 /nfs/dbraw/zinc/78/35/86/1030783586.db2.gz LZAMWWQVQLSXQY-HDICACEKSA-N 2 1 353.466 2.750 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cc(OC)ccc1O)C2 ZINC001203671920 1030818294 /nfs/dbraw/zinc/81/82/94/1030818294.db2.gz ZCLDCUMSQQPOCR-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](Cc1cc(OC)ccc1O)C2 ZINC001203671920 1030818322 /nfs/dbraw/zinc/81/83/22/1030818322.db2.gz ZCLDCUMSQQPOCR-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1cc(OC)ccc1O)C2 ZINC001203671920 1030818346 /nfs/dbraw/zinc/81/83/46/1030818346.db2.gz ZCLDCUMSQQPOCR-RXVVDRJESA-N 2 1 360.498 2.581 20 10 FFCDMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205579647 1031849036 /nfs/dbraw/zinc/84/90/36/1031849036.db2.gz PPVDWNRICKNGCI-GOSISDBHSA-N 2 1 355.885 2.830 20 10 FFCDMP C[C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC[N@H+]1Cc1ccccc1 ZINC001236072682 1037914535 /nfs/dbraw/zinc/91/45/35/1037914535.db2.gz VLTHCSRKXBCVNO-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCN1Cc1ccccc1 ZINC001236072682 1037914546 /nfs/dbraw/zinc/91/45/46/1037914546.db2.gz VLTHCSRKXBCVNO-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCN1Cc1ccccc1 ZINC001236072682 1037914558 /nfs/dbraw/zinc/91/45/58/1037914558.db2.gz VLTHCSRKXBCVNO-FQEVSTJZSA-N 2 1 364.537 2.803 20 10 FFCDMP Cc1cc(C[N@H+]2CCC[C@@H](N3CC(C[NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236081144 1037923528 /nfs/dbraw/zinc/92/35/28/1037923528.db2.gz YZVSDYYFKCFJJW-JOCHJYFZSA-N 2 1 352.526 2.949 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001236433430 1038086819 /nfs/dbraw/zinc/08/68/19/1038086819.db2.gz ICHJUJPIZKYQFO-HXUWFJFHSA-N 2 1 359.514 2.583 20 10 FFCDMP Cc1cccnc1O[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236535418 1038122773 /nfs/dbraw/zinc/12/27/73/1038122773.db2.gz HJHSENZJRORSGG-OAQYLSRUSA-N 2 1 366.509 2.843 20 10 FFCDMP CCc1ccc(C[NH+]2CCC([N@@H+]3CCC[C@H](C(=O)OC)C3)CC2)c(O)c1 ZINC001236787616 1038268811 /nfs/dbraw/zinc/26/88/11/1038268811.db2.gz IRMOCPOBVUAHHC-SFHVURJKSA-N 2 1 360.498 2.804 20 10 FFCDMP CCc1ccc(C[NH+]2CCC([N@H+]3CCC[C@H](C(=O)OC)C3)CC2)c(O)c1 ZINC001236787616 1038268817 /nfs/dbraw/zinc/26/88/17/1038268817.db2.gz IRMOCPOBVUAHHC-SFHVURJKSA-N 2 1 360.498 2.804 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4cccnc4)C3)c(F)c2)CC1 ZINC001236941215 1038370429 /nfs/dbraw/zinc/37/04/29/1038370429.db2.gz YEOIJZWGOTWXDD-FQEVSTJZSA-N 2 1 370.472 2.626 20 10 FFCDMP Fc1cccc(O[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)c1 ZINC001236949237 1038375077 /nfs/dbraw/zinc/37/50/77/1038375077.db2.gz GUPOZVDKCAOMBL-OAQYLSRUSA-N 2 1 355.457 2.889 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C)C2)cc1 ZINC001209520254 1038948563 /nfs/dbraw/zinc/94/85/63/1038948563.db2.gz SNOFUECMIWWMIL-HXUWFJFHSA-N 2 1 368.525 2.736 20 10 FFCDMP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@H](NC(=O)C[NH+](C)C)C2)cc1 ZINC001209520254 1038948585 /nfs/dbraw/zinc/94/85/85/1038948585.db2.gz SNOFUECMIWWMIL-HXUWFJFHSA-N 2 1 368.525 2.736 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCN[C@H]3CC[NH2+][C@H](C(C)C)C3)CC2)cc1 ZINC001246185120 1039267646 /nfs/dbraw/zinc/26/76/46/1039267646.db2.gz SFBFQWJTAWPANX-UGKGYDQZSA-N 2 1 374.573 2.574 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3COCc4ccccc43)cc2F)CC1 ZINC001261376298 1041199016 /nfs/dbraw/zinc/19/90/16/1041199016.db2.gz MCJDIMNJGYZLEJ-HXUWFJFHSA-N 2 1 355.457 2.939 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1 ZINC001278571427 1041217038 /nfs/dbraw/zinc/21/70/38/1041217038.db2.gz RLAXYPYPVJCPCW-OAQYLSRUSA-N 2 1 361.530 2.640 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@H+](Cc1c(C)cccc1O)CCC2 ZINC001237488825 1043202802 /nfs/dbraw/zinc/20/28/02/1043202802.db2.gz RQJWTPBYARUWHN-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP COc1cc(C)c(C[NH+]2CCC3(C[NH+](Cc4cn[nH]c4)C3)CC2)c(O)c1 ZINC001279668018 1043434275 /nfs/dbraw/zinc/43/42/75/1043434275.db2.gz SVCDXAZFXCQHGC-UHFFFAOYSA-N 2 1 356.470 2.530 20 10 FFCDMP COC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319835914 1045282522 /nfs/dbraw/zinc/28/25/22/1045282522.db2.gz GXGMGJOPIHVGND-FQEVSTJZSA-N 2 1 371.500 2.925 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3Cc4cccc(O)c4C3)cc2F)CC1 ZINC001324592874 1046117705 /nfs/dbraw/zinc/11/77/05/1046117705.db2.gz RXJNEWSBCXGTOU-QGZVFWFLSA-N 2 1 355.457 2.540 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3ccc(OCC[NH3+])cc3)cc2F)CC1 ZINC001325272839 1046446591 /nfs/dbraw/zinc/44/65/91/1046446591.db2.gz NRZIPKMYEBOANT-UHFFFAOYSA-N 2 1 358.461 2.527 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C3CCC3)[C@H]3CCOC3)cc2F)CC1 ZINC001331966693 1048189977 /nfs/dbraw/zinc/18/99/77/1048189977.db2.gz UCQXRRYOOWFPRB-GHTZIAJQSA-N 2 1 361.505 2.872 20 10 FFCDMP CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCC[N@H+]2C2CCCC2)[NH+](C)C)cc1 ZINC001304769725 1051690490 /nfs/dbraw/zinc/69/04/90/1051690490.db2.gz ZFVHTKKODYQKHE-NHCUHLMSSA-N 2 1 372.557 2.879 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3OCCc4ccccc43)cc2F)CC1 ZINC001308262239 1052438573 /nfs/dbraw/zinc/43/85/73/1052438573.db2.gz KFUROBPBKDWUQZ-JOCHJYFZSA-N 2 1 369.484 2.981 20 10 FFCDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@H](C)C1 ZINC001334956363 1053165578 /nfs/dbraw/zinc/16/55/78/1053165578.db2.gz PGWCRUSPMBWRAF-WBVHZDCISA-N 2 1 366.502 2.636 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3COc4ccccc43)cc2F)CC1 ZINC001346910825 1053433804 /nfs/dbraw/zinc/43/38/04/1053433804.db2.gz HCLBACBHNGMMIM-QGZVFWFLSA-N 2 1 355.457 2.843 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+](CCCO)Cc3ccccc3)cc2F)CC1 ZINC001337033492 1054426164 /nfs/dbraw/zinc/42/61/64/1054426164.db2.gz VRGAXZNUHKFQIV-UHFFFAOYSA-N 2 1 371.500 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+](CCCO)Cc3ccccc3)cc2F)CC1 ZINC001337033492 1054426170 /nfs/dbraw/zinc/42/61/70/1054426170.db2.gz VRGAXZNUHKFQIV-UHFFFAOYSA-N 2 1 371.500 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCCO)Cc3ccccc3)cc2F)CC1 ZINC001337033492 1054426177 /nfs/dbraw/zinc/42/61/77/1054426177.db2.gz VRGAXZNUHKFQIV-UHFFFAOYSA-N 2 1 371.500 2.962 20 10 FFCDMP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349523867 1055317655 /nfs/dbraw/zinc/31/76/55/1055317655.db2.gz YEWZGZYMZSRVGN-UHFFFAOYSA-N 3 1 356.489 2.587 20 10 FFCDMP [NH3+][C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001580368793 1078793580 /nfs/dbraw/zinc/79/35/80/1078793580.db2.gz PKWWRENSEVZWMC-YESZJQIVSA-N 2 1 365.905 2.644 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000375786514 512506204 /nfs/dbraw/zinc/50/62/04/512506204.db2.gz MSVKTZYLUJLQNL-YSIASYRMSA-N 2 1 361.505 2.749 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)C[NH+](C)C)C1 ZINC000584521098 518381172 /nfs/dbraw/zinc/38/11/72/518381172.db2.gz FGEDJAAIFWRDQL-QGZVFWFLSA-N 2 1 370.541 2.722 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@@H](c2cccs2)N2CC[NH+](C)CC2)cc1 ZINC000920957081 737936585 /nfs/dbraw/zinc/93/65/85/737936585.db2.gz CGMNLOVZHDNNTP-IBGZPJMESA-N 2 1 358.555 2.892 20 10 FFCDMP C[NH+](C)CCN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1c(O)cccc1Cl ZINC001275837282 1013065709 /nfs/dbraw/zinc/06/57/09/1013065709.db2.gz FRBWKLVQYYWWHZ-IBGZPJMESA-N 2 1 365.905 2.564 20 10 FFCDMP COc1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1Cn1cccn1 ZINC000873042769 1013360047 /nfs/dbraw/zinc/36/00/47/1013360047.db2.gz IZQJHJASIUXHAL-INIZCTEOSA-N 2 1 353.470 2.871 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895555961 970736165 /nfs/dbraw/zinc/73/61/65/970736165.db2.gz DBBGNEMBHGJSSA-SFHVURJKSA-N 2 1 352.482 2.629 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc(F)ccc2n1C ZINC000894188078 978124389 /nfs/dbraw/zinc/12/43/89/978124389.db2.gz QGCCOBTVZBQEFX-GJZGRUSLSA-N 2 1 359.445 2.820 20 10 FFCDMP COC(=O)c1c(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2cc(F)ccc2n1C ZINC000894188078 978124393 /nfs/dbraw/zinc/12/43/93/978124393.db2.gz QGCCOBTVZBQEFX-GJZGRUSLSA-N 2 1 359.445 2.820 20 10 FFCDMP Cn1ncc(Cl)c1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000132594095 988608273 /nfs/dbraw/zinc/60/82/73/988608273.db2.gz BKJRCCPZZIHRFY-UHFFFAOYSA-N 2 1 373.932 2.895 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+](C)Cc2cnnn2[C@H]2CCC[NH2+]C2)cc1 ZINC000903876790 1016281523 /nfs/dbraw/zinc/28/15/23/1016281523.db2.gz ISVFGCGRXNBUQI-IBGZPJMESA-N 2 1 356.518 2.681 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)Cc2cnnn2[C@H]2CCC[NH2+]C2)cc1 ZINC000903876790 1016281531 /nfs/dbraw/zinc/28/15/31/1016281531.db2.gz ISVFGCGRXNBUQI-IBGZPJMESA-N 2 1 356.518 2.681 20 10 FFCDMP CN(C)c1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC[NH2+]CC2)cc1 ZINC000903980337 1016356262 /nfs/dbraw/zinc/35/62/62/1016356262.db2.gz PCWAFILOYVTTBO-BUMKJDKQSA-N 2 1 354.542 2.666 20 10 FFCDMP COc1ccc([C@H](C[NH3+])C[N@@H+](C)CCN(C)c2ccc(OC)cc2)cc1 ZINC000846225776 1000235199 /nfs/dbraw/zinc/23/51/99/1000235199.db2.gz UKCVXULLJVVDKW-GOSISDBHSA-N 2 1 357.498 2.814 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859904 /nfs/dbraw/zinc/85/99/04/1003859904.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 3 1 356.558 2.602 20 10 FFCDMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859914 /nfs/dbraw/zinc/85/99/14/1003859914.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 3 1 356.558 2.602 20 10 FFCDMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859924 /nfs/dbraw/zinc/85/99/24/1003859924.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 3 1 356.558 2.602 20 10 FFCDMP C[N@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859934 /nfs/dbraw/zinc/85/99/34/1003859934.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 2 1 356.558 2.602 20 10 FFCDMP C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775726704 1003859943 /nfs/dbraw/zinc/85/99/43/1003859943.db2.gz XMUXAYQTTFJGBJ-OAQYLSRUSA-N 2 1 356.558 2.602 20 10 FFCDMP COC(=O)c1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775654493 1004963438 /nfs/dbraw/zinc/96/34/38/1004963438.db2.gz LDWNDZYMHDMINB-UHFFFAOYSA-N 2 1 367.493 2.857 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850508064 1005819352 /nfs/dbraw/zinc/81/93/52/1005819352.db2.gz KDGYCNHDYQUEST-QAPCUYQASA-N 2 1 356.466 2.818 20 10 FFCDMP NC(=O)C1CCN(c2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000925776232 1017847970 /nfs/dbraw/zinc/84/79/70/1017847970.db2.gz FNFUJPJFSVIKCV-SFTDATJTSA-N 2 1 364.493 2.623 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3Cc4ccccc4CO3)cc2F)CC1 ZINC001118861160 1022447901 /nfs/dbraw/zinc/44/79/01/1022447901.db2.gz ZPQQVHKDDIGGDV-FQEVSTJZSA-N 2 1 369.484 2.809 20 10 FFCDMP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1O ZINC000756508332 1023720574 /nfs/dbraw/zinc/72/05/74/1023720574.db2.gz IMIMZSXYINCENY-INIZCTEOSA-N 2 1 358.461 2.789 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+](C)CC(=O)NC2CC[NH+](CC)CC2)cc1 ZINC000759644472 1024701557 /nfs/dbraw/zinc/70/15/57/1024701557.db2.gz UCMZPSYRKRSHHV-UHFFFAOYSA-N 2 1 360.546 2.565 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)CC(=O)NC2CC[NH+](CC)CC2)cc1 ZINC000759644472 1024701569 /nfs/dbraw/zinc/70/15/69/1024701569.db2.gz UCMZPSYRKRSHHV-UHFFFAOYSA-N 2 1 360.546 2.565 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045363 1030000053 /nfs/dbraw/zinc/00/00/53/1030000053.db2.gz KGLCABMQESXADY-ZPMCFJSWSA-N 2 1 352.526 2.863 20 10 FFCDMP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000832272947 1034694668 /nfs/dbraw/zinc/69/46/68/1034694668.db2.gz KHNSLJWFNSLXCA-SFTDATJTSA-N 2 1 366.509 2.533 20 10 FFCDMP CCOC(=O)[C@]1(C)CCCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139408630 1035092483 /nfs/dbraw/zinc/09/24/83/1035092483.db2.gz NYYKMSHYQHAVOL-JOCHJYFZSA-N 2 1 373.541 2.994 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CC[NH+](C)CC4)CC3)cc2)CC1 ZINC001139411106 1035095032 /nfs/dbraw/zinc/09/50/32/1035095032.db2.gz VHLXFNOENCFYSB-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001140304394 1035426314 /nfs/dbraw/zinc/42/63/14/1035426314.db2.gz NHDVDXBRVDPBBZ-IBGZPJMESA-N 2 1 373.541 2.992 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001231592833 1037711248 /nfs/dbraw/zinc/71/12/48/1037711248.db2.gz VFDNQLPQSOXMTR-SFHVURJKSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3cccc(C)c3O)CC2)C1 ZINC001231592833 1037711264 /nfs/dbraw/zinc/71/12/64/1037711264.db2.gz VFDNQLPQSOXMTR-SFHVURJKSA-N 2 1 360.498 2.940 20 10 FFCDMP CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235767953 1037730430 /nfs/dbraw/zinc/73/04/30/1037730430.db2.gz BRMNIZDPOSFXHT-INIZCTEOSA-N 2 1 362.470 2.570 20 10 FFCDMP CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235767953 1037730441 /nfs/dbraw/zinc/73/04/41/1037730441.db2.gz BRMNIZDPOSFXHT-INIZCTEOSA-N 2 1 362.470 2.570 20 10 FFCDMP c1ccc2c(c1)CCN1CC[N@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C[C@@H]21 ZINC001236058707 1037909838 /nfs/dbraw/zinc/90/98/38/1037909838.db2.gz AJKVQZKINWRIKI-QHCPKHFHSA-N 2 1 362.521 2.511 20 10 FFCDMP CC[NH+](CC)CCCN1CC[NH+](Cc2ccc(N(C)C)cc2OC)CC1 ZINC001231853925 1037951664 /nfs/dbraw/zinc/95/16/64/1037951664.db2.gz USUGJUUHVFTNQO-UHFFFAOYSA-N 2 1 362.562 2.611 20 10 FFCDMP CO[C@@H](CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C(F)(F)F ZINC001255582423 1038030081 /nfs/dbraw/zinc/03/00/81/1038030081.db2.gz XLEKNKCIVRCGPP-INIZCTEOSA-N 2 1 363.399 2.635 20 10 FFCDMP c1ccc(C[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C2CC[NH2+]CC2)cc1 ZINC001236299170 1038030615 /nfs/dbraw/zinc/03/06/15/1038030615.db2.gz DLNAWWJNOPWBSL-UHFFFAOYSA-N 3 1 364.537 2.850 20 10 FFCDMP c1ccc(CN(Cc2ccc(N3CC[NH2+]CC3)cc2)C2CC[NH2+]CC2)cc1 ZINC001236299170 1038030639 /nfs/dbraw/zinc/03/06/39/1038030639.db2.gz DLNAWWJNOPWBSL-UHFFFAOYSA-N 2 1 364.537 2.850 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1OC ZINC001236751811 1038237060 /nfs/dbraw/zinc/23/70/60/1038237060.db2.gz JQZVGJQNTUTPHW-RTBURBONSA-N 2 1 368.477 2.973 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@@H]3CCC[N@@H+](C4CCCC4)C3)cc2)CC1 ZINC001256898912 1038649855 /nfs/dbraw/zinc/64/98/55/1038649855.db2.gz AOHYUWKDWLSSBB-HXUWFJFHSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN[C@@H]3CCC[N@H+](C4CCCC4)C3)cc2)CC1 ZINC001256898912 1038649857 /nfs/dbraw/zinc/64/98/57/1038649857.db2.gz AOHYUWKDWLSSBB-HXUWFJFHSA-N 2 1 356.558 2.935 20 10 FFCDMP C[NH2+]CC[C@H](C)[N@H+]1CCC[C@@]2(C1)COCCN(c1ccc(OC)cc1)C2 ZINC001246700996 1039441147 /nfs/dbraw/zinc/44/11/47/1039441147.db2.gz HYRWZTYYOYSABC-RXVVDRJESA-N 2 1 361.530 2.612 20 10 FFCDMP CN1CCCc2cc(C[N@H+]3CCCC4(CN(CC[NH+](C)C)C4)C3)ccc21 ZINC001279550702 1043244711 /nfs/dbraw/zinc/24/47/11/1043244711.db2.gz BKUFUBCCIJNNMU-UHFFFAOYSA-N 2 1 356.558 2.528 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+](CCO)CCc3ccccc3)cc2F)CC1 ZINC001320498254 1045419411 /nfs/dbraw/zinc/41/94/11/1045419411.db2.gz YLLBNSCZXZSGDK-UHFFFAOYSA-N 2 1 371.500 2.615 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)CCc3ccccc3)cc2F)CC1 ZINC001320498254 1045419414 /nfs/dbraw/zinc/41/94/14/1045419414.db2.gz YLLBNSCZXZSGDK-UHFFFAOYSA-N 2 1 371.500 2.615 20 10 FFCDMP CCC(CC)(CC(=O)OC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001322325479 1046044956 /nfs/dbraw/zinc/04/49/56/1046044956.db2.gz NHGYRHWBQLDAJA-UHFFFAOYSA-N 2 1 365.493 2.789 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3[C@@H]3CCCOC3)cc2F)CC1 ZINC001327121414 1047196288 /nfs/dbraw/zinc/19/62/88/1047196288.db2.gz QMFHTJYYUTVJET-QUCCMNQESA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCOC3)cc2F)CC1 ZINC001327121414 1047196291 /nfs/dbraw/zinc/19/62/91/1047196291.db2.gz QMFHTJYYUTVJET-QUCCMNQESA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)C3CCCCC3)cc2F)CC1 ZINC001327815769 1048053443 /nfs/dbraw/zinc/05/34/43/1048053443.db2.gz BSGGQWCNRNPWFJ-LJQANCHMSA-N 2 1 363.521 2.856 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cc(N)ccc43)cc2F)CC1 ZINC001329353551 1048681200 /nfs/dbraw/zinc/68/12/00/1048681200.db2.gz GFMNWAMYTWKSLM-HXUWFJFHSA-N 2 1 354.473 2.937 20 10 FFCDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@@H](C)C1 ZINC001334956360 1053165394 /nfs/dbraw/zinc/16/53/94/1053165394.db2.gz PGWCRUSPMBWRAF-DOTOQJQBSA-N 2 1 366.502 2.636 20 10 FFCDMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 ZINC001200244514 1056140298 /nfs/dbraw/zinc/14/02/98/1056140298.db2.gz VAQVQCARGLENRS-LJQANCHMSA-N 2 1 362.537 2.788 20 10 FFCDMP CN(C)c1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001560317988 1076263193 /nfs/dbraw/zinc/26/31/93/1076263193.db2.gz RWGLJKJGVHPERI-UHFFFAOYSA-N 2 1 356.489 2.933 20 10 FFCDMP Cc1cc(Br)cc([C@H](C)[NH2+]CCC[NH+]2CCC(O)CC2)c1O ZINC000187050463 510028001 /nfs/dbraw/zinc/02/80/01/510028001.db2.gz KHSVGZWRKNEJJG-ZDUSSCGKSA-N 2 1 371.319 2.961 20 10 FFCDMP NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C[NH2+]Cc3cc(F)ccc3O)c2)C1 ZINC000180704613 510063278 /nfs/dbraw/zinc/06/32/78/510063278.db2.gz ZBNQOYQLEXCTJV-QGZVFWFLSA-N 2 1 371.456 2.518 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]2CCC[C@H]21 ZINC000375785955 512505240 /nfs/dbraw/zinc/50/52/40/512505240.db2.gz CPFQATZMWZXYSJ-FDFHNCONSA-N 2 1 357.542 2.858 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)NCC2([NH+](C)C)CC2)C1 ZINC000416308190 513702030 /nfs/dbraw/zinc/70/20/30/513702030.db2.gz PBNGSDLVPFGDOZ-UHFFFAOYSA-N 2 1 368.525 2.618 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+](C)CC2CC[NH+](C)CC2)c1O ZINC000093088716 728473965 /nfs/dbraw/zinc/47/39/65/728473965.db2.gz FXHLVEUCHMOORI-UHFFFAOYSA-N 2 1 357.292 2.937 20 10 FFCDMP COc1cc(Br)cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1O ZINC000725846018 734396082 /nfs/dbraw/zinc/39/60/82/734396082.db2.gz UMFJXVVGZYUDFZ-KGLIPLIRSA-N 2 1 355.276 2.880 20 10 FFCDMP COc1c(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774847016 738031896 /nfs/dbraw/zinc/03/18/96/738031896.db2.gz SUYXEZNGIDQQER-UHFFFAOYSA-N 2 1 351.447 2.861 20 10 FFCDMP COc1c(O)c(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774847016 738031900 /nfs/dbraw/zinc/03/19/00/738031900.db2.gz SUYXEZNGIDQQER-UHFFFAOYSA-N 2 1 351.447 2.861 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c1O ZINC000839183564 746797067 /nfs/dbraw/zinc/79/70/67/746797067.db2.gz YPEMIBHFMWEGEX-LBPRGKRZSA-N 2 1 357.292 2.985 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@@H]1C[NH3+] ZINC001206027872 1032114353 /nfs/dbraw/zinc/11/43/53/1032114353.db2.gz WZRJOWQKLFFCQU-HZPDHXFCSA-N 2 1 351.922 2.983 20 10 FFCDMP CCOc1ccc(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391440 988549473 /nfs/dbraw/zinc/54/94/73/988549473.db2.gz CTUJFQVXHWCNKP-CWJKEVGVSA-N 2 1 362.514 2.750 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@](CO)(c4ccccc4)C3)cc2)CC1 ZINC000812781456 995533189 /nfs/dbraw/zinc/53/31/89/995533189.db2.gz UXXHEWNCXIRDIW-QHCPKHFHSA-N 2 1 365.521 2.574 20 10 FFCDMP Cc1c(C[C@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cnn1C ZINC000903873803 1016279903 /nfs/dbraw/zinc/27/99/03/1016279903.db2.gz MFBFZAMCNDABAQ-HXUWFJFHSA-N 2 1 369.557 2.968 20 10 FFCDMP CC(C)[NH+]1CCC(N2CC[NH+](Cc3ccc(N(C)C)c(F)c3)CC2)CC1 ZINC000769536571 1000544633 /nfs/dbraw/zinc/54/46/33/1000544633.db2.gz BQTZKURZIRRQCK-UHFFFAOYSA-N 2 1 362.537 2.882 20 10 FFCDMP NC(=O)[C@@H]1CCCN(c2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000817888154 1007784723 /nfs/dbraw/zinc/78/47/23/1007784723.db2.gz BZYRKDACVCGZJM-MAODMQOUSA-N 2 1 364.493 2.623 20 10 FFCDMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000817887753 1007785394 /nfs/dbraw/zinc/78/53/94/1007785394.db2.gz DLSZPSUVHMHJJZ-OXJNMPFZSA-N 2 1 357.473 2.710 20 10 FFCDMP COc1cccc2c1C[C@H]([NH2+]C1CC[NH+](Cc3ccccc3O)CC1)CO2 ZINC001173150548 1012295456 /nfs/dbraw/zinc/29/54/56/1012295456.db2.gz MRTYFOOIFROIQD-SFHVURJKSA-N 2 1 368.477 2.959 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+](CCO)Cc3ccccc3)cc2F)CC1 ZINC001116438607 1021218306 /nfs/dbraw/zinc/21/83/06/1021218306.db2.gz JIRWBPOKHVDVMM-UHFFFAOYSA-N 2 1 357.473 2.572 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)Cc3ccccc3)cc2F)CC1 ZINC001116438607 1021218313 /nfs/dbraw/zinc/21/83/13/1021218313.db2.gz JIRWBPOKHVDVMM-UHFFFAOYSA-N 2 1 357.473 2.572 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C(C)(C)C)[C@@H](O)C3)cc2F)CC1 ZINC001116502389 1021250622 /nfs/dbraw/zinc/25/06/22/1021250622.db2.gz UVNYUMLBKKFQSY-XLIONFOSSA-N 2 1 363.521 2.806 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C(C)(C)C)[C@@H](O)C3)cc2F)CC1 ZINC001116502389 1021250626 /nfs/dbraw/zinc/25/06/26/1021250626.db2.gz UVNYUMLBKKFQSY-XLIONFOSSA-N 2 1 363.521 2.806 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1O ZINC001119446515 1022773375 /nfs/dbraw/zinc/77/33/75/1022773375.db2.gz ZLRVKXYWHBGFLD-LJQANCHMSA-N 2 1 356.466 2.566 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001203555965 1030764692 /nfs/dbraw/zinc/76/46/92/1030764692.db2.gz LDRPFYADGIWPIE-UHFFFAOYSA-N 2 1 367.493 2.902 20 10 FFCDMP COc1cc(C[N@@H+]2C[C@H]3c4ccccc4C(=O)[C@H]3C2)cc(C[NH+](C)C)c1O ZINC001139254638 1035030657 /nfs/dbraw/zinc/03/06/57/1035030657.db2.gz KEPXHKQFGDIWIG-OALUTQOASA-N 2 1 366.461 2.874 20 10 FFCDMP CCOC(=O)[C@@]1(C)CCC[N@@H+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139259316 1035031895 /nfs/dbraw/zinc/03/18/95/1035031895.db2.gz QYUDWGAJEWVRDL-FQEVSTJZSA-N 2 1 364.486 2.628 20 10 FFCDMP CCOC(=O)[C@@H]1CCCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139413544 1035096750 /nfs/dbraw/zinc/09/67/50/1035096750.db2.gz WCHLLTWWZUGVRB-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@](C)(C(=O)OC)C3)cc2)CC1 ZINC001140303839 1035426167 /nfs/dbraw/zinc/42/61/67/1035426167.db2.gz BNROVDFICJMJPA-NRFANRHFSA-N 2 1 359.514 2.604 20 10 FFCDMP CCOC(=O)[C@@]1(C)CCC[N@@H+](Cc2ccc(N3CC[NH+](CC)CC3)cc2)C1 ZINC001140306588 1035428285 /nfs/dbraw/zinc/42/82/85/1035428285.db2.gz UVPZNZRAJSDWBZ-QFIPXVFZSA-N 2 1 373.541 2.994 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3c3ncccn3)cc2)CC1 ZINC001140309781 1035429518 /nfs/dbraw/zinc/42/95/18/1035429518.db2.gz UKRCKNAYXLPUBE-HXUWFJFHSA-N 2 1 351.498 2.956 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3c3ncccn3)cc2)CC1 ZINC001140309781 1035429521 /nfs/dbraw/zinc/42/95/21/1035429521.db2.gz UKRCKNAYXLPUBE-HXUWFJFHSA-N 2 1 351.498 2.956 20 10 FFCDMP C[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000835026987 1035489282 /nfs/dbraw/zinc/48/92/82/1035489282.db2.gz AMWWEHWDWUPANB-GXDMAZLRSA-N 2 1 356.558 2.724 20 10 FFCDMP Cc1cc(C)c(C[N@@H+]2CCCC[C@]23CC(=O)N(CC[NH+](C)C)C3)c(O)c1 ZINC001277204850 1035530160 /nfs/dbraw/zinc/53/01/60/1035530160.db2.gz YSJUELGAAYVGLE-OAQYLSRUSA-N 2 1 359.514 2.528 20 10 FFCDMP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1c(O)ccc2ccc(OC)cc21 ZINC001234552843 1037082624 /nfs/dbraw/zinc/08/26/24/1037082624.db2.gz KTZJCXHRSPVEHQ-UHFFFAOYSA-N 2 1 374.481 2.871 20 10 FFCDMP COc1ccc(Br)c(C[N@@H+](C)CC2CC[NH+](C)CC2)c1O ZINC001231552789 1037676009 /nfs/dbraw/zinc/67/60/09/1037676009.db2.gz JOJYXSNILGALOT-UHFFFAOYSA-N 2 1 357.292 2.937 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@@H+](Cc1cccc(C)c1O)CCC2 ZINC001231591503 1037707422 /nfs/dbraw/zinc/70/74/22/1037707422.db2.gz DWFCBBHLBSEOGB-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@H+](Cc1cccc(C)c1O)CCC2 ZINC001231591503 1037707445 /nfs/dbraw/zinc/70/74/45/1037707445.db2.gz DWFCBBHLBSEOGB-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001235726776 1037713071 /nfs/dbraw/zinc/71/30/71/1037713071.db2.gz PPLLYCHKQVTLSU-MRXNPFEDSA-N 2 1 355.457 2.930 20 10 FFCDMP COCCC[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H]1CCC[NH2+]C1 ZINC001235806001 1037756484 /nfs/dbraw/zinc/75/64/84/1037756484.db2.gz HYWZHKFMCKYSLT-LJQANCHMSA-N 2 1 373.541 2.682 20 10 FFCDMP COCCC[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H]1CCC[NH2+]C1 ZINC001235806001 1037756500 /nfs/dbraw/zinc/75/65/00/1037756500.db2.gz HYWZHKFMCKYSLT-LJQANCHMSA-N 2 1 373.541 2.682 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCN[C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855684 1037796611 /nfs/dbraw/zinc/79/66/11/1037796611.db2.gz UWISPNSENINJAZ-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[NH2+][C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855684 1037796627 /nfs/dbraw/zinc/79/66/27/1037796627.db2.gz UWISPNSENINJAZ-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP Cc1cc(C)c(C[NH+]2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001231844398 1037943356 /nfs/dbraw/zinc/94/33/56/1037943356.db2.gz HXZWKQLZEDFLKU-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[NH+]2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001231844398 1037943370 /nfs/dbraw/zinc/94/33/70/1037943370.db2.gz HXZWKQLZEDFLKU-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[N@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001231844398 1037943380 /nfs/dbraw/zinc/94/33/80/1037943380.db2.gz HXZWKQLZEDFLKU-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP Cc1cc(C)c(C[N@@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)c(O)c1 ZINC001231844398 1037943393 /nfs/dbraw/zinc/94/33/93/1037943393.db2.gz HXZWKQLZEDFLKU-MOPGFXCFSA-N 2 1 354.498 2.696 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236213005 1037989077 /nfs/dbraw/zinc/98/90/77/1037989077.db2.gz ARPCUUVPIPKOCI-QZTJIDSGSA-N 2 1 364.486 2.816 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c(O)c1 ZINC001236213005 1037989085 /nfs/dbraw/zinc/98/90/85/1037989085.db2.gz ARPCUUVPIPKOCI-QZTJIDSGSA-N 2 1 364.486 2.816 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(C(C)C)cc3O)CC[C@@H]2C1 ZINC001237049046 1038424438 /nfs/dbraw/zinc/42/44/38/1038424438.db2.gz RIIZXQWPVPJDKS-TZIWHRDSSA-N 2 1 362.514 2.685 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(C(C)C)cc3O)CC[C@@H]2C1 ZINC001237049046 1038424446 /nfs/dbraw/zinc/42/44/46/1038424446.db2.gz RIIZXQWPVPJDKS-TZIWHRDSSA-N 2 1 362.514 2.685 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(C(C)C)cc3O)CC[C@@H]2C1 ZINC001237049046 1038424449 /nfs/dbraw/zinc/42/44/49/1038424449.db2.gz RIIZXQWPVPJDKS-TZIWHRDSSA-N 2 1 362.514 2.685 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256521035 1038541362 /nfs/dbraw/zinc/54/13/62/1038541362.db2.gz XNNOWYHZQMBZDO-FPDPHYFHSA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@@H]1C[C@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256521035 1038541375 /nfs/dbraw/zinc/54/13/75/1038541375.db2.gz XNNOWYHZQMBZDO-FPDPHYFHSA-N 2 1 356.466 2.774 20 10 FFCDMP Oc1ccccc1C[N@H+]1CCC[C@@]2(CCC[NH+](CCn3ccnc3)C2)C1 ZINC001278551391 1041112116 /nfs/dbraw/zinc/11/21/16/1041112116.db2.gz ICDRRXONVLBMEN-OAQYLSRUSA-N 2 1 354.498 2.967 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC[C@@]2(CCC[N@H+](CCn3ccnc3)C2)C1 ZINC001278551391 1041112121 /nfs/dbraw/zinc/11/21/21/1041112121.db2.gz ICDRRXONVLBMEN-OAQYLSRUSA-N 2 1 354.498 2.967 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC[C@@]2(CCC[N@@H+](CCn3ccnc3)C2)C1 ZINC001278551391 1041112128 /nfs/dbraw/zinc/11/21/28/1041112128.db2.gz ICDRRXONVLBMEN-OAQYLSRUSA-N 2 1 354.498 2.967 20 10 FFCDMP COc1ccc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4cn[nH]c4)C3)CC2)c1 ZINC001278570305 1041214247 /nfs/dbraw/zinc/21/42/47/1041214247.db2.gz AUVLWUMSEJGINU-UHFFFAOYSA-N 2 1 356.470 2.612 20 10 FFCDMP CCc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](COCCOC)CC[C@@H]3C2)c(O)c1 ZINC001279664029 1043425817 /nfs/dbraw/zinc/42/58/17/1043425817.db2.gz OMLVBRGXMDVQBD-KDURUIRLSA-N 2 1 362.514 2.719 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@@H]3CC[N@@H+](COCCOC)CC[C@@H]3C2)c(O)c1 ZINC001279664029 1043425823 /nfs/dbraw/zinc/42/58/23/1043425823.db2.gz OMLVBRGXMDVQBD-KDURUIRLSA-N 2 1 362.514 2.719 20 10 FFCDMP CCc1ccc(C[NH+]2C[C@@H]3CC[N@H+](COCCOC)CC[C@@H]3C2)c(O)c1 ZINC001279664029 1043425829 /nfs/dbraw/zinc/42/58/29/1043425829.db2.gz OMLVBRGXMDVQBD-KDURUIRLSA-N 2 1 362.514 2.719 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(C)CCO[C@H]3C3CC3)cc2F)CC1 ZINC001320413568 1045404012 /nfs/dbraw/zinc/40/40/12/1045404012.db2.gz CMGUSLZYRVMVEI-SFTDATJTSA-N 2 1 361.505 2.872 20 10 FFCDMP C[C@H]1[C@H]([NH+]2CCCC2)CCN1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325712847 1046620065 /nfs/dbraw/zinc/62/00/65/1046620065.db2.gz DTIOOMVKJDRLHT-FXAWDEMLSA-N 2 1 360.521 2.636 20 10 FFCDMP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CCOCC2 ZINC001326339021 1046882710 /nfs/dbraw/zinc/88/27/10/1046882710.db2.gz OBJDSCVCVLFJSS-QGZVFWFLSA-N 2 1 361.505 2.969 20 10 FFCDMP C[C@@H]1CC2(C[N@H+]1Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)CCOCC2 ZINC001326339021 1046882726 /nfs/dbraw/zinc/88/27/26/1046882726.db2.gz OBJDSCVCVLFJSS-QGZVFWFLSA-N 2 1 361.505 2.969 20 10 FFCDMP Cn1ccc(C2CC[NH+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)CC2)n1 ZINC001334317750 1049369792 /nfs/dbraw/zinc/36/97/92/1049369792.db2.gz IJFQQKFCYDEXBR-UHFFFAOYSA-N 2 1 371.504 2.691 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@@H](O)Cc1ccccc1 ZINC001343972843 1052521359 /nfs/dbraw/zinc/52/13/59/1052521359.db2.gz MXFPZDYCQJVMPH-FQEVSTJZSA-N 2 1 371.500 2.613 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@@H](O)Cc1ccccc1 ZINC001343972843 1052521367 /nfs/dbraw/zinc/52/13/67/1052521367.db2.gz MXFPZDYCQJVMPH-FQEVSTJZSA-N 2 1 371.500 2.613 20 10 FFCDMP COC(=O)CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)CC(C)C ZINC001337010492 1054407720 /nfs/dbraw/zinc/40/77/20/1054407720.db2.gz UOPGJSMYAFYQHT-UHFFFAOYSA-N 2 1 365.493 2.599 20 10 FFCDMP COC(=O)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)CC(C)C ZINC001337010492 1054407727 /nfs/dbraw/zinc/40/77/27/1054407727.db2.gz UOPGJSMYAFYQHT-UHFFFAOYSA-N 2 1 365.493 2.599 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3ccc(F)cc3)cc2F)CC1 ZINC001461035684 1061192104 /nfs/dbraw/zinc/19/21/04/1061192104.db2.gz CNGJDQVKULFHHC-UHFFFAOYSA-N 2 1 361.436 2.885 20 10 FFCDMP COc1ccc(N2CCN(CCC[NH2+][C@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)CC2)cc1 ZINC000162809145 509306233 /nfs/dbraw/zinc/30/62/33/509306233.db2.gz DXFFJDSHGKHVET-KNKQGSTJSA-N 2 1 374.573 2.526 20 10 FFCDMP CN(C)c1ccc(C[NH2+]CCC[NH+]2CCC(O)CC2)c(C(F)(F)F)c1 ZINC000279544254 511121520 /nfs/dbraw/zinc/12/15/20/511121520.db2.gz APOQIEFDYQHHEF-UHFFFAOYSA-N 2 1 359.436 2.708 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]2CCC[C@@H]21 ZINC000375785957 512504652 /nfs/dbraw/zinc/50/46/52/512504652.db2.gz CPFQATZMWZXYSJ-FSSWDIPSSA-N 2 1 357.542 2.858 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@H](c2cccs2)N2CC[NH+](C)CC2)cc1 ZINC000920957082 737936546 /nfs/dbraw/zinc/93/65/46/737936546.db2.gz CGMNLOVZHDNNTP-LJQANCHMSA-N 2 1 358.555 2.892 20 10 FFCDMP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@](C)(C(F)F)O1 ZINC000827955261 745007320 /nfs/dbraw/zinc/00/73/20/745007320.db2.gz CMUWLJAUHCKPJG-DNVCBOLYSA-N 2 1 353.457 2.683 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@](C)(C(F)F)O1 ZINC000827955261 745007325 /nfs/dbraw/zinc/00/73/25/745007325.db2.gz CMUWLJAUHCKPJG-DNVCBOLYSA-N 2 1 353.457 2.683 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1O ZINC000843047421 747756087 /nfs/dbraw/zinc/75/60/87/747756087.db2.gz UVLBTXIRWBQSOB-PBWFPOADSA-N 2 1 355.276 2.878 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903447 748132961 /nfs/dbraw/zinc/13/29/61/748132961.db2.gz ZFPLKQRMWHSFTQ-BJJXKVORSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903447 748132965 /nfs/dbraw/zinc/13/29/65/748132965.db2.gz ZFPLKQRMWHSFTQ-BJJXKVORSA-N 2 1 369.303 2.873 20 10 FFCDMP CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000846227110 748434160 /nfs/dbraw/zinc/43/41/60/748434160.db2.gz GSSYBJUFFCGCDH-JQHSSLGASA-N 2 1 350.434 2.595 20 10 FFCDMP CCc1cccc(C[NH+]2CCC([NH+](CCOC)CCOC)CC2)c1O ZINC000848911502 749033211 /nfs/dbraw/zinc/03/32/11/749033211.db2.gz WEUIDQRRNYFABZ-UHFFFAOYSA-N 2 1 350.503 2.514 20 10 FFCDMP CCOc1ccc(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c(O)c1 ZINC000922391439 988548741 /nfs/dbraw/zinc/54/87/41/988548741.db2.gz CTUJFQVXHWCNKP-AYWYSENESA-N 2 1 362.514 2.750 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CCO)c1ccccc1 ZINC000775698622 1003704203 /nfs/dbraw/zinc/70/42/03/1003704203.db2.gz PMHBCLAMJQATAW-JOCHJYFZSA-N 2 1 353.510 2.994 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1n1ccnc1 ZINC000775738147 1003929520 /nfs/dbraw/zinc/92/95/20/1003929520.db2.gz UFXMLDGXRQWLFC-RXVVDRJESA-N 2 1 353.514 2.718 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCOc3cccc(F)c3)cc2F)CC1 ZINC001199564139 1004971476 /nfs/dbraw/zinc/97/14/76/1004971476.db2.gz OFRNZARNVQEJMM-UHFFFAOYSA-N 2 1 361.436 2.885 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000850508384 1005819128 /nfs/dbraw/zinc/81/91/28/1005819128.db2.gz MDKVNYWUFAYXMF-QAPCUYQASA-N 2 1 356.466 2.818 20 10 FFCDMP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)NCc2ccc(N(C)C)cc2)CC1 ZINC000114475584 1007916090 /nfs/dbraw/zinc/91/60/90/1007916090.db2.gz OKNJISWWELFSMH-UHFFFAOYSA-N 2 1 374.573 2.813 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCNc3cc(CO)cc(C)[nH+]3)CC2)cc1 ZINC000820608840 1008358135 /nfs/dbraw/zinc/35/81/35/1008358135.db2.gz AJPBMJCBGXROJL-UHFFFAOYSA-N 2 1 370.497 2.515 20 10 FFCDMP C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001177830544 1008761141 /nfs/dbraw/zinc/76/11/41/1008761141.db2.gz XRKVVYBIATXJCB-LAUBAEHRSA-N 2 1 371.500 2.832 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc(C(C)C)cc3O)C[C@@H]1C[NH2+]CCC2 ZINC001222136352 1032779708 /nfs/dbraw/zinc/77/97/08/1032779708.db2.gz RZBQXBZQWDBHCV-RXVVDRJESA-N 2 1 360.498 2.880 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000756482917 1023718344 /nfs/dbraw/zinc/71/83/44/1023718344.db2.gz LBCUWBLPVZYGKL-JYJNAYRXSA-N 2 1 364.486 2.719 20 10 FFCDMP Cc1cc(C[N@H+]2CCC(=O)N(CC[NH+](C)C)CC2)c(C)n1-c1ccccc1 ZINC001137859199 1033229176 /nfs/dbraw/zinc/22/91/76/1033229176.db2.gz NLXCPOPVSUFWEN-UHFFFAOYSA-N 2 1 368.525 2.690 20 10 FFCDMP COc1ccccc1-n1nccc1C[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000841041315 1029996160 /nfs/dbraw/zinc/99/61/60/1029996160.db2.gz FFRUAPVXFJNPCR-IBGZPJMESA-N 2 1 365.481 2.737 20 10 FFCDMP CCOC(=O)C1CCN(C2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)CC1 ZINC001203930736 1030991130 /nfs/dbraw/zinc/99/11/30/1030991130.db2.gz GWKDMMLNQLVDBY-UHFFFAOYSA-N 2 1 373.541 2.992 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2ccc3c(c2)OCO3)cc(C[NH+](C)C)c1O ZINC001139258605 1035031917 /nfs/dbraw/zinc/03/19/17/1035031917.db2.gz UXARFNKBCOXFTE-UHFFFAOYSA-N 2 1 358.438 2.823 20 10 FFCDMP CCOC(=O)C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC001139410872 1035095296 /nfs/dbraw/zinc/09/52/96/1035095296.db2.gz JJONGZGPNIHUBE-UHFFFAOYSA-N 2 1 359.514 2.746 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](CC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001139410968 1035095440 /nfs/dbraw/zinc/09/54/40/1035095440.db2.gz OAWJZTWTVPIKBF-LJQANCHMSA-N 2 1 373.541 2.992 20 10 FFCDMP CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)[C@@H]1SC ZINC001202948114 1035166719 /nfs/dbraw/zinc/16/67/19/1035166719.db2.gz VOBVBTIRCMCQLJ-QRQLOZEOSA-N 2 1 367.534 2.576 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@](CO)(C(F)(F)F)C3)cc2)CC1 ZINC001140302101 1035425184 /nfs/dbraw/zinc/42/51/84/1035425184.db2.gz JTZUEJKWKIVBOY-GOSISDBHSA-N 2 1 371.447 2.575 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](Oc4ccncc4)C3)cc2)CC1 ZINC001140306236 1035427552 /nfs/dbraw/zinc/42/75/52/1035427552.db2.gz QAFNQJZPHRJTQY-QFIPXVFZSA-N 2 1 366.509 2.877 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155290 1037390575 /nfs/dbraw/zinc/39/05/75/1037390575.db2.gz OAGXRAZBRMDRDT-JOCHJYFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155290 1037390589 /nfs/dbraw/zinc/39/05/89/1037390589.db2.gz OAGXRAZBRMDRDT-JOCHJYFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155290 1037390610 /nfs/dbraw/zinc/39/06/10/1037390610.db2.gz OAGXRAZBRMDRDT-JOCHJYFZSA-N 2 1 356.558 2.793 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001235726773 1037713216 /nfs/dbraw/zinc/71/32/16/1037713216.db2.gz PPLLYCHKQVTLSU-INIZCTEOSA-N 2 1 355.457 2.930 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001235949981 1037854559 /nfs/dbraw/zinc/85/45/59/1037854559.db2.gz YNPCODWEBHJVOS-KRWDZBQOSA-N 2 1 355.457 2.930 20 10 FFCDMP COc1ccc(N2CC[NH+](C3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c(OC)c1 ZINC001255681673 1038123430 /nfs/dbraw/zinc/12/34/30/1038123430.db2.gz ASDOEECQWSCYLA-JWTNVVGKSA-N 2 1 359.514 2.841 20 10 FFCDMP COc1ccc(N2CC[NH+](C3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c(OC)c1 ZINC001255681673 1038123463 /nfs/dbraw/zinc/12/34/63/1038123463.db2.gz ASDOEECQWSCYLA-JWTNVVGKSA-N 2 1 359.514 2.841 20 10 FFCDMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](Cc1c(C)cc(OC)cc1O)C2 ZINC001236809865 1038284299 /nfs/dbraw/zinc/28/42/99/1038284299.db2.gz SVXHNRZGTJDHNG-GCJKJVERSA-N 2 1 374.525 2.890 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4cccc(O)c4C3)c(F)c2)CC1 ZINC001236942993 1038371025 /nfs/dbraw/zinc/37/10/25/1038371025.db2.gz OSHDXHVUDRRFAL-UHFFFAOYSA-N 2 1 355.457 2.841 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256524592 1038545431 /nfs/dbraw/zinc/54/54/31/1038545431.db2.gz XNNOWYHZQMBZDO-KLHJMIIUSA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256524592 1038545437 /nfs/dbraw/zinc/54/54/37/1038545437.db2.gz XNNOWYHZQMBZDO-KLHJMIIUSA-N 2 1 356.466 2.774 20 10 FFCDMP Oc1ccccc1C[NH+]1CCC([NH2+]C2CCC([NH+]3CCOCC3)CC2)CC1 ZINC001256680800 1038600768 /nfs/dbraw/zinc/60/07/68/1038600768.db2.gz DMNMOTBPPSISAQ-UHFFFAOYSA-N 3 1 373.541 2.590 20 10 FFCDMP C[C@H]1C[C@@H]([NH+]2CCN(c3ccc(OCc4cccnc4)cc3)CC2)CC[NH2+]1 ZINC001246998874 1039569464 /nfs/dbraw/zinc/56/94/64/1039569464.db2.gz HFFGQHCYSOSFQI-RXVVDRJESA-N 2 1 366.509 2.923 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4cc[nH]n4)C3)cc2F)CC1 ZINC001253990220 1040496341 /nfs/dbraw/zinc/49/63/41/1040496341.db2.gz PJKLBLCTSSHWBH-KRWDZBQOSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)cc2F)CC1 ZINC001253990220 1040496351 /nfs/dbraw/zinc/49/63/51/1040496351.db2.gz PJKLBLCTSSHWBH-KRWDZBQOSA-N 2 1 357.477 2.680 20 10 FFCDMP COCCOC[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(N(C)C)cc3)C[C@H]2CC1 ZINC001279149957 1042920457 /nfs/dbraw/zinc/92/04/57/1042920457.db2.gz PJDYOSZEZHRHAJ-BGYRXZFFSA-N 2 1 361.530 2.517 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(N(C)C)cc3)C[C@H]2CC1 ZINC001279149957 1042920459 /nfs/dbraw/zinc/92/04/59/1042920459.db2.gz PJDYOSZEZHRHAJ-BGYRXZFFSA-N 2 1 361.530 2.517 20 10 FFCDMP COCCOC[NH+]1CC[C@H]2C[N@H+](Cc3ccc(N(C)C)cc3)C[C@H]2CC1 ZINC001279149957 1042920464 /nfs/dbraw/zinc/92/04/64/1042920464.db2.gz PJDYOSZEZHRHAJ-BGYRXZFFSA-N 2 1 361.530 2.517 20 10 FFCDMP CN(C)c1ccc(C[N@@H+]2[C@@H]3C[C@H]2CN(CC[NH+](C)C)C3)c2ccccc21 ZINC001279222740 1042951230 /nfs/dbraw/zinc/95/12/30/1042951230.db2.gz XVHHPRANZXSZBY-KDURUIRLSA-N 2 1 352.526 2.726 20 10 FFCDMP Cc1cccc(O)c1C[NH+]1CC[C@H]2[C@H](C[C@@H](Cn3cncn3)[N@@H+]2C(C)C)C1 ZINC001237488792 1043202959 /nfs/dbraw/zinc/20/29/59/1043202959.db2.gz QBUPIOPLNQZIHT-HBFSDRIKSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1cccc(O)c1C[N@@H+]1CC[C@H]2[C@H](C[C@@H](Cn3cncn3)[NH+]2C(C)C)C1 ZINC001237488792 1043202963 /nfs/dbraw/zinc/20/29/63/1043202963.db2.gz QBUPIOPLNQZIHT-HBFSDRIKSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1cccc(O)c1C[N@H+]1CC[C@H]2[C@H](C[C@@H](Cn3cncn3)[NH+]2C(C)C)C1 ZINC001237488792 1043202977 /nfs/dbraw/zinc/20/29/77/1043202977.db2.gz QBUPIOPLNQZIHT-HBFSDRIKSA-N 2 1 369.513 2.666 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)cc2F)CC1 ZINC001319701136 1045244021 /nfs/dbraw/zinc/24/40/21/1045244021.db2.gz CQXBZAHAJGFIFX-GOSISDBHSA-N 2 1 357.477 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](n4ccnc4)C3)cc2F)CC1 ZINC001319701136 1045244031 /nfs/dbraw/zinc/24/40/31/1045244031.db2.gz CQXBZAHAJGFIFX-GOSISDBHSA-N 2 1 357.477 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@](C)(CO)c3ccccc3)cc2F)CC1 ZINC001324311360 1045964733 /nfs/dbraw/zinc/96/47/33/1045964733.db2.gz ALINEWUXAIADNK-OAQYLSRUSA-N 2 1 357.473 2.575 20 10 FFCDMP CN1Cc2ccccc2[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001323023874 1046312443 /nfs/dbraw/zinc/31/24/43/1046312443.db2.gz AABOGHRWZPMRQZ-NRFANRHFSA-N 2 1 368.500 2.854 20 10 FFCDMP C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001328086415 1048171424 /nfs/dbraw/zinc/17/14/24/1048171424.db2.gz SDVBVVKEEJTOSJ-VGOFRKELSA-N 2 1 371.500 2.832 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C3CCC3)[C@H]3CCOC3)cc2F)CC1 ZINC001331966695 1048190110 /nfs/dbraw/zinc/19/01/10/1048190110.db2.gz UCQXRRYOOWFPRB-RXVVDRJESA-N 2 1 361.505 2.872 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3C[C@H]3C3CCOCC3)cc2F)CC1 ZINC001351781565 1054996114 /nfs/dbraw/zinc/99/61/14/1054996114.db2.gz BSIYGFVBRGJWQB-OALUTQOASA-N 2 1 361.505 2.730 20 10 FFCDMP CCc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000848898793 1055324496 /nfs/dbraw/zinc/32/44/96/1055324496.db2.gz YLAFFVFLBPOFDS-LEWJYISDSA-N 2 1 354.494 2.927 20 10 FFCDMP CCc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000848898793 1055324513 /nfs/dbraw/zinc/32/45/13/1055324513.db2.gz YLAFFVFLBPOFDS-LEWJYISDSA-N 2 1 354.494 2.927 20 10 FFCDMP CCC(CC)(CCO)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001461259928 1061271364 /nfs/dbraw/zinc/27/13/64/1061271364.db2.gz BCWSJNPNQDNZNE-UHFFFAOYSA-N 2 1 351.510 2.856 20 10 FFCDMP COc1cc(C)c(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)c(O)c1 ZINC001461994300 1061472887 /nfs/dbraw/zinc/47/28/87/1061472887.db2.gz GTJSNIILNDRYHB-IBGZPJMESA-N 2 1 370.493 2.956 20 10 FFCDMP C[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1O ZINC000282404465 510963002 /nfs/dbraw/zinc/96/30/02/510963002.db2.gz RUTXQVAQRRUYJN-CYBMUJFWSA-N 2 1 370.335 2.831 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH+]2CCC3(CO[C@H](C[NH3+])C3)CC2)c1 ZINC000904392740 736248257 /nfs/dbraw/zinc/24/82/57/736248257.db2.gz YQICBOYNYPJACX-AWEZNQCLSA-N 2 1 369.303 2.793 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817864734 742219305 /nfs/dbraw/zinc/21/93/05/742219305.db2.gz BAYDITDTRDBMIC-WZRBSPASSA-N 2 1 357.292 2.969 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817864734 742219306 /nfs/dbraw/zinc/21/93/06/742219306.db2.gz BAYDITDTRDBMIC-WZRBSPASSA-N 2 1 357.292 2.969 20 10 FFCDMP COC[C@]1(C[NH2+][C@H](C)c2cc(Br)cc(C)c2O)CCC[NH2+]1 ZINC000817974291 742225918 /nfs/dbraw/zinc/22/59/18/742225918.db2.gz KODVWQRITBWDJM-MLGOLLRUSA-N 2 1 357.292 2.882 20 10 FFCDMP COc1cc(Br)cc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c1O ZINC000843120213 747776830 /nfs/dbraw/zinc/77/68/30/747776830.db2.gz ZGZVOYGWUUQWDJ-UHFFFAOYSA-N 2 1 355.276 2.739 20 10 FFCDMP Cc1cc(Br)cc(C[N@H+]2C[C@@H](C[NH3+])C3(C2)CCOCC3)c1O ZINC000843125513 747777650 /nfs/dbraw/zinc/77/76/50/747777650.db2.gz XLQKPDYSNUOYFO-CQSZACIVSA-N 2 1 369.303 2.650 20 10 FFCDMP CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1O ZINC000846227111 748434116 /nfs/dbraw/zinc/43/41/16/748434116.db2.gz GSSYBJUFFCGCDH-KBAYOESNSA-N 2 1 350.434 2.595 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cc1Br ZINC001206011581 1032108338 /nfs/dbraw/zinc/10/83/38/1032108338.db2.gz FAUTZOWZIXJFMR-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2Cl)CCC[C@H]1C[NH3+] ZINC001206027868 1032114533 /nfs/dbraw/zinc/11/45/33/1032114533.db2.gz WZRJOWQKLFFCQU-HOTGVXAUSA-N 2 1 351.922 2.983 20 10 FFCDMP CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1N[C@H](C)[C@H]1C[NH2+]CCO1)N=[N+]=[N-] ZINC001170563397 994312568 /nfs/dbraw/zinc/31/25/68/994312568.db2.gz LWCWQTGMCYXKDP-CJKKJBIBSA-N 2 1 374.445 2.702 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)c(O)c1 ZINC001144508667 998610195 /nfs/dbraw/zinc/61/01/95/998610195.db2.gz UWBHSDWDHJNGDF-UHFFFAOYSA-N 2 1 358.438 2.885 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515479 998627365 /nfs/dbraw/zinc/62/73/65/998627365.db2.gz PZLQAGGYENWKOX-DLBZAZTESA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515479 998627368 /nfs/dbraw/zinc/62/73/68/998627368.db2.gz PZLQAGGYENWKOX-DLBZAZTESA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001144515479 998627371 /nfs/dbraw/zinc/62/73/71/998627371.db2.gz PZLQAGGYENWKOX-DLBZAZTESA-N 2 1 354.450 2.757 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCCC3)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000768465734 1000263792 /nfs/dbraw/zinc/26/37/92/1000263792.db2.gz RLNXPYWOWKHKCA-UWJYYQICSA-N 2 1 357.542 2.729 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)c1O ZINC001205570619 1003950463 /nfs/dbraw/zinc/95/04/63/1003950463.db2.gz MLWLTQJOSQCUGD-HNNXBMFYSA-N 2 1 361.255 2.816 20 10 FFCDMP C[C@H](CN1C[C@H](C)C[C@@H](C)C1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677366 1005003624 /nfs/dbraw/zinc/00/36/24/1005003624.db2.gz ALYUPMOOZROXIG-VAMGGRTRSA-N 2 1 358.574 2.894 20 10 FFCDMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001201625548 1005245291 /nfs/dbraw/zinc/24/52/91/1005245291.db2.gz BNNVBCLYPYCLCH-NRFANRHFSA-N 2 1 352.478 2.868 20 10 FFCDMP Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C2)nc1 ZINC000858012758 1008277258 /nfs/dbraw/zinc/27/72/58/1008277258.db2.gz LMVIVWGYJUDKPH-OAQYLSRUSA-N 2 1 366.509 2.795 20 10 FFCDMP CN(C)c1ccc(CNC(=O)C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000859213710 1008488462 /nfs/dbraw/zinc/48/84/62/1008488462.db2.gz AHBRUSAXQRTKSI-UHFFFAOYSA-N 2 1 368.525 2.562 20 10 FFCDMP CN(C)c1ccc(CNC(=O)C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000859213710 1008488465 /nfs/dbraw/zinc/48/84/65/1008488465.db2.gz AHBRUSAXQRTKSI-UHFFFAOYSA-N 2 1 368.525 2.562 20 10 FFCDMP CC(C)C[N@H+](Cc1cnn(C)c1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117782798 1021884520 /nfs/dbraw/zinc/88/45/20/1021884520.db2.gz RSDCPRCDKSICNH-UHFFFAOYSA-N 2 1 373.520 2.969 20 10 FFCDMP CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117782798 1021884540 /nfs/dbraw/zinc/88/45/40/1021884540.db2.gz RSDCPRCDKSICNH-UHFFFAOYSA-N 2 1 373.520 2.969 20 10 FFCDMP C[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756561221 1023728022 /nfs/dbraw/zinc/72/80/22/1023728022.db2.gz CSQMDQSOMCESTP-INIZCTEOSA-N 2 1 373.541 2.864 20 10 FFCDMP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(F)cc1O ZINC000756640482 1023739326 /nfs/dbraw/zinc/73/93/26/1023739326.db2.gz BKXPTCLTYHONIX-AWEZNQCLSA-N 2 1 365.493 2.809 20 10 FFCDMP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn1C ZINC000840908517 1029918240 /nfs/dbraw/zinc/91/82/40/1029918240.db2.gz SCEQYXSMZISRPH-UHFFFAOYSA-N 2 1 353.514 2.550 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045360 1029999228 /nfs/dbraw/zinc/99/92/28/1029999228.db2.gz KGLCABMQESXADY-VOQZNFBZSA-N 2 1 352.526 2.863 20 10 FFCDMP Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000798960955 1031595996 /nfs/dbraw/zinc/59/59/96/1031595996.db2.gz ONCHFOFHACCDAK-NRFANRHFSA-N 2 1 353.514 2.899 20 10 FFCDMP COc1cc(C[NH+]2CCN(c3ccccc3)CC2)cc(C[NH+](C)C)c1O ZINC001139253145 1035030146 /nfs/dbraw/zinc/03/01/46/1035030146.db2.gz NMVBTQCRFSCKSY-UHFFFAOYSA-N 2 1 355.482 2.785 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](c3noc(C)n3)C2)cc(C[NH+](C)C)c1O ZINC001139254057 1035030785 /nfs/dbraw/zinc/03/07/85/1035030785.db2.gz CLWNMMVNYADXFV-HNNXBMFYSA-N 2 1 360.458 2.533 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](CC(=O)OC)C3)cc2)CC1 ZINC001140305939 1035427610 /nfs/dbraw/zinc/42/76/10/1035427610.db2.gz IVDYNUXSJXXLPU-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](CCC(=O)OC)C3)cc2)CC1 ZINC001140306600 1035428273 /nfs/dbraw/zinc/42/82/73/1035428273.db2.gz VCFVSYCLEQGCNI-IBGZPJMESA-N 2 1 359.514 2.604 20 10 FFCDMP CCOC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306709 1035428280 /nfs/dbraw/zinc/42/82/80/1035428280.db2.gz VOZOAYSOQFNFER-WIYYLYMNSA-N 2 1 373.541 2.992 20 10 FFCDMP CCOC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140306709 1035428282 /nfs/dbraw/zinc/42/82/82/1035428282.db2.gz VOZOAYSOQFNFER-WIYYLYMNSA-N 2 1 373.541 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000835039840 1035491629 /nfs/dbraw/zinc/49/16/29/1035491629.db2.gz KIQABTTXOFDTLO-MFJULSPGSA-N 2 1 365.521 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000835039840 1035491632 /nfs/dbraw/zinc/49/16/32/1035491632.db2.gz KIQABTTXOFDTLO-MFJULSPGSA-N 2 1 365.521 2.992 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001140620388 1035746522 /nfs/dbraw/zinc/74/65/22/1035746522.db2.gz MKONSHJMOMYDBK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001140620388 1035746532 /nfs/dbraw/zinc/74/65/32/1035746532.db2.gz MKONSHJMOMYDBK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001140620388 1035746549 /nfs/dbraw/zinc/74/65/49/1035746549.db2.gz MKONSHJMOMYDBK-DENIHFKCSA-N 2 1 367.493 2.819 20 10 FFCDMP COCC[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH+](C)CC1 ZINC001141076211 1036925483 /nfs/dbraw/zinc/92/54/83/1036925483.db2.gz MSYDRZWMSPHRCG-UHFFFAOYSA-N 2 1 357.542 2.928 20 10 FFCDMP COCC[N@@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH+](C)CC1 ZINC001141076211 1036925498 /nfs/dbraw/zinc/92/54/98/1036925498.db2.gz MSYDRZWMSPHRCG-UHFFFAOYSA-N 2 1 357.542 2.928 20 10 FFCDMP Oc1cc2c(cc1C[NH+]1CCN(c3ccccc3Cl)CC1)C[NH2+]CCO2 ZINC001235819725 1037768195 /nfs/dbraw/zinc/76/81/95/1037768195.db2.gz HHDXEFZDJIRCEY-UHFFFAOYSA-N 2 1 373.884 2.850 20 10 FFCDMP CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236113304 1037937064 /nfs/dbraw/zinc/93/70/64/1037937064.db2.gz RGVNSMOQOGMXMZ-UHFFFAOYSA-N 2 1 353.510 2.869 20 10 FFCDMP COCCN1CCOC[C@@]2(CCC[N@@H+](Cc3c(C)cc(C)cc3O)C2)C1 ZINC001231844983 1037943253 /nfs/dbraw/zinc/94/32/53/1037943253.db2.gz VBUCIAGYARZBRC-NRFANRHFSA-N 2 1 362.514 2.570 20 10 FFCDMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC2CCC2)CC1 ZINC001236539221 1038125293 /nfs/dbraw/zinc/12/52/93/1038125293.db2.gz APIHJQBHQXRRMT-WGSAOQKQSA-N 3 1 359.514 2.746 20 10 FFCDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc3c(cc2[O-])OCC[NH2+]C3)CC2CCC2)CC1 ZINC001236539221 1038125302 /nfs/dbraw/zinc/12/53/02/1038125302.db2.gz APIHJQBHQXRRMT-WGSAOQKQSA-N 2 1 359.514 2.746 20 10 FFCDMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc3c(cc2[O-])OCC[NH2+]C3)CC2CCC2)CC1 ZINC001236539221 1038125306 /nfs/dbraw/zinc/12/53/06/1038125306.db2.gz APIHJQBHQXRRMT-WGSAOQKQSA-N 2 1 359.514 2.746 20 10 FFCDMP CC(C)C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1O)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551031 1038126477 /nfs/dbraw/zinc/12/64/77/1038126477.db2.gz JRFILCVVLSBDRY-WGSAOQKQSA-N 3 1 360.546 2.530 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+](CCO)Cc3cccs3)c(F)c2)CC1 ZINC001236940417 1038369043 /nfs/dbraw/zinc/36/90/43/1038369043.db2.gz QCRUFCPZGYQUHI-UHFFFAOYSA-N 2 1 363.502 2.634 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)Cc3cccs3)c(F)c2)CC1 ZINC001236940417 1038369053 /nfs/dbraw/zinc/36/90/53/1038369053.db2.gz QCRUFCPZGYQUHI-UHFFFAOYSA-N 2 1 363.502 2.634 20 10 FFCDMP COc1ccc(N2CC[NH+](CCCN[C@@H]3CC[NH2+][C@@H](C(C)C)C3)CC2)cc1 ZINC001246185117 1039268718 /nfs/dbraw/zinc/26/87/18/1039268718.db2.gz SFBFQWJTAWPANX-DENIHFKCSA-N 2 1 374.573 2.574 20 10 FFCDMP Cc1cc(C[NH+]2CCC3(C[NH+](Cc4cn[nH]c4)C3)CC2)ccc1N(C)C ZINC001278685567 1039760576 /nfs/dbraw/zinc/76/05/76/1039760576.db2.gz APHYSAWRQXKDLM-UHFFFAOYSA-N 2 1 353.514 2.882 20 10 FFCDMP Cc1cc(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4O)C[C@H]3CC2)n(C)n1 ZINC001278552229 1041118358 /nfs/dbraw/zinc/11/83/58/1041118358.db2.gz RQXNBGCHKFIKGW-HDICACEKSA-N 2 1 354.498 2.778 20 10 FFCDMP Cc1cc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4O)C[C@H]3CC2)n(C)n1 ZINC001278552229 1041118363 /nfs/dbraw/zinc/11/83/63/1041118363.db2.gz RQXNBGCHKFIKGW-HDICACEKSA-N 2 1 354.498 2.778 20 10 FFCDMP Cc1cc(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4O)C[C@H]3CC2)n(C)n1 ZINC001278552229 1041118369 /nfs/dbraw/zinc/11/83/69/1041118369.db2.gz RQXNBGCHKFIKGW-HDICACEKSA-N 2 1 354.498 2.778 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCC34CCOCC4)cc2F)CC1 ZINC001261851478 1041447083 /nfs/dbraw/zinc/44/70/83/1041447083.db2.gz VNLBGNUAMHNWFH-SFHVURJKSA-N 2 1 361.505 2.874 20 10 FFCDMP CC[N@@H+](C)C(C)(C)C(=O)N1C[C@@H](C)[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1 ZINC001214997924 1041638426 /nfs/dbraw/zinc/63/84/26/1041638426.db2.gz OKHLHDXCDUJYMD-SJLPKXTDSA-N 2 1 361.530 2.670 20 10 FFCDMP COCCOC[N@@H+]1CCCC2(CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001279337992 1043010801 /nfs/dbraw/zinc/01/08/01/1043010801.db2.gz DYWQHPSZWGPKOW-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP COCCOC[N@H+]1CCCC2(CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001279337992 1043010805 /nfs/dbraw/zinc/01/08/05/1043010805.db2.gz DYWQHPSZWGPKOW-UHFFFAOYSA-N 2 1 362.514 2.999 20 10 FFCDMP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c(O)c1 ZINC001321079595 1045537496 /nfs/dbraw/zinc/53/74/96/1045537496.db2.gz JDCUHQZIMRJSIH-UHFFFAOYSA-N 2 1 359.445 2.582 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3Cc4ccccc4O3)cc2F)CC1 ZINC001200161964 1055908729 /nfs/dbraw/zinc/90/87/29/1055908729.db2.gz UMOMTRJOGOSHRE-SFHVURJKSA-N 2 1 355.457 2.671 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)[C@H](c2ccccc2)[NH+](C)C)[NH+](C)C)cc1 ZINC001456927149 1060229069 /nfs/dbraw/zinc/22/90/69/1060229069.db2.gz ALHWDBKMCTZFMN-SFTDATJTSA-N 2 1 368.525 2.774 20 10 FFCDMP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1OC ZINC001473910915 1065418251 /nfs/dbraw/zinc/41/82/51/1065418251.db2.gz HGUDQQHCRRHNJC-UHFFFAOYSA-N 2 1 373.472 2.885 20 10 FFCDMP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)CC1 ZINC000093132718 508122786 /nfs/dbraw/zinc/12/27/86/508122786.db2.gz UYJIKRPLYGTOQN-JOCHJYFZSA-N 2 1 356.558 2.889 20 10 FFCDMP COc1ccc(N2CCC([NH2+]CC3CCN(CC[NH+](C)C)CC3)CC2)cc1 ZINC000124431492 508831159 /nfs/dbraw/zinc/83/11/59/508831159.db2.gz YREFUDPSWUDGEA-UHFFFAOYSA-N 2 1 374.573 2.527 20 10 FFCDMP CCCOc1ccc(C[N@@H+](C)C2CCN(CCn3cccn3)CC2)c([O-])c1 ZINC000121226747 509153439 /nfs/dbraw/zinc/15/34/39/509153439.db2.gz HMHNCBCQUIUJSV-UHFFFAOYSA-N 2 1 372.513 2.974 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246113616 510301254 /nfs/dbraw/zinc/30/12/54/510301254.db2.gz JWBQLYQBLVSSJW-UGKGYDQZSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246113616 510301261 /nfs/dbraw/zinc/30/12/61/510301261.db2.gz JWBQLYQBLVSSJW-UGKGYDQZSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246113616 510301269 /nfs/dbraw/zinc/30/12/69/510301269.db2.gz JWBQLYQBLVSSJW-UGKGYDQZSA-N 2 1 355.526 2.972 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+][C@@H]2CNCC3(CCOCC3)C2)c1O ZINC000903972906 736196867 /nfs/dbraw/zinc/19/68/67/736196867.db2.gz MDOLQPAESDMBNS-HNNXBMFYSA-N 2 1 369.303 2.711 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)cc(F)c1O ZINC000756779223 736361118 /nfs/dbraw/zinc/36/11/18/736361118.db2.gz RMGIJFZXJCORHS-GFCCVEGCSA-N 2 1 351.397 2.857 20 10 FFCDMP CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809738329 741338515 /nfs/dbraw/zinc/33/85/15/741338515.db2.gz USNYDXXUNDZKSN-KRWDZBQOSA-N 2 1 369.937 2.902 20 10 FFCDMP COc1ccc(N2CC[C@@H](C[NH2+]Cc3ncc(C[NH+](C)C)s3)C2)cc1 ZINC000818222533 742251116 /nfs/dbraw/zinc/25/11/16/742251116.db2.gz UPVBPTXNMJHUGF-HNNXBMFYSA-N 2 1 360.527 2.829 20 10 FFCDMP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@](C)(C(F)F)O1 ZINC000827955263 745007584 /nfs/dbraw/zinc/00/75/84/745007584.db2.gz CMUWLJAUHCKPJG-KXBFYZLASA-N 2 1 353.457 2.683 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@](C)(C(F)F)O1 ZINC000827955263 745007587 /nfs/dbraw/zinc/00/75/87/745007587.db2.gz CMUWLJAUHCKPJG-KXBFYZLASA-N 2 1 353.457 2.683 20 10 FFCDMP Brc1cc(C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)ccc1N1CCCCC1 ZINC000841081771 747265054 /nfs/dbraw/zinc/26/50/54/747265054.db2.gz YJMTZYUJCFETBQ-HALDLXJZSA-N 2 1 350.304 2.747 20 10 FFCDMP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000841099531 747268899 /nfs/dbraw/zinc/26/88/99/747268899.db2.gz LGIWARDQFRQSGB-NVXWUHKLSA-N 2 1 369.303 2.873 20 10 FFCDMP COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1O ZINC000844910434 748134720 /nfs/dbraw/zinc/13/47/20/748134720.db2.gz IBKRXVCHAFMWRK-BZUAXINKSA-N 2 1 354.878 2.915 20 10 FFCDMP OC1CCN(c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2)CC1 ZINC000876771004 1014385995 /nfs/dbraw/zinc/38/59/95/1014385995.db2.gz SISHHXBECUKUTH-HXUWFJFHSA-N 2 1 357.542 2.956 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1 ZINC000922391240 988548886 /nfs/dbraw/zinc/54/88/86/988548886.db2.gz AEVNPGIDRYPAOH-WLRLJWMZSA-N 2 1 362.514 2.750 20 10 FFCDMP CC[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)CC1 ZINC000917075093 990117542 /nfs/dbraw/zinc/11/75/42/990117542.db2.gz PUVMCLLPJOWTHL-UHFFFAOYSA-N 2 1 360.546 2.564 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@](O)(C(F)(F)F)CC3)cc2)CC1 ZINC000809705601 994585999 /nfs/dbraw/zinc/58/59/99/994585999.db2.gz WEDUJKIDTDOTAE-SFHVURJKSA-N 2 1 371.447 2.718 20 10 FFCDMP COc1ccc([C@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000844220941 997711335 /nfs/dbraw/zinc/71/13/35/997711335.db2.gz RCNSXQGIOZMHED-HXUWFJFHSA-N 2 1 369.509 2.706 20 10 FFCDMP Cc1c(C[C@@H](C[NH3+])C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cnn1C ZINC000903879881 1016284044 /nfs/dbraw/zinc/28/40/44/1016284044.db2.gz LHJYYSORARGYFK-SFHVURJKSA-N 2 1 355.530 2.577 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000741258906 999716963 /nfs/dbraw/zinc/71/69/63/999716963.db2.gz QWDWZHCEBKPJON-OAQYLSRUSA-N 2 1 357.473 2.618 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000741258906 999716965 /nfs/dbraw/zinc/71/69/65/999716965.db2.gz QWDWZHCEBKPJON-OAQYLSRUSA-N 2 1 357.473 2.618 20 10 FFCDMP CCOC(=O)[C@@H](CC)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000787438583 1001690962 /nfs/dbraw/zinc/69/09/62/1001690962.db2.gz DIPOSOUVFSHAOH-HXUWFJFHSA-N 2 1 359.514 2.745 20 10 FFCDMP CCOC(=O)[C@@H](CC)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000787438583 1001690964 /nfs/dbraw/zinc/69/09/64/1001690964.db2.gz DIPOSOUVFSHAOH-HXUWFJFHSA-N 2 1 359.514 2.745 20 10 FFCDMP COc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(Br)c1 ZINC001205654891 1004669289 /nfs/dbraw/zinc/66/92/89/1004669289.db2.gz XZRQWSXLBAELNQ-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1cc(C[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000850284961 1005802674 /nfs/dbraw/zinc/80/26/74/1005802674.db2.gz OGBVWSYOYVHHMH-UHFFFAOYSA-N 2 1 363.546 2.814 20 10 FFCDMP COc1ccc(N2CC[C@@H]([NH2+]C3CC[NH+](C[C@H]4CCCO4)CC3)C2)cc1 ZINC000850488876 1005818494 /nfs/dbraw/zinc/81/84/94/1005818494.db2.gz VMVZNIKKROBRBK-WIYYLYMNSA-N 2 1 359.514 2.507 20 10 FFCDMP COc1cccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1O ZINC000850508057 1005819381 /nfs/dbraw/zinc/81/93/81/1005819381.db2.gz KDGYCNHDYQUEST-CRAIPNDOSA-N 2 1 356.466 2.818 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccn(-c4ccccc4)n3)cc2)CC1 ZINC000883283531 1006729930 /nfs/dbraw/zinc/72/99/30/1006729930.db2.gz IVFKGEXKUCCSRR-UHFFFAOYSA-N 2 1 361.493 2.914 20 10 FFCDMP C[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(N2CCCCCC2)cc1 ZINC000854231233 1006734936 /nfs/dbraw/zinc/73/49/36/1006734936.db2.gz HLOPQAFABQFHFB-HNNXBMFYSA-N 2 1 355.486 2.872 20 10 FFCDMP CC[NH+]1CCC(N2CCC[N@@H+](Cc3c(O)ccc4ccncc43)CC2)CC1 ZINC000817372871 1007567985 /nfs/dbraw/zinc/56/79/85/1007567985.db2.gz MSZQGLNRUSBFNL-UHFFFAOYSA-N 2 1 368.525 2.932 20 10 FFCDMP CN(C)c1ccc([C@H](N)C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000817942907 1007818199 /nfs/dbraw/zinc/81/81/99/1007818199.db2.gz RMRASBAXCXJMNN-SJBKTWHCSA-N 2 1 366.509 2.598 20 10 FFCDMP Cc1ccc(C)c(C[N@@H+]2CCCC[C@]23CC(=O)N(CC[NH+](C)C)C3)c1O ZINC001275771911 1012991713 /nfs/dbraw/zinc/99/17/13/1012991713.db2.gz TWVHPVJWWHYZNV-OAQYLSRUSA-N 2 1 359.514 2.528 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CO)c3ccc(F)cc3)cc2F)CC1 ZINC001117748074 1021856039 /nfs/dbraw/zinc/85/60/39/1021856039.db2.gz YDWHKFUQTMUOST-LJQANCHMSA-N 2 1 361.436 2.540 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](c4cccnc4)C3)cc2F)CC1 ZINC001118202268 1022117006 /nfs/dbraw/zinc/11/70/06/1022117006.db2.gz UFZJCGIPFVYJKX-IBGZPJMESA-N 2 1 354.473 2.962 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4cccnc4)C3)cc2F)CC1 ZINC001118202268 1022117015 /nfs/dbraw/zinc/11/70/15/1022117015.db2.gz UFZJCGIPFVYJKX-IBGZPJMESA-N 2 1 354.473 2.962 20 10 FFCDMP COc1cc(O)c(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1OC ZINC000843429564 1031400810 /nfs/dbraw/zinc/40/08/10/1031400810.db2.gz GOHRYEODSUHZHW-MSOLQXFVSA-N 2 1 356.466 2.844 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2)CC1 ZINC000798957057 1031595483 /nfs/dbraw/zinc/59/54/83/1031595483.db2.gz KGBYQCMJPDIVDR-UHFFFAOYSA-N 3 1 356.558 2.746 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2)CC1 ZINC000798957057 1031595491 /nfs/dbraw/zinc/59/54/91/1031595491.db2.gz KGBYQCMJPDIVDR-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC4(CC[NH+](C)CC4)C3)cc2)CC1 ZINC000798957057 1031595502 /nfs/dbraw/zinc/59/55/02/1031595502.db2.gz KGBYQCMJPDIVDR-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP Cc1c(C[NH+]2CCN(CC3CC[NH+](C)CC3)CC2)c2ccccc2n1C ZINC001138259137 1034031038 /nfs/dbraw/zinc/03/10/38/1034031038.db2.gz CFMJELCBUVJNTB-UHFFFAOYSA-N 2 1 354.542 2.946 20 10 FFCDMP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1 ZINC000832272944 1034694203 /nfs/dbraw/zinc/69/42/03/1034694203.db2.gz KHNSLJWFNSLXCA-LEWJYISDSA-N 2 1 366.509 2.533 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@]1(O)C(F)(F)F ZINC001139408740 1035092280 /nfs/dbraw/zinc/09/22/80/1035092280.db2.gz PWFNIOSZSKAOSX-MAUKXSAKSA-N 2 1 371.447 2.574 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC4(C3)CC[NH+](C)CC4)cc2)CC1 ZINC001140306026 1035427562 /nfs/dbraw/zinc/42/75/62/1035427562.db2.gz LBBMMTXTMXJSLT-UHFFFAOYSA-N 3 1 356.558 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](NC(=O)C(C)C)C3)cc2)CC1 ZINC001140309891 1035429801 /nfs/dbraw/zinc/42/98/01/1035429801.db2.gz ZELLXSUNNOQSIV-HXUWFJFHSA-N 2 1 372.557 2.565 20 10 FFCDMP c1cn2c(n1)[C@@H]([NH2+]Cc1ccc(N3CC[NH+](CC4CC4)CC3)cc1)CC2 ZINC000834697336 1035431423 /nfs/dbraw/zinc/43/14/23/1035431423.db2.gz ITEZOYDZSWHYPB-FQEVSTJZSA-N 2 1 351.498 2.650 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@@H+](Cc1cc(C)ccc1O)CCC2 ZINC001140620245 1035744567 /nfs/dbraw/zinc/74/45/67/1035744567.db2.gz HTUAGFGMBVOCDY-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP CC[NH+](CC)Cc1cc(=O)n2c(n1)C[N@H+](Cc1cc(C)ccc1O)CCC2 ZINC001140620245 1035744580 /nfs/dbraw/zinc/74/45/80/1035744580.db2.gz HTUAGFGMBVOCDY-UHFFFAOYSA-N 2 1 370.497 2.505 20 10 FFCDMP Cc1c[nH+]ccc1N1CC[NH+](Cc2ccc(N3CCOCC3)cc2F)CC1 ZINC001140667466 1035828959 /nfs/dbraw/zinc/82/89/59/1035828959.db2.gz UCQOPMNXIPEDDM-UHFFFAOYSA-N 2 1 370.472 2.688 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001140948052 1036539121 /nfs/dbraw/zinc/53/91/21/1036539121.db2.gz QSXXYQUCPCDKGK-GOSISDBHSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001140948052 1036539134 /nfs/dbraw/zinc/53/91/34/1036539134.db2.gz QSXXYQUCPCDKGK-GOSISDBHSA-N 2 1 360.498 2.940 20 10 FFCDMP COC(=O)CC[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235693126 1037687076 /nfs/dbraw/zinc/68/70/76/1037687076.db2.gz RZUNOWFZYBCSTI-UHFFFAOYSA-N 2 1 367.493 2.662 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCN[C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855545 1037797814 /nfs/dbraw/zinc/79/78/14/1037797814.db2.gz UFROIRYLUIHPAF-HSZRJFAPSA-N 2 1 364.537 2.975 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CC[NH2+][C@@H](c4ccccc4)C3)cc2)CC1 ZINC001235855545 1037797832 /nfs/dbraw/zinc/79/78/32/1037797832.db2.gz UFROIRYLUIHPAF-HSZRJFAPSA-N 2 1 364.537 2.975 20 10 FFCDMP Cc1ccc([C@@]2(C)C[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)CCO2)cc1 ZINC001235948383 1037850090 /nfs/dbraw/zinc/85/00/90/1037850090.db2.gz MXTQUROUJLMPOZ-JOCHJYFZSA-N 2 1 368.477 2.930 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4ccncc4)C3)c(F)c2)CC1 ZINC001236937748 1038366787 /nfs/dbraw/zinc/36/67/87/1038366787.db2.gz DRRRHXWAJRAQML-SFHVURJKSA-N 2 1 354.473 2.962 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@@H+]1Cc1ccccc1 ZINC001256528275 1038544870 /nfs/dbraw/zinc/54/48/70/1038544870.db2.gz YOBKHFXZKXQDSY-QAPCUYQASA-N 2 1 356.466 2.989 20 10 FFCDMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(O)c(O)cc2O)CC[N@H+]1Cc1ccccc1 ZINC001256528275 1038544875 /nfs/dbraw/zinc/54/48/75/1038544875.db2.gz YOBKHFXZKXQDSY-QAPCUYQASA-N 2 1 356.466 2.989 20 10 FFCDMP Cc1ncsc1C[NH+]1CC2(C1)CC[NH+](Cc1cc(O)ccc1O)CC2 ZINC001278751151 1040471689 /nfs/dbraw/zinc/47/16/89/1040471689.db2.gz WJTWVPYGDGNRJH-UHFFFAOYSA-N 2 1 359.495 2.961 20 10 FFCDMP COC(=O)Cc1ccc(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c(O)c1 ZINC001249207705 1040628583 /nfs/dbraw/zinc/62/85/83/1040628583.db2.gz HDNLADSSFOLGDR-UHFFFAOYSA-N 2 1 364.461 2.506 20 10 FFCDMP COc1cccc(C[N@H+]2CCC[C@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001278562236 1041179581 /nfs/dbraw/zinc/17/95/81/1041179581.db2.gz AUIRPUMECDPIIV-NRFANRHFSA-N 2 1 361.530 2.640 20 10 FFCDMP Cc1cc(C[NH+]2CC3(CCN3CC[NH+](C)C)C2)c(C)n1-c1ccccc1 ZINC001279425693 1043099861 /nfs/dbraw/zinc/09/98/61/1043099861.db2.gz ULIMJUKRNBWKHZ-UHFFFAOYSA-N 2 1 352.526 2.916 20 10 FFCDMP C[NH+](C)CCN1C[C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)[C@@H]2C1 ZINC001279534481 1043232745 /nfs/dbraw/zinc/23/27/45/1043232745.db2.gz XQQLOLFMRZLIKM-RBBKRZOGSA-N 2 1 356.558 2.745 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1cc(Cl)c(Cl)cc1O)C2 ZINC001279665044 1043427828 /nfs/dbraw/zinc/42/78/28/1043427828.db2.gz JKSDBLUUNCVJDO-OCCSQVGLSA-N 2 1 358.313 2.767 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cc(Cl)c(Cl)cc1O)C2 ZINC001279665044 1043427837 /nfs/dbraw/zinc/42/78/37/1043427837.db2.gz JKSDBLUUNCVJDO-OCCSQVGLSA-N 2 1 358.313 2.767 20 10 FFCDMP Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1 ZINC001326130820 1046779111 /nfs/dbraw/zinc/77/91/11/1046779111.db2.gz WPGGTGAAHWBQKS-HXUWFJFHSA-N 2 1 371.500 2.579 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104157 1052259318 /nfs/dbraw/zinc/25/93/18/1052259318.db2.gz KCGOBNANNGNAKD-ICSRJNTNSA-N 2 1 360.521 2.542 20 10 FFCDMP Cc1ccc(C[N@@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c(O)c1 ZINC001308755027 1052495885 /nfs/dbraw/zinc/49/58/85/1052495885.db2.gz NWXNVYJWQQNWTL-UHFFFAOYSA-N 2 1 353.510 2.950 20 10 FFCDMP CCc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000848898800 1055325765 /nfs/dbraw/zinc/32/57/65/1055325765.db2.gz YLAFFVFLBPOFDS-SFTDATJTSA-N 2 1 354.494 2.927 20 10 FFCDMP CCc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1O ZINC000848898800 1055325782 /nfs/dbraw/zinc/32/57/82/1055325782.db2.gz YLAFFVFLBPOFDS-SFTDATJTSA-N 2 1 354.494 2.927 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH+]2CCC3(CO[C@@H](C[NH3+])C3)CC2)c1 ZINC000904392741 736248232 /nfs/dbraw/zinc/24/82/32/736248232.db2.gz YQICBOYNYPJACX-CQSZACIVSA-N 2 1 369.303 2.793 20 10 FFCDMP COC[C@@]1(C[NH2+][C@H](C)c2cc(Br)cc(C)c2O)CCC[NH2+]1 ZINC000817974294 742226186 /nfs/dbraw/zinc/22/61/86/742226186.db2.gz KODVWQRITBWDJM-WBMJQRKESA-N 2 1 357.292 2.882 20 10 FFCDMP C[NH+](C)CCN1CCC[C@]2(CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279106860 960396290 /nfs/dbraw/zinc/39/62/90/960396290.db2.gz GPTSNHBXIRVTCE-FQEVSTJZSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+](C)CCN1CCC[C@]2(CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)C1 ZINC001279106860 960396296 /nfs/dbraw/zinc/39/62/96/960396296.db2.gz GPTSNHBXIRVTCE-FQEVSTJZSA-N 2 1 367.484 2.910 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)cc2)CC1 ZINC001167964366 965148639 /nfs/dbraw/zinc/14/86/39/965148639.db2.gz PPNJJNBTUJFCPQ-BRTIRZTQSA-N 3 1 368.569 2.933 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)CC1 ZINC001167964366 965148647 /nfs/dbraw/zinc/14/86/47/965148647.db2.gz PPNJJNBTUJFCPQ-BRTIRZTQSA-N 2 1 368.569 2.933 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNC3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)cc2)CC1 ZINC001167964366 965148657 /nfs/dbraw/zinc/14/86/57/965148657.db2.gz PPNJJNBTUJFCPQ-BRTIRZTQSA-N 2 1 368.569 2.933 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(Br)c1 ZINC001206024981 1032112022 /nfs/dbraw/zinc/11/20/22/1032112022.db2.gz LWBYVGJYWDBUOY-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514772 998626198 /nfs/dbraw/zinc/62/61/98/998626198.db2.gz RMTHISFIFDPBTN-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514772 998626201 /nfs/dbraw/zinc/62/62/01/998626201.db2.gz RMTHISFIFDPBTN-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514772 998626204 /nfs/dbraw/zinc/62/62/04/998626204.db2.gz RMTHISFIFDPBTN-NRFANRHFSA-N 2 1 354.450 2.901 20 10 FFCDMP C[N@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873305 1016280248 /nfs/dbraw/zinc/28/02/48/1016280248.db2.gz GQWTVYWQLYXILH-HXUWFJFHSA-N 2 1 368.529 2.825 20 10 FFCDMP C[N@@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc(N2CCCCC2)cc1 ZINC000903873305 1016280253 /nfs/dbraw/zinc/28/02/53/1016280253.db2.gz GQWTVYWQLYXILH-HXUWFJFHSA-N 2 1 368.529 2.825 20 10 FFCDMP C[N@H+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000768465832 1000263624 /nfs/dbraw/zinc/26/36/24/1000263624.db2.gz MHIJMCKXQBVYNB-DYESRHJHSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000768465832 1000263628 /nfs/dbraw/zinc/26/36/28/1000263628.db2.gz MHIJMCKXQBVYNB-DYESRHJHSA-N 2 1 368.477 2.772 20 10 FFCDMP C[NH+](Cc1cc2c(cc1O)OC[C@H]2O)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000768465832 1000263633 /nfs/dbraw/zinc/26/36/33/1000263633.db2.gz MHIJMCKXQBVYNB-DYESRHJHSA-N 2 1 368.477 2.772 20 10 FFCDMP CC[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CN1C(C)=O ZINC000775720215 1003786585 /nfs/dbraw/zinc/78/65/85/1003786585.db2.gz IRRJOAJGLRUHGR-SFTDATJTSA-N 2 1 372.557 2.660 20 10 FFCDMP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817916273 1007809052 /nfs/dbraw/zinc/80/90/52/1007809052.db2.gz DNYBJRLQOGSYTN-YADHBBJMSA-N 3 1 356.558 2.839 20 10 FFCDMP COc1nsc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1Cl ZINC001203490719 1030727174 /nfs/dbraw/zinc/72/71/74/1030727174.db2.gz BPOQCNGRTOGTLO-UHFFFAOYSA-N 2 1 366.918 2.847 20 10 FFCDMP C[NH+]1CCC(COC[C@H]2CC[C@@H]3[C@@H](CC[N@H+]3Cc3ccccc3O)O2)CC1 ZINC001203552161 1030759588 /nfs/dbraw/zinc/75/95/88/1030759588.db2.gz CMULTUUKRNJXRM-KCZVDYSFSA-N 2 1 374.525 2.873 20 10 FFCDMP COc1ccc(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001203623418 1030791114 /nfs/dbraw/zinc/79/11/14/1030791114.db2.gz QBTIQNGFFVIKQR-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1ccc(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001203623418 1030791131 /nfs/dbraw/zinc/79/11/31/1030791131.db2.gz QBTIQNGFFVIKQR-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP COc1ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001203623418 1030791148 /nfs/dbraw/zinc/79/11/48/1030791148.db2.gz QBTIQNGFFVIKQR-WIYYLYMNSA-N 2 1 360.498 2.581 20 10 FFCDMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205579653 1031847932 /nfs/dbraw/zinc/84/79/32/1031847932.db2.gz PPVDWNRICKNGCI-SFHVURJKSA-N 2 1 355.885 2.830 20 10 FFCDMP CCOC(=O)C1(C)CC[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)CC1 ZINC001139258551 1035031723 /nfs/dbraw/zinc/03/17/23/1035031723.db2.gz RLSMTLADMZRBRU-UHFFFAOYSA-N 2 1 364.486 2.628 20 10 FFCDMP Cc1ccc(C)c(C[N@H+]2CCCn3cnc(COCC[NH+](C)C)c3C2)c1O ZINC001140178875 1035369856 /nfs/dbraw/zinc/36/98/56/1035369856.db2.gz AVYSYLIQQMOQMD-UHFFFAOYSA-N 2 1 372.513 2.690 20 10 FFCDMP CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304700 1035426099 /nfs/dbraw/zinc/42/60/99/1035426099.db2.gz YRTYEKIYEYYJMR-HXUWFJFHSA-N 2 1 359.514 2.746 20 10 FFCDMP CCOC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140304700 1035426101 /nfs/dbraw/zinc/42/61/01/1035426101.db2.gz YRTYEKIYEYYJMR-HXUWFJFHSA-N 2 1 359.514 2.746 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H](C(=O)OC)CC[C@H]3C)cc2)CC1 ZINC001140304073 1035426368 /nfs/dbraw/zinc/42/63/68/1035426368.db2.gz HEPGLZLGFQWBIL-MJGOQNOKSA-N 2 1 359.514 2.602 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)cc2)CC1 ZINC001140306235 1035427528 /nfs/dbraw/zinc/42/75/28/1035427528.db2.gz QAFNQJZPHRJTQY-JOCHJYFZSA-N 2 1 366.509 2.877 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3nc(C)no3)cc2)CC1 ZINC001140306738 1035428187 /nfs/dbraw/zinc/42/81/87/1035428187.db2.gz VZOFFZYMCGOZAD-IBGZPJMESA-N 2 1 355.486 2.857 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3c3nc(C)no3)cc2)CC1 ZINC001140306738 1035428189 /nfs/dbraw/zinc/42/81/89/1035428189.db2.gz VZOFFZYMCGOZAD-IBGZPJMESA-N 2 1 355.486 2.857 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3c3ncccn3)cc2)CC1 ZINC001140309780 1035429839 /nfs/dbraw/zinc/42/98/39/1035429839.db2.gz UKRCKNAYXLPUBE-FQEVSTJZSA-N 2 1 351.498 2.956 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3c3ncccn3)cc2)CC1 ZINC001140309780 1035429840 /nfs/dbraw/zinc/42/98/40/1035429840.db2.gz UKRCKNAYXLPUBE-FQEVSTJZSA-N 2 1 351.498 2.956 20 10 FFCDMP C[NH+]1CCN(C(=O)C2CC[NH+](Cc3cc(C(C)(C)C)ccc3O)CC2)CC1 ZINC001233286368 1036493281 /nfs/dbraw/zinc/49/32/81/1036493281.db2.gz QODFGFANTNYYDC-UHFFFAOYSA-N 2 1 373.541 2.676 20 10 FFCDMP COc1cc(O)c(C[N@@H+](C)CCC2CC[NH2+]CC2)c(Br)c1 ZINC001235717847 1037707547 /nfs/dbraw/zinc/70/75/47/1037707547.db2.gz NPHFEOMPAGPKQC-UHFFFAOYSA-N 2 1 357.292 2.985 20 10 FFCDMP Cc1cc(C)c(C[N@@H+]2CCc3nnc(CN4CCCCC4)n3CC2)c(O)c1 ZINC001231843839 1037940950 /nfs/dbraw/zinc/94/09/50/1037940950.db2.gz BRQLGLMPUBQCCL-UHFFFAOYSA-N 2 1 369.513 2.645 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](COCC4CC4)C3)c(F)c2)CC1 ZINC001236943149 1038370483 /nfs/dbraw/zinc/37/04/83/1038370483.db2.gz QAPUYRQGMCIOSS-GOSISDBHSA-N 2 1 361.505 2.826 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+](C3CCC3)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155896 1038456621 /nfs/dbraw/zinc/45/66/21/1038456621.db2.gz USTAPJDURWXXFU-JOCHJYFZSA-N 3 1 356.558 2.935 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C3CCC3)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237155896 1038456627 /nfs/dbraw/zinc/45/66/27/1038456627.db2.gz USTAPJDURWXXFU-JOCHJYFZSA-N 3 1 356.558 2.935 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@@H+]1Cc1ccccc1 ZINC001256524596 1038544745 /nfs/dbraw/zinc/54/47/45/1038544745.db2.gz XNNOWYHZQMBZDO-XERREHJYSA-N 2 1 356.466 2.774 20 10 FFCDMP C[C@H]1C[C@@H]([NH2+]C[C@H](O)c2ccc(O)c(O)c2)CC[N@H+]1Cc1ccccc1 ZINC001256524596 1038544750 /nfs/dbraw/zinc/54/47/50/1038544750.db2.gz XNNOWYHZQMBZDO-XERREHJYSA-N 2 1 356.466 2.774 20 10 FFCDMP CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001318526761 1044730553 /nfs/dbraw/zinc/73/05/53/1044730553.db2.gz KHWMHLCWUYMWGN-CEXWTWQISA-N 2 1 361.530 2.718 20 10 FFCDMP C[N@H+](CCC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319714852 1045248961 /nfs/dbraw/zinc/24/89/61/1045248961.db2.gz FDHDFVFUUIXOON-UHFFFAOYSA-N 2 1 365.493 2.741 20 10 FFCDMP C[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319714852 1045248969 /nfs/dbraw/zinc/24/89/69/1045248969.db2.gz FDHDFVFUUIXOON-UHFFFAOYSA-N 2 1 365.493 2.741 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccccc3[N+](=O)[O-])cc2F)CC1 ZINC001308391169 1052453947 /nfs/dbraw/zinc/45/39/47/1052453947.db2.gz UOELUZNNYUZMKY-UHFFFAOYSA-N 2 1 372.444 2.818 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cc2)CC1 ZINC000849350573 1056835461 /nfs/dbraw/zinc/83/54/61/1056835461.db2.gz QUEKZBDACKIILZ-NRFANRHFSA-N 2 1 356.558 2.650 20 10 FFCDMP COC(=O)c1c(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c2cc(F)ccc2n1C ZINC001578850321 1078534066 /nfs/dbraw/zinc/53/40/66/1078534066.db2.gz DNYXCWDNNLPLLS-YLQAJVPDSA-N 2 1 359.445 2.663 20 10 FFCDMP COC(=O)c1c(C[N@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c2cc(F)ccc2n1C ZINC001578850321 1078534071 /nfs/dbraw/zinc/53/40/71/1078534071.db2.gz DNYXCWDNNLPLLS-YLQAJVPDSA-N 2 1 359.445 2.663 20 10 FFCDMP CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)C1 ZINC001558722860 1076063326 /nfs/dbraw/zinc/06/33/26/1076063326.db2.gz DFEIEGXJVXGLSG-UYAOXDASSA-N 2 1 360.546 2.594 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c1O ZINC000282522494 511012318 /nfs/dbraw/zinc/01/23/18/511012318.db2.gz ZSDMTGSSZSQPAT-UHFFFAOYSA-N 2 1 370.335 2.579 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273446709 511525927 /nfs/dbraw/zinc/52/59/27/511525927.db2.gz NXIYVQLHPNALDG-RDTXWAMCSA-N 2 1 371.437 2.718 20 10 FFCDMP C[NH+](C)CCCCC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000771057400 737689979 /nfs/dbraw/zinc/68/99/79/737689979.db2.gz IYELTURJEIPCJU-KRWDZBQOSA-N 2 1 367.921 2.858 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCc4ccccc43)cc2F)CC1 ZINC001116019207 1032068297 /nfs/dbraw/zinc/06/82/97/1032068297.db2.gz SUTVKRZSFDBKNH-UHFFFAOYSA-N 2 1 368.500 2.730 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1O ZINC000895248586 968750745 /nfs/dbraw/zinc/75/07/45/968750745.db2.gz ONXZLQIPJUQZAM-IBGZPJMESA-N 2 1 356.466 2.566 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895558226 970741633 /nfs/dbraw/zinc/74/16/33/970741633.db2.gz UGEAQJNPVPOZSQ-SFHVURJKSA-N 2 1 366.509 2.753 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cc1Br ZINC001206011582 1032107975 /nfs/dbraw/zinc/10/79/75/1032107975.db2.gz FAUTZOWZIXJFMR-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000702604884 990008932 /nfs/dbraw/zinc/00/89/32/990008932.db2.gz ZZTRKCLVZWJFPC-IIBYNOLFSA-N 2 1 356.466 2.688 20 10 FFCDMP COc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000702604884 990008943 /nfs/dbraw/zinc/00/89/43/990008943.db2.gz ZZTRKCLVZWJFPC-IIBYNOLFSA-N 2 1 356.466 2.688 20 10 FFCDMP CCOC(=O)C(=Cc1cc(C)c(C)[nH+]c1N[C@@H](C)[C@@H]1C[NH2+]CCO1)N=[N+]=[N-] ZINC001170563402 994312806 /nfs/dbraw/zinc/31/28/06/994312806.db2.gz LWCWQTGMCYXKDP-JEJBDVSJSA-N 2 1 374.445 2.702 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCCC3)CC[C@H]1N1CC[NH+](C)CC1 ZINC000768465731 1000263660 /nfs/dbraw/zinc/26/36/60/1000263660.db2.gz RLNXPYWOWKHKCA-DYESRHJHSA-N 2 1 357.542 2.729 20 10 FFCDMP CCC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CC)C(=O)OCC ZINC000792188418 1002939085 /nfs/dbraw/zinc/93/90/85/1002939085.db2.gz ONWXHGPFNLZASP-FQEVSTJZSA-N 2 1 361.530 2.992 20 10 FFCDMP CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667295 1005011274 /nfs/dbraw/zinc/01/12/74/1005011274.db2.gz HXRLDUBPLNNHCW-FQEVSTJZSA-N 2 1 372.557 2.567 20 10 FFCDMP CCOc1cccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1O ZINC000850357401 1005810654 /nfs/dbraw/zinc/81/06/54/1005810654.db2.gz IMIAPLGRRACHLQ-IBGZPJMESA-N 2 1 356.466 2.647 20 10 FFCDMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817895336 1007802309 /nfs/dbraw/zinc/80/23/09/1007802309.db2.gz SZYOHPSGCZFUMB-HRAATJIYSA-N 2 1 371.500 2.835 20 10 FFCDMP [NH3+][C@H]1CCCCC[C@@H]1NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000817918327 1007810333 /nfs/dbraw/zinc/81/03/33/1007810333.db2.gz YRSHSKREEJTCKF-VXKWHMMOSA-N 2 1 356.558 2.968 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCCC[C@@]3(CCCC[NH2+]C3)C1)C[NH2+]CCO2 ZINC001222173940 1032802198 /nfs/dbraw/zinc/80/21/98/1032802198.db2.gz ZUVLMZYZMVSAGN-OAQYLSRUSA-N 3 1 359.514 2.620 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272434 1032861485 /nfs/dbraw/zinc/86/14/85/1032861485.db2.gz UFNCIZXAKIKHST-QFIPXVFZSA-N 3 1 356.558 2.794 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCC[NH2+]C4)C3)cc2)CC1 ZINC001222272434 1032861502 /nfs/dbraw/zinc/86/15/02/1032861502.db2.gz UFNCIZXAKIKHST-QFIPXVFZSA-N 2 1 356.558 2.794 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](OCC4CC4)C3)cc2F)CC1 ZINC001116695306 1021359327 /nfs/dbraw/zinc/35/93/27/1021359327.db2.gz BGSAXMYTQXHSAV-IBGZPJMESA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](OCC4CC4)C3)cc2F)CC1 ZINC001116695306 1021359345 /nfs/dbraw/zinc/35/93/45/1021359345.db2.gz BGSAXMYTQXHSAV-IBGZPJMESA-N 2 1 361.505 2.969 20 10 FFCDMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(Cc1cc(F)c(F)cc1[O-])C2 ZINC001142517401 1030565588 /nfs/dbraw/zinc/56/55/88/1030565588.db2.gz MBKCRLYPMKSNSC-UZLBHIALSA-N 2 1 366.452 2.851 20 10 FFCDMP COc1ccc(O)c(CN2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821370 /nfs/dbraw/zinc/82/13/70/1030821370.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(O)c(C[N@@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821388 /nfs/dbraw/zinc/82/13/88/1030821388.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(O)c(C[N@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821408 /nfs/dbraw/zinc/82/14/08/1030821408.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(O)c(C[NH+]2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821422 /nfs/dbraw/zinc/82/14/22/1030821422.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1ccc(O)c(C[NH+]2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c1 ZINC001203675404 1030821444 /nfs/dbraw/zinc/82/14/44/1030821444.db2.gz WDHGCJYBAJDDOP-GHTZIAJQSA-N 2 1 360.498 2.724 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](CNC(=O)[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000843058449 1031165689 /nfs/dbraw/zinc/16/56/89/1031165689.db2.gz SLJCAKOKHUPWLK-FPOVZHCZSA-N 2 1 372.557 2.613 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](Oc3ccncc3)C2)cc(C[NH+](C)C)c1O ZINC001139260311 1035031521 /nfs/dbraw/zinc/03/15/21/1035031521.db2.gz KZGRAVJONOQQHC-IBGZPJMESA-N 2 1 371.481 2.901 20 10 FFCDMP CCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139404472 1035091223 /nfs/dbraw/zinc/09/12/23/1035091223.db2.gz IVTIKBQOHMPVLX-HXUWFJFHSA-N 2 1 372.557 2.519 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCc4cc(O)c(O)cc4C3)cc2)CC1 ZINC001139411028 1035095843 /nfs/dbraw/zinc/09/58/43/1035095843.db2.gz QYKWELLJTYXORK-UHFFFAOYSA-N 2 1 367.493 2.798 20 10 FFCDMP Cc1cc(C[N@@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)ccc1N(C)C ZINC001139671368 1035193944 /nfs/dbraw/zinc/19/39/44/1035193944.db2.gz JYJUIRZFXQAGIJ-RTWAWAEBSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[N@H+]2C[C@H]3CC[NH+](Cc4cnn(C)c4)C[C@H]3C2)ccc1N(C)C ZINC001139671368 1035193947 /nfs/dbraw/zinc/19/39/47/1035193947.db2.gz JYJUIRZFXQAGIJ-RTWAWAEBSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[NH+]2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)ccc1N(C)C ZINC001139671368 1035193951 /nfs/dbraw/zinc/19/39/51/1035193951.db2.gz JYJUIRZFXQAGIJ-RTWAWAEBSA-N 2 1 367.541 2.748 20 10 FFCDMP Cc1cc(C[NH+]2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)ccc1N(C)C ZINC001139671368 1035193953 /nfs/dbraw/zinc/19/39/53/1035193953.db2.gz JYJUIRZFXQAGIJ-RTWAWAEBSA-N 2 1 367.541 2.748 20 10 FFCDMP CC(C)(C)c1ccc(O)c(C[NH+]2CCC([NH+]3CCC(C(N)=O)CC3)CC2)c1 ZINC001233286839 1036493401 /nfs/dbraw/zinc/49/34/01/1036493401.db2.gz KZAQVEOMLNHWQA-UHFFFAOYSA-N 2 1 373.541 2.851 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCCC[NH2+]4)CC3)cc2)CC1 ZINC001235229161 1037424920 /nfs/dbraw/zinc/42/49/20/1037424920.db2.gz OOHWTQRGCDCUPK-JOCHJYFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC(C4CC[NH2+]CC4)CC3)c(F)c2)CC1 ZINC001235701602 1037698912 /nfs/dbraw/zinc/69/89/12/1037698912.db2.gz DVBOQLHCASWFFF-UHFFFAOYSA-N 2 1 374.548 2.789 20 10 FFCDMP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]1C2 ZINC001236028040 1037892544 /nfs/dbraw/zinc/89/25/44/1037892544.db2.gz AQVQXBWPTIQENL-IRMTXWDGSA-N 2 1 372.509 2.520 20 10 FFCDMP Cc1cc(C[N@H+]2CCC[C@H](N3CC(C[NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236081145 1037922380 /nfs/dbraw/zinc/92/23/80/1037922380.db2.gz YZVSDYYFKCFJJW-QFIPXVFZSA-N 2 1 352.526 2.949 20 10 FFCDMP CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236092969 1037931495 /nfs/dbraw/zinc/93/14/95/1037931495.db2.gz CBUNROOGPAESFL-IBGZPJMESA-N 2 1 359.514 2.792 20 10 FFCDMP CC[N@@H+](CCc1ccc(OC)cc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001236302946 1038032427 /nfs/dbraw/zinc/03/24/27/1038032427.db2.gz ITWBYMXBJYUGAE-UHFFFAOYSA-N 2 1 356.466 2.947 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCOC[C@H]1C1CCCCC1 ZINC001236433428 1038086626 /nfs/dbraw/zinc/08/66/26/1038086626.db2.gz ICHJUJPIZKYQFO-FQEVSTJZSA-N 2 1 359.514 2.583 20 10 FFCDMP CCc1ccc(C[NH+]2CCC([N@@H+]3CCC[C@@H](C(=O)OC)C3)CC2)c(O)c1 ZINC001236787614 1038267742 /nfs/dbraw/zinc/26/77/42/1038267742.db2.gz IRMOCPOBVUAHHC-GOSISDBHSA-N 2 1 360.498 2.804 20 10 FFCDMP CCc1ccc(C[NH+]2CCC([N@H+]3CCC[C@@H](C(=O)OC)C3)CC2)c(O)c1 ZINC001236787614 1038267749 /nfs/dbraw/zinc/26/77/49/1038267749.db2.gz IRMOCPOBVUAHHC-GOSISDBHSA-N 2 1 360.498 2.804 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4cc[nH]n4)C3)cc2F)CC1 ZINC001253990224 1040495482 /nfs/dbraw/zinc/49/54/82/1040495482.db2.gz PJKLBLCTSSHWBH-QGZVFWFLSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)cc2F)CC1 ZINC001253990224 1040495486 /nfs/dbraw/zinc/49/54/86/1040495486.db2.gz PJKLBLCTSSHWBH-QGZVFWFLSA-N 2 1 357.477 2.680 20 10 FFCDMP CN(C)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccc(Cl)cc1[O-])CC2 ZINC001278557000 1041145138 /nfs/dbraw/zinc/14/51/38/1041145138.db2.gz CCBOAVRRFSCYHJ-UHFFFAOYSA-N 2 1 351.922 2.895 20 10 FFCDMP CCC[N@@H+](C)CCC(=O)N1C[C@@H](C)[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C1 ZINC001216506668 1042044049 /nfs/dbraw/zinc/04/40/49/1042044049.db2.gz LUUUWBXJZXMGRH-IEBWSBKVSA-N 2 1 361.530 2.672 20 10 FFCDMP C[C@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC[N@H+]1C1CCCCC1 ZINC001237250292 1043075300 /nfs/dbraw/zinc/07/53/00/1043075300.db2.gz URLKSTJCLFRCSP-INIZCTEOSA-N 2 1 359.514 2.713 20 10 FFCDMP C[NH+](C)CCN1CC[C@@]2(C1)CCC[N@@H+](Cc1cc(Cl)c(O)cc1O)C2 ZINC001279573753 1043280079 /nfs/dbraw/zinc/28/00/79/1043280079.db2.gz YVTMXRPSYPVXPP-LJQANCHMSA-N 2 1 367.921 2.601 20 10 FFCDMP C[N@H+]1CCC2(C1)CC[NH+](Cc1cc(O)c(Br)cc1O)CC2 ZINC001279663451 1043423769 /nfs/dbraw/zinc/42/37/69/1043423769.db2.gz QCXKFOXLYQAXMF-UHFFFAOYSA-N 2 1 355.276 2.778 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@H]4CCCO[C@H]4C3(C)C)cc2F)CC1 ZINC001318724660 1044839057 /nfs/dbraw/zinc/83/90/57/1044839057.db2.gz RMPANCDQNUSZPX-NSISKUIASA-N 2 1 361.505 2.871 20 10 FFCDMP COc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1O ZINC001318339279 1045275014 /nfs/dbraw/zinc/27/50/14/1045275014.db2.gz MEFVEJKCGDEERK-UHFFFAOYSA-N 2 1 359.445 2.582 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(n4ccnc4)CC3)cc2F)CC1 ZINC001319814382 1045276388 /nfs/dbraw/zinc/27/63/88/1045276388.db2.gz CWIIDVHIBKKLIV-UHFFFAOYSA-N 2 1 357.477 2.611 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCCCC[NH+]3CCCC3)cc2F)CC1 ZINC001324223584 1045925052 /nfs/dbraw/zinc/92/50/52/1045925052.db2.gz WHUUQSKSMGQFHC-UHFFFAOYSA-N 3 1 362.537 2.933 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@H]2C1 ZINC001333890610 1049158875 /nfs/dbraw/zinc/15/88/75/1049158875.db2.gz FGCAMXYRLNGRDJ-QKNQBKEWSA-N 2 1 357.542 2.810 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(N4CCC(O)CC4)cc3)C[C@@H]2C1 ZINC001333890612 1049159065 /nfs/dbraw/zinc/15/90/65/1049159065.db2.gz FGCAMXYRLNGRDJ-SVFBPWRDSA-N 2 1 357.542 2.810 20 10 FFCDMP CN(C)c1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)cc1F ZINC001308366436 1052450772 /nfs/dbraw/zinc/45/07/72/1052450772.db2.gz MNOPEGXKRSCVDM-IBGZPJMESA-N 2 1 357.473 2.748 20 10 FFCDMP COc1cc(C)cc(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1O ZINC001308583646 1052473132 /nfs/dbraw/zinc/47/31/32/1052473132.db2.gz MPHLQXMRPFVYEX-HDICACEKSA-N 2 1 361.530 2.700 20 10 FFCDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(OC)c(OC)c2O)[C@H](C)C1 ZINC001334956361 1053165136 /nfs/dbraw/zinc/16/51/36/1053165136.db2.gz PGWCRUSPMBWRAF-NVXWUHKLSA-N 2 1 366.502 2.636 20 10 FFCDMP COC(=O)c1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001347213731 1053726850 /nfs/dbraw/zinc/72/68/50/1053726850.db2.gz ZEZSUIGNHBMWRU-UHFFFAOYSA-N 2 1 371.456 2.654 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CC[C@H]([NH+]4CCCCC4)C3)cc2F)CC1 ZINC001337033493 1054426093 /nfs/dbraw/zinc/42/60/93/1054426093.db2.gz VRIVKDCLWORUMZ-IBGZPJMESA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCOC3CCSCC3)cc2F)CC1 ZINC001356046157 1055242752 /nfs/dbraw/zinc/24/27/52/1055242752.db2.gz OJWUCFXZSDLVIK-UHFFFAOYSA-N 2 1 367.534 2.579 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)cc2F)CC1 ZINC001474098401 1065456581 /nfs/dbraw/zinc/45/65/81/1065456581.db2.gz VWRXKLXTSAMRAO-UHFFFAOYSA-N 2 1 372.444 2.818 20 10 FFCDMP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c1 ZINC000273390344 511525019 /nfs/dbraw/zinc/52/50/19/511525019.db2.gz KODVRVZHCMOBRQ-KRWDZBQOSA-N 2 1 367.493 2.939 20 10 FFCDMP CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)CC[NH+](C)C)C1 ZINC000444245530 514165882 /nfs/dbraw/zinc/16/58/82/514165882.db2.gz XPIMQFLQMCAZIG-QGZVFWFLSA-N 2 1 370.541 2.864 20 10 FFCDMP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)c(F)c1 ZINC000925781710 738529499 /nfs/dbraw/zinc/52/94/99/738529499.db2.gz ZTGNVJVZWFESPA-ZFWWWQNUSA-N 2 1 357.420 2.558 20 10 FFCDMP COCC[N@H+](Cc1cccc(Br)c1[O-])CC1CC[NH+](C)CC1 ZINC000877665234 732408732 /nfs/dbraw/zinc/40/87/32/732408732.db2.gz NHIYSNVEAPDKPE-UHFFFAOYSA-N 2 1 371.319 2.945 20 10 FFCDMP COCC[N@@H+](Cc1cccc(Br)c1O)CC1CC[NH+](C)CC1 ZINC000877665234 732408736 /nfs/dbraw/zinc/40/87/36/732408736.db2.gz NHIYSNVEAPDKPE-UHFFFAOYSA-N 2 1 371.319 2.945 20 10 FFCDMP COCC[N@H+](Cc1cccc(Br)c1O)CC1CC[NH+](C)CC1 ZINC000877665234 732408740 /nfs/dbraw/zinc/40/87/40/732408740.db2.gz NHIYSNVEAPDKPE-UHFFFAOYSA-N 2 1 371.319 2.945 20 10 FFCDMP COC[C@]1(C[NH2+][C@@H](C)c2cc(Br)cc(C)c2O)CCC[NH2+]1 ZINC000817974287 742225995 /nfs/dbraw/zinc/22/59/95/742225995.db2.gz KODVWQRITBWDJM-BLLLJJGKSA-N 2 1 357.292 2.882 20 10 FFCDMP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000178671842 977698977 /nfs/dbraw/zinc/69/89/77/977698977.db2.gz XPKKKBARDFLEHO-IBGZPJMESA-N 2 1 372.557 2.882 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c1O ZINC000894139377 977956741 /nfs/dbraw/zinc/95/67/41/977956741.db2.gz SSDDUOUKXYCXJS-FQEVSTJZSA-N 2 1 369.509 2.788 20 10 FFCDMP NC(=O)[C@@H]1CCC[N@@H+](CCC[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729683852 981288762 /nfs/dbraw/zinc/28/87/62/981288762.db2.gz CZGJPPKYLKUJBT-LJQANCHMSA-N 2 1 367.493 2.736 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@@H](C(F)(F)F)O1 ZINC000877824058 1014744030 /nfs/dbraw/zinc/74/40/30/1014744030.db2.gz ONVKVJNICKYFIE-YJBOKZPZSA-N 2 1 371.447 2.980 20 10 FFCDMP COc1ccc(Br)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1O ZINC001206011267 1032107616 /nfs/dbraw/zinc/10/76/16/1032107616.db2.gz BDDIDKWUPGYLKO-RYUDHWBXSA-N 2 1 357.292 2.970 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCCCC2)cc1 ZINC000765795384 985853850 /nfs/dbraw/zinc/85/38/50/985853850.db2.gz CCPZFBYICSNTBH-AZUAARDMSA-N 2 1 372.557 2.915 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000809700689 994573413 /nfs/dbraw/zinc/57/34/13/994573413.db2.gz MHQIBGUFXHNLPF-OAQYLSRUSA-N 2 1 369.484 2.923 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000809700689 994573423 /nfs/dbraw/zinc/57/34/23/994573423.db2.gz MHQIBGUFXHNLPF-OAQYLSRUSA-N 2 1 369.484 2.923 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000741258162 999717457 /nfs/dbraw/zinc/71/74/57/999717457.db2.gz LLBANMCQSYHAHQ-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP CCOc1ccc(O)c(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000741258162 999717458 /nfs/dbraw/zinc/71/74/58/999717458.db2.gz LLBANMCQSYHAHQ-OAQYLSRUSA-N 2 1 356.466 2.518 20 10 FFCDMP C[N@H+]1CCCC[C@H]1CN1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444972 1000251213 /nfs/dbraw/zinc/25/12/13/1000251213.db2.gz DHVVIRPBRDVUSS-NRFANRHFSA-N 2 1 357.542 2.873 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+](CCO)[C@H]3CCc4ccccc43)cc2)CC1 ZINC000775697267 1003704643 /nfs/dbraw/zinc/70/46/43/1003704643.db2.gz XZNFZRSMOZDOGO-QHCPKHFHSA-N 2 1 365.521 2.920 20 10 FFCDMP CC[NH+]1CCC(N2CCC[N@@H+](Cc3cc4c(cc3O)CCC4)CC2)CC1 ZINC000817374627 1007568341 /nfs/dbraw/zinc/56/83/41/1007568341.db2.gz XZKPMXLFSVZKIT-UHFFFAOYSA-N 2 1 357.542 2.873 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3COc4cc(F)ccc4C3)cc2F)CC1 ZINC001179192992 1009286836 /nfs/dbraw/zinc/28/68/36/1009286836.db2.gz BXWBJRDRXITBMF-SFHVURJKSA-N 2 1 373.447 2.810 20 10 FFCDMP COc1cc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(O)c(C(C)(C)C)c1 ZINC000827698698 1018618841 /nfs/dbraw/zinc/61/88/41/1018618841.db2.gz AXZILOJZUJYIAW-QGZVFWFLSA-N 2 1 362.514 2.729 20 10 FFCDMP COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCN(C)CC3)c2)c1 ZINC001116564934 1021286670 /nfs/dbraw/zinc/28/66/70/1021286670.db2.gz BMZSWVLAAJOWPD-KRWDZBQOSA-N 2 1 369.509 2.999 20 10 FFCDMP CCOC(=O)[C@@H]1CCC[N@H+](C2CCN(Cc3ccc(N(C)C)cc3)CC2)C1 ZINC001203931044 1030989796 /nfs/dbraw/zinc/98/97/96/1030989796.db2.gz MJLXPJQKVZGSBP-LJQANCHMSA-N 2 1 373.541 2.992 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139257104 1035030685 /nfs/dbraw/zinc/03/06/85/1035030685.db2.gz RMSJKBAFHJASKP-SFHVURJKSA-N 2 1 357.454 2.511 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1c1ccccc1 ZINC001139409603 1035094104 /nfs/dbraw/zinc/09/41/04/1035094104.db2.gz MYZRARGHCDTYLI-HSZRJFAPSA-N 2 1 364.537 2.927 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@H]1Cc2ccccc2O1 ZINC001139411309 1035095683 /nfs/dbraw/zinc/09/56/83/1035095683.db2.gz FPIQBXADDPOVJN-OAQYLSRUSA-N 2 1 351.494 2.874 20 10 FFCDMP CCOC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC001139411489 1035095940 /nfs/dbraw/zinc/09/59/40/1035095940.db2.gz ORZHUTCLVBGRTM-ICSRJNTNSA-N 2 1 373.541 2.850 20 10 FFCDMP Cc1cc(C[N@@H+]2CCc3ncc(C[NH+]4CCCC4)n3CC2)ccc1N(C)C ZINC001139669911 1035193295 /nfs/dbraw/zinc/19/32/95/1035193295.db2.gz DDWYTLQOMGGSQO-UHFFFAOYSA-N 2 1 367.541 2.912 20 10 FFCDMP Cc1ccc(O)c(C[N@@H+]2CCc3ncc(C[NH+]4CCCCC4)n3CC2)c1 ZINC001140620603 1035746352 /nfs/dbraw/zinc/74/63/52/1035746352.db2.gz UTBHIAVIXHQUSV-UHFFFAOYSA-N 2 1 354.498 2.941 20 10 FFCDMP CCC[N@@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c(C)c1 ZINC001229868431 1036947030 /nfs/dbraw/zinc/94/70/30/1036947030.db2.gz GFALNIFYHSRRQL-RTBURBONSA-N 2 1 361.530 2.862 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cc2)CC1 ZINC001235043773 1037324382 /nfs/dbraw/zinc/32/43/82/1037324382.db2.gz HDTWUVOOADUCQG-QFIPXVFZSA-N 3 1 356.558 2.937 20 10 FFCDMP Cc1cc(Br)c([O-])c(CN2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)c1 ZINC001235409297 1037531116 /nfs/dbraw/zinc/53/11/16/1037531116.db2.gz WAXLTEJTGROOEA-GOEBONIOSA-N 2 1 357.267 2.987 20 10 FFCDMP Fc1ccc(O[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688873 1037684801 /nfs/dbraw/zinc/68/48/01/1037684801.db2.gz UPSLFHBEUCTKAG-NRFANRHFSA-N 2 1 355.457 2.889 20 10 FFCDMP Oc1cc2c(cc1C[N@H+]1CCN[C@@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789849 1037745870 /nfs/dbraw/zinc/74/58/70/1037745870.db2.gz KXHKDKLOHCTODS-GOSISDBHSA-N 2 1 373.884 2.674 20 10 FFCDMP Oc1cc2c(cc1CN1CC[NH2+][C@@H](c3ccc(Cl)cc3)C1)C[NH2+]CCO2 ZINC001235789849 1037745876 /nfs/dbraw/zinc/74/58/76/1037745876.db2.gz KXHKDKLOHCTODS-GOSISDBHSA-N 2 1 373.884 2.674 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4cc(CO)ccc4C3)c(F)c2)CC1 ZINC001236933163 1038365621 /nfs/dbraw/zinc/36/56/21/1038365621.db2.gz WEVPOPBXEHLLJR-UHFFFAOYSA-N 2 1 369.484 2.628 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4cc(CO)ccc4C3)c(F)c2)CC1 ZINC001236933163 1038365634 /nfs/dbraw/zinc/36/56/34/1038365634.db2.gz WEVPOPBXEHLLJR-UHFFFAOYSA-N 2 1 369.484 2.628 20 10 FFCDMP CCOc1cccc(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001278578450 1041241261 /nfs/dbraw/zinc/24/12/61/1041241261.db2.gz RNGZSLQSMILFCK-NRFANRHFSA-N 2 1 361.530 2.640 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(N(CC)CC)cc2)CCC12C[NH2+]C2 ZINC001237413380 1043149285 /nfs/dbraw/zinc/14/92/85/1043149285.db2.gz WVSKBRZHZYZTDT-LJQANCHMSA-N 2 1 359.514 2.507 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCC12C[NH2+]C2 ZINC001237428636 1043154850 /nfs/dbraw/zinc/15/48/50/1043154850.db2.gz BOMZFNWKSIMXQP-QGZVFWFLSA-N 2 1 360.498 2.664 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC12C[NH2+]C2 ZINC001237432179 1043158667 /nfs/dbraw/zinc/15/86/67/1043158667.db2.gz UIQPYTZCZGPPOC-LBPRGKRZSA-N 2 1 373.280 2.674 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC12C[NH2+]C2 ZINC001237432179 1043158671 /nfs/dbraw/zinc/15/86/71/1043158671.db2.gz UIQPYTZCZGPPOC-LBPRGKRZSA-N 2 1 373.280 2.674 20 10 FFCDMP Cc1c(C[N@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c2ccccc2n1C ZINC001279541976 1043237694 /nfs/dbraw/zinc/23/76/94/1043237694.db2.gz SEWVQEFLLZHCJN-UHFFFAOYSA-N 2 1 354.542 2.946 20 10 FFCDMP COc1cc(C)c(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279666316 1043431621 /nfs/dbraw/zinc/43/16/21/1043431621.db2.gz ALUBFRFPWRGDLS-NRFANRHFSA-N 2 1 361.530 2.559 20 10 FFCDMP COc1cc(CN2CCC[C@]3(CCC[N@@H+](C)C3)C2)cc(C[NH+](C)C)c1O ZINC001279698518 1043489780 /nfs/dbraw/zinc/48/97/80/1043489780.db2.gz NEXXJLUUBGRSDR-NRFANRHFSA-N 2 1 361.530 2.770 20 10 FFCDMP CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001318526762 1044729501 /nfs/dbraw/zinc/72/95/01/1044729501.db2.gz KHWMHLCWUYMWGN-GBESFXJTSA-N 2 1 361.530 2.718 20 10 FFCDMP Cc1cnc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c(C)c1 ZINC001329114552 1048581833 /nfs/dbraw/zinc/58/18/33/1048581833.db2.gz QFAPQMDTHWGLSD-UHFFFAOYSA-N 2 1 356.489 2.922 20 10 FFCDMP CC[NH+](CC)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001337042714 1054434536 /nfs/dbraw/zinc/43/45/36/1054434536.db2.gz SJYGYBABGSFIIQ-LJQANCHMSA-N 2 1 362.537 2.741 20 10 FFCDMP Cc1cc(C)n(CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)n1 ZINC001473908876 1065416800 /nfs/dbraw/zinc/41/68/00/1065416800.db2.gz DHJMKRLATAMYTQ-UHFFFAOYSA-N 2 1 359.493 2.571 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066515 508039243 /nfs/dbraw/zinc/03/92/43/508039243.db2.gz JWBQLYQBLVSSJW-DENIHFKCSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066515 508039244 /nfs/dbraw/zinc/03/92/44/508039244.db2.gz JWBQLYQBLVSSJW-DENIHFKCSA-N 2 1 355.526 2.972 20 10 FFCDMP c1cc(N2CCOCC2)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066515 508039245 /nfs/dbraw/zinc/03/92/45/508039245.db2.gz JWBQLYQBLVSSJW-DENIHFKCSA-N 2 1 355.526 2.972 20 10 FFCDMP CCOc1cccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1O ZINC000377691181 512400879 /nfs/dbraw/zinc/40/08/79/512400879.db2.gz FBOPDYUMMBZVGR-DFNIBXOVSA-N 2 1 359.514 2.534 20 10 FFCDMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000277178094 510955951 /nfs/dbraw/zinc/95/59/51/510955951.db2.gz LDZOAWXJVHOGAO-UHFFFAOYSA-N 2 1 371.529 2.540 20 10 FFCDMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000277178094 510955954 /nfs/dbraw/zinc/95/59/54/510955954.db2.gz LDZOAWXJVHOGAO-UHFFFAOYSA-N 2 1 371.529 2.540 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)c1O ZINC000725849326 734396279 /nfs/dbraw/zinc/39/62/79/734396279.db2.gz KNUNCRHANJIZNF-GFCCVEGCSA-N 2 1 357.292 2.983 20 10 FFCDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(C)cc(OC)c2O)[C@@H](C)C1 ZINC000894256424 734825971 /nfs/dbraw/zinc/82/59/71/734825971.db2.gz QIASBHGHTJGSMA-FUHWJXTLSA-N 2 1 350.503 2.936 20 10 FFCDMP COc1c([O-])c(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973665 738046273 /nfs/dbraw/zinc/04/62/73/738046273.db2.gz DCWPYCYJRCJKSO-AWEZNQCLSA-N 2 1 351.447 2.911 20 10 FFCDMP COc1c(O)c(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973665 738046276 /nfs/dbraw/zinc/04/62/76/738046276.db2.gz DCWPYCYJRCJKSO-AWEZNQCLSA-N 2 1 351.447 2.911 20 10 FFCDMP COc1c(O)c(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000774973665 738046280 /nfs/dbraw/zinc/04/62/80/738046280.db2.gz DCWPYCYJRCJKSO-AWEZNQCLSA-N 2 1 351.447 2.911 20 10 FFCDMP Cc1cc(O)c(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825916456 743342655 /nfs/dbraw/zinc/34/26/55/743342655.db2.gz ORDKQUNWGYPIFT-QGZVFWFLSA-N 2 1 351.922 2.954 20 10 FFCDMP CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1O ZINC000846227112 748433975 /nfs/dbraw/zinc/43/39/75/748433975.db2.gz GSSYBJUFFCGCDH-NXHRZFHOSA-N 2 1 350.434 2.595 20 10 FFCDMP CC[C@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1ccc(F)cc1O ZINC000854232617 750266414 /nfs/dbraw/zinc/26/64/14/750266414.db2.gz VQXRLEWAHIXJSW-KRWDZBQOSA-N 2 1 351.466 2.563 20 10 FFCDMP C[NH+](C)CCN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1c(O)cccc1Cl ZINC001275837283 1013065840 /nfs/dbraw/zinc/06/58/40/1013065840.db2.gz FRBWKLVQYYWWHZ-LJQANCHMSA-N 2 1 365.905 2.564 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)CCN1c1cc[nH+]cc1 ZINC000895555958 970735862 /nfs/dbraw/zinc/73/58/62/970735862.db2.gz DBBGNEMBHGJSSA-GOSISDBHSA-N 2 1 352.482 2.629 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1O ZINC000894176080 978113015 /nfs/dbraw/zinc/11/30/15/978113015.db2.gz HJCMKLXSWHPUDA-UHFFFAOYSA-N 2 1 369.509 2.746 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[C@H](C(F)(F)F)O1 ZINC000877824052 1014743575 /nfs/dbraw/zinc/74/35/75/1014743575.db2.gz ONVKVJNICKYFIE-CRAIPNDOSA-N 2 1 371.447 2.980 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514773 998626122 /nfs/dbraw/zinc/62/61/22/998626122.db2.gz RMTHISFIFDPBTN-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514773 998626126 /nfs/dbraw/zinc/62/61/26/998626126.db2.gz RMTHISFIFDPBTN-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(O)c1 ZINC001144514773 998626130 /nfs/dbraw/zinc/62/61/30/998626130.db2.gz RMTHISFIFDPBTN-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP CCN(CC)c1ccc(C[N@@H+](C)C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903878509 1016282592 /nfs/dbraw/zinc/28/25/92/1016282592.db2.gz WJLFPTFGPOQEPD-IBGZPJMESA-N 2 1 357.546 2.824 20 10 FFCDMP CCOc1ccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c(O)c1 ZINC000769191529 1000448009 /nfs/dbraw/zinc/44/80/09/1000448009.db2.gz DCOWLOZNARJSPS-QZTJIDSGSA-N 2 1 361.530 2.781 20 10 FFCDMP CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775667296 1005011072 /nfs/dbraw/zinc/01/10/72/1005011072.db2.gz HXRLDUBPLNNHCW-HXUWFJFHSA-N 2 1 372.557 2.567 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(F)cc3O)cn2)CC1 ZINC000756431017 1023709908 /nfs/dbraw/zinc/70/99/08/1023709908.db2.gz ATEJGTMYZSLPBR-OAHLLOKOSA-N 2 1 358.461 2.919 20 10 FFCDMP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1O ZINC000756548165 1023725575 /nfs/dbraw/zinc/72/55/75/1023725575.db2.gz JAXCOQHTKNZDCE-DOTOQJQBSA-N 2 1 355.482 2.783 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045362 1030000889 /nfs/dbraw/zinc/00/08/89/1030000889.db2.gz KGLCABMQESXADY-YHYVQYDKSA-N 2 1 352.526 2.863 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(I)cc2O)CC[C@@H]1C[NH3+] ZINC001205637832 1031894062 /nfs/dbraw/zinc/89/40/62/1031894062.db2.gz JESIJSXGXOCVFN-NWDGAFQWSA-N 2 1 374.266 2.804 20 10 FFCDMP C[NH+](C)CCC[N@H+](C)Cc1ccc(N2CCOCC2)c(Br)c1 ZINC001138675708 1034535319 /nfs/dbraw/zinc/53/53/19/1034535319.db2.gz IGEZPJWDAMRMBL-UHFFFAOYSA-N 2 1 370.335 2.669 20 10 FFCDMP C[NH+](C)CCC[N@@H+](C)Cc1ccc(N2CCOCC2)c(Br)c1 ZINC001138675708 1034535323 /nfs/dbraw/zinc/53/53/23/1034535323.db2.gz IGEZPJWDAMRMBL-UHFFFAOYSA-N 2 1 370.335 2.669 20 10 FFCDMP COC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)C1 ZINC001140185138 1035371949 /nfs/dbraw/zinc/37/19/49/1035371949.db2.gz PRVJGGJMGJMJJC-KRWDZBQOSA-N 2 1 360.498 2.858 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C(=O)OC)[C@H]3C)cc2)CC1 ZINC001140304290 1035426379 /nfs/dbraw/zinc/42/63/79/1035426379.db2.gz LXQWSJNGFMMIEU-YLJYHZDGSA-N 2 1 359.514 2.602 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000835039837 1035491590 /nfs/dbraw/zinc/49/15/90/1035491590.db2.gz KIQABTTXOFDTLO-CJHOVAGGSA-N 2 1 365.521 2.992 20 10 FFCDMP CN(C)c1ccc(/C=C/C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000835039837 1035491592 /nfs/dbraw/zinc/49/15/92/1035491592.db2.gz KIQABTTXOFDTLO-CJHOVAGGSA-N 2 1 365.521 2.992 20 10 FFCDMP Cc1cc(C)c(C[N@@H+]2CCCC[C@@]23CC(=O)N(CC[NH+](C)C)C3)c(O)c1 ZINC001277204849 1035529880 /nfs/dbraw/zinc/52/98/80/1035529880.db2.gz YSJUELGAAYVGLE-NRFANRHFSA-N 2 1 359.514 2.528 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001140948053 1036540147 /nfs/dbraw/zinc/54/01/47/1036540147.db2.gz QSXXYQUCPCDKGK-SFHVURJKSA-N 2 1 360.498 2.940 20 10 FFCDMP CCOC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccc(C)cc3O)CC2)C1 ZINC001140948053 1036540156 /nfs/dbraw/zinc/54/01/56/1036540156.db2.gz QSXXYQUCPCDKGK-SFHVURJKSA-N 2 1 360.498 2.940 20 10 FFCDMP CCCCN(CCCC)c1ccc(C[N@@H+]2CCN[C@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235060709 1037333533 /nfs/dbraw/zinc/33/35/33/1037333533.db2.gz GIFJHZVZRHVNLQ-QFIPXVFZSA-N 2 1 374.573 2.936 20 10 FFCDMP CCCCN(CCCC)c1ccc(C[N@H+]2CCN[C@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235060709 1037333545 /nfs/dbraw/zinc/33/35/45/1037333545.db2.gz GIFJHZVZRHVNLQ-QFIPXVFZSA-N 2 1 374.573 2.936 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC(C4CC[NH2+]CC4)CC3)cc2)CC1 ZINC001235700997 1037698004 /nfs/dbraw/zinc/69/80/04/1037698004.db2.gz BGKGFQQJOPZBNK-UHFFFAOYSA-N 2 1 356.558 2.650 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001235714129 1037706079 /nfs/dbraw/zinc/70/60/79/1037706079.db2.gz HHXQQNVKZLQYFS-LJQANCHMSA-N 2 1 351.494 2.866 20 10 FFCDMP C[C@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CCO1 ZINC001235962115 1037862049 /nfs/dbraw/zinc/86/20/49/1037862049.db2.gz JHZCDKIYGDYXPI-JOCHJYFZSA-N 2 1 369.484 2.983 20 10 FFCDMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971777 1037869916 /nfs/dbraw/zinc/86/99/16/1037869916.db2.gz AGVQUZOCEWTKBY-FCHUYYIVSA-N 3 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971777 1037869926 /nfs/dbraw/zinc/86/99/26/1037869926.db2.gz AGVQUZOCEWTKBY-FCHUYYIVSA-N 3 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971777 1037869936 /nfs/dbraw/zinc/86/99/36/1037869936.db2.gz AGVQUZOCEWTKBY-FCHUYYIVSA-N 3 1 356.558 2.935 20 10 FFCDMP c1ccc(C[C@H]2C[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)CCO2)cc1 ZINC001236070895 1037914957 /nfs/dbraw/zinc/91/49/57/1037914957.db2.gz CBTBNWPMBIBUGE-QFIPXVFZSA-N 2 1 351.494 2.540 20 10 FFCDMP COCC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc4ccccc4c3O)CC[C@@H]2C1 ZINC001231880126 1037974064 /nfs/dbraw/zinc/97/40/64/1037974064.db2.gz GLMILFOZXQEXHJ-WIYYLYMNSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc4ccccc4c3O)CC[C@@H]2C1 ZINC001231880126 1037974076 /nfs/dbraw/zinc/97/40/76/1037974076.db2.gz GLMILFOZXQEXHJ-WIYYLYMNSA-N 2 1 370.493 2.715 20 10 FFCDMP COCC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3O)CC[C@@H]2C1 ZINC001231880126 1037974086 /nfs/dbraw/zinc/97/40/86/1037974086.db2.gz GLMILFOZXQEXHJ-WIYYLYMNSA-N 2 1 370.493 2.715 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc(N)cc4C3)c(F)c2)CC1 ZINC001236234428 1037996019 /nfs/dbraw/zinc/99/60/19/1037996019.db2.gz PDYMTZXALPHATD-UHFFFAOYSA-N 2 1 354.473 2.718 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](c4cccnc4)C3)c(F)c2)CC1 ZINC001236937424 1038366888 /nfs/dbraw/zinc/36/68/88/1038366888.db2.gz GWLYVBSPZRDQBQ-SFHVURJKSA-N 2 1 354.473 2.962 20 10 FFCDMP COc1cc2c(cn1)CCN(Cc1ccc(N3CCN(C)CC3)cc1F)C2 ZINC001236947356 1038374606 /nfs/dbraw/zinc/37/46/06/1038374606.db2.gz QRSLLQVZGFPRPZ-UHFFFAOYSA-N 2 1 370.472 2.539 20 10 FFCDMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccc(N4CC[NH2+]CC4)cc3)CC[NH2+]2)cc1 ZINC001246175054 1039267071 /nfs/dbraw/zinc/26/70/71/1039267071.db2.gz RVPJUULFMYMCAC-UNMCSNQZSA-N 3 1 350.510 2.679 20 10 FFCDMP Cn1ccc([C@H]2CCC[N@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001262375292 1041664992 /nfs/dbraw/zinc/66/49/92/1041664992.db2.gz FIGDNCFILLXDGK-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP Cn1ccc([C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)c(F)c3)C2)n1 ZINC001262375292 1041664996 /nfs/dbraw/zinc/66/49/96/1041664996.db2.gz FIGDNCFILLXDGK-SFHVURJKSA-N 2 1 371.504 2.691 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001279229786 1042956340 /nfs/dbraw/zinc/95/63/40/1042956340.db2.gz CBSSONIPOHCKIP-UHFFFAOYSA-N 2 1 356.558 2.746 20 10 FFCDMP Cc1cccc(C[NH+]2CCC3(CC[N@@H+](CCn4ccnc4)C3)CC2)c1O ZINC001279290127 1042985412 /nfs/dbraw/zinc/98/54/12/1042985412.db2.gz GKTKQTROTOCVDZ-UHFFFAOYSA-N 2 1 354.498 2.885 20 10 FFCDMP COc1cc(C)c(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279666318 1043431642 /nfs/dbraw/zinc/43/16/42/1043431642.db2.gz ALUBFRFPWRGDLS-OAQYLSRUSA-N 2 1 361.530 2.559 20 10 FFCDMP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3F)(C1)CCC2 ZINC001279676580 1043449296 /nfs/dbraw/zinc/44/92/96/1043449296.db2.gz ZRSPAWDTULMTLY-LEWJYISDSA-N 3 1 360.521 2.732 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4c[nH]cn4)CC3)cc2F)CC1 ZINC001319823882 1045278824 /nfs/dbraw/zinc/27/88/24/1045278824.db2.gz VATHDIQXAHRXMT-UHFFFAOYSA-N 2 1 357.477 2.680 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)CC3CCCC3)cc2F)CC1 ZINC001321150005 1045562821 /nfs/dbraw/zinc/56/28/21/1045562821.db2.gz RBOVPWRLIATZJT-IBGZPJMESA-N 2 1 363.521 2.856 20 10 FFCDMP Cc1n[nH]cc1C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001321777603 1045798048 /nfs/dbraw/zinc/79/80/48/1045798048.db2.gz DJVNXSBZZMJLGO-UHFFFAOYSA-N 2 1 371.504 2.989 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCN4CCCC[C@@H]34)cc2F)CC1 ZINC001329113373 1048582189 /nfs/dbraw/zinc/58/21/89/1048582189.db2.gz JPZVYMRKBCITCX-FPOVZHCZSA-N 2 1 360.521 2.684 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@H](O)Cc1ccccc1 ZINC001343972844 1052521263 /nfs/dbraw/zinc/52/12/63/1052521263.db2.gz MXFPZDYCQJVMPH-HXUWFJFHSA-N 2 1 371.500 2.613 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[C@H](O)Cc1ccccc1 ZINC001343972844 1052521271 /nfs/dbraw/zinc/52/12/71/1052521271.db2.gz MXFPZDYCQJVMPH-HXUWFJFHSA-N 2 1 371.500 2.613 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)[C@@H](c2ccccc2)[NH+](C)C)[NH+](C)C)cc1 ZINC001456927124 1060229753 /nfs/dbraw/zinc/22/97/53/1060229753.db2.gz ALHWDBKMCTZFMN-LEWJYISDSA-N 2 1 368.525 2.774 20 10 FFCDMP CC[NH+]1CCN(CCCC[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000154488887 508795266 /nfs/dbraw/zinc/79/52/66/508795266.db2.gz JMIDOZVQLYHLJY-UHFFFAOYSA-N 2 1 374.573 2.671 20 10 FFCDMP C[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cc(Br)ccc1O ZINC000185366607 510824487 /nfs/dbraw/zinc/82/44/87/510824487.db2.gz ABAPROIKDFGIPS-AWEZNQCLSA-N 2 1 370.335 2.833 20 10 FFCDMP CN(C)c1ccc([C@H](CNC(=O)CC[C@H]2CCCC[N@H+]2C)[NH+](C)C)cc1 ZINC001184426890 1002611314 /nfs/dbraw/zinc/61/13/14/1002611314.db2.gz POUJKGIIBXITMR-UXHICEINSA-N 2 1 360.546 2.736 20 10 FFCDMP COc1ccc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1O ZINC000775664585 1004994319 /nfs/dbraw/zinc/99/43/19/1004994319.db2.gz ZFBGIQWYXPDJOI-UHFFFAOYSA-N 2 1 355.482 2.785 20 10 FFCDMP c1c(C[NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nn2c1CCC2 ZINC000850234303 1005797440 /nfs/dbraw/zinc/79/74/40/1005797440.db2.gz DXLXXVZYYGIAQY-UHFFFAOYSA-N 2 1 365.525 2.651 20 10 FFCDMP C[C@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc(C(F)(F)F)c1O ZINC000925852999 1017872684 /nfs/dbraw/zinc/87/26/84/1017872684.db2.gz XNHGHNCZFOKNBR-RYUDHWBXSA-N 2 1 372.387 2.747 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c1 ZINC000925887191 1017882418 /nfs/dbraw/zinc/88/24/18/1017882418.db2.gz UWKWVZIYHDXJMH-XXHMAFKTSA-N 2 1 354.450 2.889 20 10 FFCDMP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167810 1032799879 /nfs/dbraw/zinc/79/98/79/1032799879.db2.gz RUZSKRXHGMSXNU-JOCHJYFZSA-N 3 1 356.558 2.842 20 10 FFCDMP CCN(CC)c1ccc(C[N@H+]2CCOCC3(CC[NH2+]CC3)C2)c(OC)c1 ZINC001222400875 1032944164 /nfs/dbraw/zinc/94/41/64/1032944164.db2.gz LVSZXBUWRJJDTM-UHFFFAOYSA-N 2 1 361.530 2.743 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC4(CCC[NH2+]C4)CC3)c(F)c2)CC1 ZINC001222457272 1032985289 /nfs/dbraw/zinc/98/52/89/1032985289.db2.gz GDSTUKUGOMZFNE-UHFFFAOYSA-N 2 1 360.521 2.543 20 10 FFCDMP C[N@H+](CCN1CC[NH+](Cc2cc(F)ccc2O)CC1)Cc1ccccc1 ZINC000779015394 1022651113 /nfs/dbraw/zinc/65/11/13/1022651113.db2.gz VBMCFYMEDDILOC-UHFFFAOYSA-N 2 1 357.473 2.781 20 10 FFCDMP C[N@@H+](CCN1CC[NH+](Cc2cc(F)ccc2O)CC1)Cc1ccccc1 ZINC000779015394 1022651123 /nfs/dbraw/zinc/65/11/23/1022651123.db2.gz VBMCFYMEDDILOC-UHFFFAOYSA-N 2 1 357.473 2.781 20 10 FFCDMP C[NH+](C)[C@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@@H]2C1 ZINC001120070875 1023228438 /nfs/dbraw/zinc/22/84/38/1023228438.db2.gz CPVQVNSJMPUQAL-ONTIZHBOSA-N 3 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@H]([NH+](C)C)C[C@H]4C3)cc2)CC1 ZINC001120070875 1023228451 /nfs/dbraw/zinc/22/84/51/1023228451.db2.gz CPVQVNSJMPUQAL-ONTIZHBOSA-N 2 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@H]([NH+](C)C)C[C@H]4C3)cc2)CC1 ZINC001120070875 1023228460 /nfs/dbraw/zinc/22/84/60/1023228460.db2.gz CPVQVNSJMPUQAL-ONTIZHBOSA-N 2 1 356.558 2.601 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547803 1023727162 /nfs/dbraw/zinc/72/71/62/1023727162.db2.gz HPKIXVTXZCIKCG-QAPCUYQASA-N 2 1 359.514 2.509 20 10 FFCDMP Oc1ccccc1C[N@H+]1CC[C@@H]2C[NH+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001203552744 1030762313 /nfs/dbraw/zinc/76/23/13/1030762313.db2.gz RVJSVSVJFMYEFV-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@@H]2C[N@H+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001203552744 1030762319 /nfs/dbraw/zinc/76/23/19/1030762319.db2.gz RVJSVSVJFMYEFV-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP Oc1ccccc1C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccncc3)CCO[C@@H]2C1 ZINC001203552744 1030762322 /nfs/dbraw/zinc/76/23/22/1030762322.db2.gz RVJSVSVJFMYEFV-TZIWHRDSSA-N 2 1 353.466 2.510 20 10 FFCDMP COc1cccc(C[N@@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001203594366 1030778989 /nfs/dbraw/zinc/77/89/89/1030778989.db2.gz WVIBRMWVQCWBRF-AZUAARDMSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1cccc(C[N@H+]2C[C@@H]3C[NH+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001203594366 1030779003 /nfs/dbraw/zinc/77/90/03/1030779003.db2.gz WVIBRMWVQCWBRF-AZUAARDMSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1cccc(C[NH+]2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001203594366 1030779020 /nfs/dbraw/zinc/77/90/20/1030779020.db2.gz WVIBRMWVQCWBRF-AZUAARDMSA-N 2 1 360.498 2.724 20 10 FFCDMP COc1cccc(C[NH+]2C[C@@H]3C[N@@H+](CC4CCCC4)CCO[C@@H]3C2)c1O ZINC001203594366 1030779039 /nfs/dbraw/zinc/77/90/39/1030779039.db2.gz WVIBRMWVQCWBRF-AZUAARDMSA-N 2 1 360.498 2.724 20 10 FFCDMP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@]1(O)CCc2ccccc21 ZINC000843420610 1031394198 /nfs/dbraw/zinc/39/41/98/1031394198.db2.gz IVXFMVCTGUEUOX-QHCPKHFHSA-N 2 1 365.521 2.704 20 10 FFCDMP COc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cc1Br ZINC001205638272 1031895806 /nfs/dbraw/zinc/89/58/06/1031895806.db2.gz LVAZEYYOJNZBHH-NEPJUHHUSA-N 2 1 357.292 2.970 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCC(N3CC[NH+](C)CC3)CC2)c(OC)c1 ZINC001138389312 1034225462 /nfs/dbraw/zinc/22/54/62/1034225462.db2.gz MATSICFHNOPDRI-UHFFFAOYSA-N 2 1 374.573 2.753 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4cc5c(cc4C3)OCO5)cc2)CC1 ZINC001139408675 1035092296 /nfs/dbraw/zinc/09/22/96/1035092296.db2.gz OVBSSROGXSSOJR-UHFFFAOYSA-N 2 1 365.477 2.725 20 10 FFCDMP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C[C@@H]1Cc2ccccc2O1 ZINC001139411308 1035094970 /nfs/dbraw/zinc/09/49/70/1035094970.db2.gz FPIQBXADDPOVJN-NRFANRHFSA-N 2 1 351.494 2.874 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](CC(=O)OC(C)(C)C)C3)cc2)CC1 ZINC001139410967 1035096092 /nfs/dbraw/zinc/09/60/92/1035096092.db2.gz OAWJZTWTVPIKBF-IBGZPJMESA-N 2 1 373.541 2.992 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](c4ccncc4)C3)cc2)CC1 ZINC001140306433 1035428195 /nfs/dbraw/zinc/42/81/95/1035428195.db2.gz RVHWKOBYWCZBGA-QFIPXVFZSA-N 2 1 366.509 2.797 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](c4ccncc4)C3)cc2)CC1 ZINC001140306433 1035428198 /nfs/dbraw/zinc/42/81/98/1035428198.db2.gz RVHWKOBYWCZBGA-QFIPXVFZSA-N 2 1 366.509 2.797 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@@H+](C(C)C)[C@@H]3CCN(C(C)=O)C3)cc2)CC1 ZINC001140309549 1035429660 /nfs/dbraw/zinc/42/96/60/1035429660.db2.gz LFEPLJVDFDFURC-JOCHJYFZSA-N 2 1 372.557 2.660 20 10 FFCDMP CCN(CC)c1ccc(C[NH+]2CCC3(CC(N(C)C)=[NH+]O3)CC2)c(O)c1 ZINC001140852141 1036285415 /nfs/dbraw/zinc/28/54/15/1036285415.db2.gz DAKFPAGMSLSSOJ-UHFFFAOYSA-N 2 1 360.502 2.868 20 10 FFCDMP COc1cc(O)c(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1Br ZINC001233139874 1036388164 /nfs/dbraw/zinc/38/81/64/1036388164.db2.gz SHTIMVKISVPORI-UHFFFAOYSA-N 2 1 357.292 2.937 20 10 FFCDMP CC[NH+](CC)CCN1CC[NH+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC001233287365 1036492817 /nfs/dbraw/zinc/49/28/17/1036492817.db2.gz MIJPDYOOVBKVKB-UHFFFAOYSA-N 2 1 355.910 2.514 20 10 FFCDMP Cc1ccc(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3C(C)C)C2)c(O)c1 ZINC001140949618 1036546787 /nfs/dbraw/zinc/54/67/87/1036546787.db2.gz FQZXHNCXOFOKNV-AABGKKOBSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1ccc(C[N@@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C(C)C)C2)c(O)c1 ZINC001140949618 1036546798 /nfs/dbraw/zinc/54/67/98/1036546798.db2.gz FQZXHNCXOFOKNV-AABGKKOBSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1ccc(C[N@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C(C)C)C2)c(O)c1 ZINC001140949618 1036546809 /nfs/dbraw/zinc/54/68/09/1036546809.db2.gz FQZXHNCXOFOKNV-AABGKKOBSA-N 2 1 369.513 2.666 20 10 FFCDMP COc1cc(O)c(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(OC)c1 ZINC001141028329 1036764911 /nfs/dbraw/zinc/76/49/11/1036764911.db2.gz KUHZKROBRAJHTL-QZTJIDSGSA-N 2 1 368.477 2.973 20 10 FFCDMP CC(C)(C)OC(=O)C[C@H]1CCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236092970 1037932174 /nfs/dbraw/zinc/93/21/74/1037932174.db2.gz CBUNROOGPAESFL-LJQANCHMSA-N 2 1 359.514 2.792 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCc4ccc(N)cc4C3)cc2)CC1 ZINC001236232050 1037994567 /nfs/dbraw/zinc/99/45/67/1037994567.db2.gz LRCVYBWTMJUFAV-UHFFFAOYSA-N 2 1 350.510 2.969 20 10 FFCDMP CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236279875 1038019844 /nfs/dbraw/zinc/01/98/44/1038019844.db2.gz SKTRPCBWJOIITD-UHFFFAOYSA-N 2 1 368.525 2.890 20 10 FFCDMP COC(=O)c1cccc(C[N@H+](Cc2ccc(N)cc2)C2CC[NH2+]CC2)c1 ZINC001236465665 1038102369 /nfs/dbraw/zinc/10/23/69/1038102369.db2.gz BCJAIMBIRZKXIJ-UHFFFAOYSA-N 2 1 353.466 2.810 20 10 FFCDMP COC(=O)c1cccc(C[N@@H+](Cc2ccc(N)cc2)C2CC[NH2+]CC2)c1 ZINC001236465665 1038102380 /nfs/dbraw/zinc/10/23/80/1038102380.db2.gz BCJAIMBIRZKXIJ-UHFFFAOYSA-N 2 1 353.466 2.810 20 10 FFCDMP Clc1cc(N2CCOCC2)ccc1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001236930114 1038361937 /nfs/dbraw/zinc/36/19/37/1038361937.db2.gz WZVJLDMKAWSKIE-UHFFFAOYSA-N 2 1 372.900 2.894 20 10 FFCDMP COC[C@@]12CCC[C@@H]1C[N@@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1F)C2 ZINC001236935944 1038367386 /nfs/dbraw/zinc/36/73/86/1038367386.db2.gz OULKXMIXYUNHDG-NQIIRXRSSA-N 2 1 361.505 2.826 20 10 FFCDMP CCOC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1C ZINC001237114167 1038447733 /nfs/dbraw/zinc/44/77/33/1038447733.db2.gz CKAKZFZITGDDBQ-MJGOQNOKSA-N 2 1 359.514 2.507 20 10 FFCDMP C[NH+]1CCC2(CC1)C[N@@H+](Cc1c(O)cc(O)cc1O)Cc1ccccc12 ZINC001278425838 1039191060 /nfs/dbraw/zinc/19/10/60/1039191060.db2.gz HNIRDDKLVFQMMY-UHFFFAOYSA-N 2 1 354.450 2.783 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@H+]([C@@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701982 1039441924 /nfs/dbraw/zinc/44/19/24/1039441924.db2.gz JQPWEGGSBQMSNI-UZKOGDIHSA-N 2 1 373.541 2.755 20 10 FFCDMP Cc1cc(C[NH+]2CCC3(CC[N@H+](CCN(C)C)C3)CC2)ccc1N(C)C ZINC001278686090 1039766975 /nfs/dbraw/zinc/76/69/75/1039766975.db2.gz JBEQKLGOUZLNGQ-UHFFFAOYSA-N 2 1 358.574 2.911 20 10 FFCDMP Cc1cc(C[NH+]2CCC3(CCN(CC[NH+](C)C)C3)CC2)ccc1N(C)C ZINC001278686090 1039766983 /nfs/dbraw/zinc/76/69/83/1039766983.db2.gz JBEQKLGOUZLNGQ-UHFFFAOYSA-N 2 1 358.574 2.911 20 10 FFCDMP COc1ccc(C[NH2+]Cc2nc(-c3ccc(C[NH+](C)C)cc3)no2)c(O)c1 ZINC001248247959 1040192764 /nfs/dbraw/zinc/19/27/64/1040192764.db2.gz TVTDLHCBJNKQAS-UHFFFAOYSA-N 2 1 368.437 2.802 20 10 FFCDMP CCOC(=O)[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCC12C[NH2+]C2 ZINC001237431090 1043156382 /nfs/dbraw/zinc/15/63/82/1043156382.db2.gz MXKZYFDYJCMHOZ-GOSISDBHSA-N 2 1 354.450 2.520 20 10 FFCDMP COC(=O)c1c(C[NH+]2CCC3(CC[N@@H+](C)C3)CC2)c2ccccc2n1C ZINC001279594964 1043311212 /nfs/dbraw/zinc/31/12/12/1043311212.db2.gz GTWLVVZEGMFOOV-UHFFFAOYSA-N 2 1 355.482 2.883 20 10 FFCDMP CCOc1ccc(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001279672002 1043440939 /nfs/dbraw/zinc/44/09/39/1043440939.db2.gz KGBBRRZAKPHSSW-NRFANRHFSA-N 2 1 361.530 2.640 20 10 FFCDMP CC(C)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1(CO)CCC1 ZINC001324113992 1045871920 /nfs/dbraw/zinc/87/19/20/1045871920.db2.gz SSYMTRIOHWUMHB-FQEVSTJZSA-N 2 1 363.521 2.854 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCCC[C@H]3[C@H]3CCC[NH2+]3)cc2F)CC1 ZINC001332340029 1048353689 /nfs/dbraw/zinc/35/36/89/1048353689.db2.gz UYXUBOWWYRWWMT-CTNGQTDRSA-N 2 1 360.521 2.684 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cc2F)CC1 ZINC001329428567 1048715635 /nfs/dbraw/zinc/71/56/35/1048715635.db2.gz SQBDJABPOCDCPE-HXUWFJFHSA-N 3 1 360.521 2.542 20 10 FFCDMP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)[C@@H](O)c1ccccc1 ZINC001329836866 1048933084 /nfs/dbraw/zinc/93/30/84/1048933084.db2.gz YROIZRHEFKQYER-HRAATJIYSA-N 2 1 357.473 2.789 20 10 FFCDMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001341568794 1050195275 /nfs/dbraw/zinc/19/52/75/1050195275.db2.gz FUAWBHWBPOHHGC-IBGZPJMESA-N 3 1 362.537 2.884 20 10 FFCDMP CN1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000295938880 511561467 /nfs/dbraw/zinc/56/14/67/511561467.db2.gz KSVIWDQRCONHPN-FQEVSTJZSA-N 2 1 351.494 2.917 20 10 FFCDMP COc1c([O-])c(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000375690805 512457467 /nfs/dbraw/zinc/45/74/67/512457467.db2.gz IGCQHFHOPNASIT-MRXNPFEDSA-N 2 1 371.437 2.921 20 10 FFCDMP C[NH2+][C@H](C)Cc1noc(Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)n1 ZINC000572521775 518231190 /nfs/dbraw/zinc/23/11/90/518231190.db2.gz SHNSRDUKQPVGEJ-OAHLLOKOSA-N 2 1 367.497 2.990 20 10 FFCDMP CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263758 728729322 /nfs/dbraw/zinc/72/93/22/728729322.db2.gz FSLQNYCSAUXYQY-SJLPKXTDSA-N 2 1 367.921 2.712 20 10 FFCDMP CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1)[NH+](C)C ZINC000134263758 728729323 /nfs/dbraw/zinc/72/93/23/728729323.db2.gz FSLQNYCSAUXYQY-SJLPKXTDSA-N 2 1 367.921 2.712 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+][C@H]2CNCC3(CCOCC3)C2)c1O ZINC000903972907 736196905 /nfs/dbraw/zinc/19/69/05/736196905.db2.gz MDOLQPAESDMBNS-OAHLLOKOSA-N 2 1 369.303 2.711 20 10 FFCDMP COc1ccc(N2CCC([NH2+]Cc3ncc(C[NH+](C)C)s3)CC2)cc1 ZINC000796278005 740124612 /nfs/dbraw/zinc/12/46/12/740124612.db2.gz LBYAHCLXKNRBDV-UHFFFAOYSA-N 2 1 360.527 2.972 20 10 FFCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)c1O ZINC000808693098 741252563 /nfs/dbraw/zinc/25/25/63/741252563.db2.gz WAPVYKFEGHJBID-UONOGXRCSA-N 2 1 353.894 2.592 20 10 FFCDMP Fc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146280 746788206 /nfs/dbraw/zinc/78/82/06/746788206.db2.gz BFAXQTOIVUOZCF-HOTGVXAUSA-N 2 1 351.441 2.518 20 10 FFCDMP Fc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc(F)c1N1CCOCC1 ZINC000839146280 746788213 /nfs/dbraw/zinc/78/82/13/746788213.db2.gz BFAXQTOIVUOZCF-HOTGVXAUSA-N 2 1 351.441 2.518 20 10 FFCDMP COc1cc(Br)cc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1O ZINC000843126312 747777738 /nfs/dbraw/zinc/77/77/38/747777738.db2.gz IUTPYXKOKWILBG-TXEJJXNPSA-N 2 1 355.276 2.595 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cc(Br)ccc3O)C2)C1 ZINC000844901916 748131727 /nfs/dbraw/zinc/13/17/27/748131727.db2.gz IWIDOMYMRZTBGS-SRCQZFHVSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903449 748133404 /nfs/dbraw/zinc/13/34/04/748133404.db2.gz ZFPLKQRMWHSFTQ-XNRPHZJLSA-N 2 1 369.303 2.873 20 10 FFCDMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cccc(Br)c3O)C2)C1 ZINC000844903449 748133411 /nfs/dbraw/zinc/13/34/11/748133411.db2.gz ZFPLKQRMWHSFTQ-XNRPHZJLSA-N 2 1 369.303 2.873 20 10 FFCDMP CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1O ZINC000846227109 748433875 /nfs/dbraw/zinc/43/38/75/748433875.db2.gz GSSYBJUFFCGCDH-CGTJXYLNSA-N 2 1 350.434 2.595 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(O)cc1Br ZINC001206025656 1032112510 /nfs/dbraw/zinc/11/25/10/1032112510.db2.gz OPQHEGFPEZRGIR-VXGBXAGGSA-N 2 1 357.292 2.970 20 10 FFCDMP CC[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000765884353 986807592 /nfs/dbraw/zinc/80/75/92/986807592.db2.gz IVWBBWWFFXXLGL-HXUWFJFHSA-N 2 1 360.546 2.736 20 10 FFCDMP COc1ccc(O)c(C[N@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000809694415 994570706 /nfs/dbraw/zinc/57/07/06/994570706.db2.gz OAFVWUCUMTZWHV-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP COc1ccc(O)c(C[N@@H+](C)CCN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000809694415 994570713 /nfs/dbraw/zinc/57/07/13/994570713.db2.gz OAFVWUCUMTZWHV-UHFFFAOYSA-N 2 1 369.509 2.650 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CCN([C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000809700688 994572418 /nfs/dbraw/zinc/57/24/18/994572418.db2.gz MHQIBGUFXHNLPF-NRFANRHFSA-N 2 1 369.484 2.923 20 10 FFCDMP Oc1ccc(F)cc1C[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000809700688 994572427 /nfs/dbraw/zinc/57/24/27/994572427.db2.gz MHQIBGUFXHNLPF-NRFANRHFSA-N 2 1 369.484 2.923 20 10 FFCDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C2)CC1 ZINC000809756528 994605968 /nfs/dbraw/zinc/60/59/68/994605968.db2.gz SCPAQUPJVNBOIV-IBGZPJMESA-N 2 1 361.505 2.826 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CC4(CCC4)[C@@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811518198 995162807 /nfs/dbraw/zinc/16/28/07/995162807.db2.gz GSDMGGMAYZBFTC-RTWAWAEBSA-N 2 1 355.526 2.972 20 10 FFCDMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447950 1000250500 /nfs/dbraw/zinc/25/05/00/1000250500.db2.gz RYMNOJACQADSSD-JXXFODFXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447950 1000250504 /nfs/dbraw/zinc/25/05/04/1000250504.db2.gz RYMNOJACQADSSD-JXXFODFXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447950 1000250507 /nfs/dbraw/zinc/25/05/07/1000250507.db2.gz RYMNOJACQADSSD-JXXFODFXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OC[C@H]3O)C1 ZINC000768447950 1000250514 /nfs/dbraw/zinc/25/05/14/1000250514.db2.gz RYMNOJACQADSSD-JXXFODFXSA-N 2 1 360.498 2.904 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CC[N@H+]1C ZINC000773145602 1009667980 /nfs/dbraw/zinc/66/79/80/1009667980.db2.gz KELGADJYXUYIDH-GHTZIAJQSA-N 3 1 356.558 2.791 20 10 FFCDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCN1C ZINC000773145602 1009667989 /nfs/dbraw/zinc/66/79/89/1009667989.db2.gz KELGADJYXUYIDH-GHTZIAJQSA-N 2 1 356.558 2.791 20 10 FFCDMP Cc1ccc(C)c(C[N@@H+]2CCCC[C@@]23CC(=O)N(CC[NH+](C)C)C3)c1O ZINC001275771909 1012991863 /nfs/dbraw/zinc/99/18/63/1012991863.db2.gz TWVHPVJWWHYZNV-NRFANRHFSA-N 2 1 359.514 2.528 20 10 FFCDMP CCN(CC)c1ccc(C[NH2+]C2CCC(N3CC[NH2+]CC3)CC2)cc1F ZINC000841087407 1030028086 /nfs/dbraw/zinc/02/80/86/1030028086.db2.gz NLEWKLZYAUAWSN-UHFFFAOYSA-N 2 1 362.537 2.978 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(Cc1cc(F)c(F)cc1O)C2 ZINC001142512812 1030563130 /nfs/dbraw/zinc/56/31/30/1030563130.db2.gz MBKCRLYPMKSNSC-JXFKEZNVSA-N 2 1 366.452 2.851 20 10 FFCDMP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(Cc1cc(F)c(F)cc1[O-])C2 ZINC001142512812 1030563133 /nfs/dbraw/zinc/56/31/33/1030563133.db2.gz MBKCRLYPMKSNSC-JXFKEZNVSA-N 2 1 366.452 2.851 20 10 FFCDMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(Cc1cc(F)c(F)cc1[O-])C2 ZINC001142512812 1030563136 /nfs/dbraw/zinc/56/31/36/1030563136.db2.gz MBKCRLYPMKSNSC-JXFKEZNVSA-N 2 1 366.452 2.851 20 10 FFCDMP COc1ccc(CC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1OC ZINC001204870348 1031457343 /nfs/dbraw/zinc/45/73/43/1031457343.db2.gz QIQNZDRYUKDMRN-UHFFFAOYSA-N 2 1 369.509 2.788 20 10 FFCDMP CN(C)c1ccc(C[NH2+]CCN2CC[N@@H+](C)C(C)(C)C2)c(C(F)(F)F)c1 ZINC000799347108 1031744232 /nfs/dbraw/zinc/74/42/32/1031744232.db2.gz WUHMJXFRVKENTC-UHFFFAOYSA-N 2 1 372.479 2.887 20 10 FFCDMP COc1cc(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)cc(C[NH+](C)C)c1O ZINC001139252843 1035030398 /nfs/dbraw/zinc/03/03/98/1035030398.db2.gz BADCDMMYPCIWAM-HXUWFJFHSA-N 2 1 369.509 2.951 20 10 FFCDMP CCOC(=O)C[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139407750 1035092928 /nfs/dbraw/zinc/09/29/28/1035092928.db2.gz CLIWVYYCPDKITR-LJQANCHMSA-N 2 1 359.514 2.604 20 10 FFCDMP Cc1ccc(O)c(C[NH+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3C(C)C)C2)c1 ZINC001140621081 1035748423 /nfs/dbraw/zinc/74/84/23/1035748423.db2.gz GXHKUMRHWIVGIY-HOJAQTOUSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1ccc(O)c(C[N@@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C(C)C)C2)c1 ZINC001140621081 1035748437 /nfs/dbraw/zinc/74/84/37/1035748437.db2.gz GXHKUMRHWIVGIY-HOJAQTOUSA-N 2 1 369.513 2.666 20 10 FFCDMP Cc1ccc(O)c(C[N@H+]2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[NH+]3C(C)C)C2)c1 ZINC001140621081 1035748456 /nfs/dbraw/zinc/74/84/56/1035748456.db2.gz GXHKUMRHWIVGIY-HOJAQTOUSA-N 2 1 369.513 2.666 20 10 FFCDMP CC1(C)C=Cc2c(O)c(C[N@@H+]3CCOC[C@]4(CCC[NH2+]C4)C3)ccc2O1 ZINC001235017235 1037306305 /nfs/dbraw/zinc/30/63/05/1037306305.db2.gz WCOWUEDZIHTOAQ-NRFANRHFSA-N 2 1 358.482 2.778 20 10 FFCDMP CC1(C)C=Cc2c(O)c(C[N@H+]3CCOC[C@]4(CCC[NH2+]C4)C3)ccc2O1 ZINC001235017235 1037306319 /nfs/dbraw/zinc/30/63/19/1037306319.db2.gz WCOWUEDZIHTOAQ-NRFANRHFSA-N 2 1 358.482 2.778 20 10 FFCDMP Fc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235688874 1037684914 /nfs/dbraw/zinc/68/49/14/1037684914.db2.gz UPSLFHBEUCTKAG-OAQYLSRUSA-N 2 1 355.457 2.889 20 10 FFCDMP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001235714127 1037706251 /nfs/dbraw/zinc/70/62/51/1037706251.db2.gz HHXQQNVKZLQYFS-IBGZPJMESA-N 2 1 351.494 2.866 20 10 FFCDMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)CC2CCC2)CC1 ZINC001236541749 1038125145 /nfs/dbraw/zinc/12/51/45/1038125145.db2.gz SRRCOCCBOISQPF-MXVIHJGJSA-N 3 1 372.557 2.674 20 10 FFCDMP CCOc1ccc(C[N@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@H]3COC)C2)c(O)c1 ZINC001237040340 1038418186 /nfs/dbraw/zinc/41/81/86/1038418186.db2.gz HKCFZNBYUHTKFN-UGKGYDQZSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@H]3COC)c(O)c1 ZINC001237040340 1038418198 /nfs/dbraw/zinc/41/81/98/1038418198.db2.gz HKCFZNBYUHTKFN-UGKGYDQZSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c(O)c1 ZINC001237040340 1038418204 /nfs/dbraw/zinc/41/82/04/1038418204.db2.gz HKCFZNBYUHTKFN-UGKGYDQZSA-N 2 1 374.525 2.971 20 10 FFCDMP Cc1c(O)ccc(C[N@@H+]2CCC[C@@]3(CCCN(CC[NH+](C)C)C3)C2)c1O ZINC001279313697 1042996323 /nfs/dbraw/zinc/99/63/23/1042996323.db2.gz PMJADAWZUXWTRW-OAQYLSRUSA-N 2 1 361.530 2.646 20 10 FFCDMP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001279513228 1043208590 /nfs/dbraw/zinc/20/85/90/1043208590.db2.gz BUYRIHHPKGJYQN-IYBDPMFKSA-N 2 1 357.420 2.621 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+][C@]3(CO)CCc4ccccc43)cc2F)CC1 ZINC001319392658 1045134627 /nfs/dbraw/zinc/13/46/27/1045134627.db2.gz YDKJSPKSQYKUHX-QFIPXVFZSA-N 2 1 369.484 2.501 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C3CCOCC3)cc2F)CC1 ZINC001319869633 1045290297 /nfs/dbraw/zinc/29/02/97/1045290297.db2.gz FNHRIIARTBZPIK-FQEVSTJZSA-N 2 1 361.505 2.969 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3C3CCOCC3)cc2F)CC1 ZINC001319869633 1045290302 /nfs/dbraw/zinc/29/03/02/1045290302.db2.gz FNHRIIARTBZPIK-FQEVSTJZSA-N 2 1 361.505 2.969 20 10 FFCDMP Cc1ccccc1C[C@H](CO)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001320607805 1045436301 /nfs/dbraw/zinc/43/63/01/1045436301.db2.gz JLKNZINPZYUMTE-HXUWFJFHSA-N 2 1 371.500 2.579 20 10 FFCDMP CC(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccnn1C ZINC001320780254 1045466722 /nfs/dbraw/zinc/46/67/22/1045466722.db2.gz YAFDNCVHANRGDD-GOSISDBHSA-N 2 1 373.520 2.840 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C3(O)CCCC3)cc2F)CC1 ZINC001325134109 1046386993 /nfs/dbraw/zinc/38/69/93/1046386993.db2.gz SXDUQZJDKQWSAQ-UHFFFAOYSA-N 2 1 363.521 2.998 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH2+]CCCO[C@@H]3CCCCO3)cc2F)CC1 ZINC001332782677 1048560659 /nfs/dbraw/zinc/56/06/59/1048560659.db2.gz IMALAFIZBRWWGM-HXUWFJFHSA-N 2 1 365.493 2.600 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)cc2F)CC1 ZINC001330781281 1049324928 /nfs/dbraw/zinc/32/49/28/1049324928.db2.gz WFMGPEBJQWMGIH-FQEVSTJZSA-N 2 1 374.548 2.789 20 10 FFCDMP COc1cc(C)cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H]2CO)c1O ZINC001334359710 1049388154 /nfs/dbraw/zinc/38/81/54/1049388154.db2.gz PZAHGSGRCHEKGE-FQEVSTJZSA-N 2 1 370.493 2.956 20 10 FFCDMP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H]1n1ccnc1 ZINC001341604653 1050230710 /nfs/dbraw/zinc/23/07/10/1050230710.db2.gz LEAJPOYMRCOOFI-LAUBAEHRSA-N 2 1 371.504 2.857 20 10 FFCDMP C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C[C@H]1n1ccnc1 ZINC001341604653 1050230717 /nfs/dbraw/zinc/23/07/17/1050230717.db2.gz LEAJPOYMRCOOFI-LAUBAEHRSA-N 2 1 371.504 2.857 20 10 FFCDMP Cc1ncc2c(n1)CCC[C@@H]2[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001560328107 1076264754 /nfs/dbraw/zinc/26/47/54/1076264754.db2.gz GWKJSISAFBEGBX-IBGZPJMESA-N 2 1 369.488 2.843 20 10 FFCDMP C[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1ccc(Br)cc1O ZINC000185367367 510824202 /nfs/dbraw/zinc/82/42/02/510824202.db2.gz BJIRLGIAMCSBBR-AWEZNQCLSA-N 2 1 370.335 2.833 20 10 FFCDMP CC(C)[N@@H+](C)CCNC(=O)Cn1c2ccccc2c2c1CC[NH+](C(C)C)C2 ZINC000444228581 514160465 /nfs/dbraw/zinc/16/04/65/514160465.db2.gz XSUQAZAWKXXLKD-UHFFFAOYSA-N 2 1 370.541 2.864 20 10 FFCDMP CC(C)[NH+](C)CCNC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000444228581 514160473 /nfs/dbraw/zinc/16/04/73/514160473.db2.gz XSUQAZAWKXXLKD-UHFFFAOYSA-N 2 1 370.541 2.864 20 10 FFCDMP CC(C)[NH+](C)CCNC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000444228581 514160478 /nfs/dbraw/zinc/16/04/78/514160478.db2.gz XSUQAZAWKXXLKD-UHFFFAOYSA-N 2 1 370.541 2.864 20 10 FFCDMP CN(C)c1cc(F)c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1F ZINC000862221278 730677657 /nfs/dbraw/zinc/67/76/57/730677657.db2.gz XWKDGGVCKROMMF-UHFFFAOYSA-N 2 1 353.457 2.575 20 10 FFCDMP COc1cc(Br)cc(C[NH2+]CCCn2cc[nH+]c2C)c1O ZINC000725846397 734396009 /nfs/dbraw/zinc/39/60/09/734396009.db2.gz DAEYUJZBRNWXQR-UHFFFAOYSA-N 2 1 354.248 2.848 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCSC4(CCOCC4)C3)cc2)CC1 ZINC000770665565 737650567 /nfs/dbraw/zinc/65/05/67/737650567.db2.gz JZELJWUTEUUWKB-UHFFFAOYSA-N 2 1 361.555 2.536 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C2 ZINC000922391142 738136047 /nfs/dbraw/zinc/13/60/47/738136047.db2.gz SWKFEMZFDMTBCV-WCZJQEMASA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391142 738136050 /nfs/dbraw/zinc/13/60/50/738136050.db2.gz SWKFEMZFDMTBCV-WCZJQEMASA-N 2 1 356.869 2.754 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000922391142 738136053 /nfs/dbraw/zinc/13/60/53/738136053.db2.gz SWKFEMZFDMTBCV-WCZJQEMASA-N 2 1 356.869 2.754 20 10 FFCDMP Cc1cc(Br)cc(C[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1O ZINC000827549824 743599418 /nfs/dbraw/zinc/59/94/18/743599418.db2.gz VJJLOBHLAJEACV-INIZCTEOSA-N 2 1 369.303 2.806 20 10 FFCDMP [O-]c1cc(F)c(F)cc1C[NH+]1C[C@@H]2CC[N@H+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279105668 958949607 /nfs/dbraw/zinc/94/96/07/958949607.db2.gz DIICSSRBZFKDJC-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1cc(F)c(F)cc1C[N@H+]1C[C@@H]2CC[NH+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279105668 958949622 /nfs/dbraw/zinc/94/96/22/958949622.db2.gz DIICSSRBZFKDJC-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1cc(F)c(F)cc1C[N@@H+]1C[C@@H]2CC[NH+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279105668 958949637 /nfs/dbraw/zinc/94/96/37/958949637.db2.gz DIICSSRBZFKDJC-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1cc(F)c(F)cc1C[NH+]1C[C@@H]2CC[N@@H+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279105668 958949651 /nfs/dbraw/zinc/94/96/51/958949651.db2.gz DIICSSRBZFKDJC-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP Oc1cc(F)c(F)cc1C[NH+]1C[C@@H]2CC[N@H+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001279105668 958949659 /nfs/dbraw/zinc/94/96/59/958949659.db2.gz DIICSSRBZFKDJC-GASCZTMLSA-N 2 1 362.424 2.738 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCC[NH+](C)C2)C1 ZINC000683479817 960769743 /nfs/dbraw/zinc/76/97/43/960769743.db2.gz LUUKJYKJZLTWAM-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCC[N@H+](C)C2)C1 ZINC000683479817 960769766 /nfs/dbraw/zinc/76/97/66/960769766.db2.gz LUUKJYKJZLTWAM-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCC[N@@H+](C)C2)C1 ZINC000683479817 960769783 /nfs/dbraw/zinc/76/97/83/960769783.db2.gz LUUKJYKJZLTWAM-KRWDZBQOSA-N 2 1 368.525 2.618 20 10 FFCDMP Oc1ccccc1C[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000809700737 994574632 /nfs/dbraw/zinc/57/46/32/994574632.db2.gz NISJATHZPUINLV-OAQYLSRUSA-N 2 1 351.494 2.784 20 10 FFCDMP Oc1ccccc1C[N@H+](C[C@H]1CC2(CO1)CC[NH2+]CC2)C[C@@H]1CCCO1 ZINC000903719176 1016149488 /nfs/dbraw/zinc/14/94/88/1016149488.db2.gz WJRCFTNDNHXMLX-RBUKOAKNSA-N 2 1 360.498 2.532 20 10 FFCDMP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)C1 ZINC000738208303 999622618 /nfs/dbraw/zinc/62/26/18/999622618.db2.gz LFKSVEMYJWENJU-GOSISDBHSA-N 2 1 361.530 2.607 20 10 FFCDMP C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3cc(C(C)(C)C)cc(O)c3O)CC2)C1 ZINC000738208303 999622621 /nfs/dbraw/zinc/62/26/21/999622621.db2.gz LFKSVEMYJWENJU-GOSISDBHSA-N 2 1 361.530 2.607 20 10 FFCDMP C[C@H]1C[N@H+](Cc2cccc(I)c2O)CCC[C@H]1C[NH3+] ZINC001206028304 1000501432 /nfs/dbraw/zinc/50/14/32/1000501432.db2.gz YBFHTXPVXJIAAD-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2cccc(I)c2O)CCC[C@H]1C[NH3+] ZINC001206028304 1000501437 /nfs/dbraw/zinc/50/14/37/1000501437.db2.gz YBFHTXPVXJIAAD-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP Cn1c2ccccc2nc1C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775695037 1003703507 /nfs/dbraw/zinc/70/35/07/1003703507.db2.gz DLWDZWWVPYESMT-UHFFFAOYSA-N 2 1 363.509 2.957 20 10 FFCDMP Cn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775695037 1003703517 /nfs/dbraw/zinc/70/35/17/1003703517.db2.gz DLWDZWWVPYESMT-UHFFFAOYSA-N 2 1 363.509 2.957 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2)CC1 ZINC000775698592 1003704229 /nfs/dbraw/zinc/70/42/29/1003704229.db2.gz OVCOQYOBYSZOMI-UHFFFAOYSA-N 2 1 366.465 2.905 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2)CC1 ZINC000775698592 1003704238 /nfs/dbraw/zinc/70/42/38/1003704238.db2.gz OVCOQYOBYSZOMI-UHFFFAOYSA-N 2 1 366.465 2.905 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cc2)CC1 ZINC000775724562 1003830270 /nfs/dbraw/zinc/83/02/70/1003830270.db2.gz LWMWYHXRNSAUSM-UHFFFAOYSA-N 2 1 358.574 2.992 20 10 FFCDMP COCC[N@@H+](Cc1ccc(C)o1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775726840 1003860743 /nfs/dbraw/zinc/86/07/43/1003860743.db2.gz YLILVASWSJDXGZ-UHFFFAOYSA-N 2 1 357.498 2.988 20 10 FFCDMP Cc1noc(C)c1CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001201373087 1005202827 /nfs/dbraw/zinc/20/28/27/1005202827.db2.gz RGJDLBVHBKZTDN-UHFFFAOYSA-N 2 1 360.477 2.905 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000850419679 1005814341 /nfs/dbraw/zinc/81/43/41/1005814341.db2.gz GTJBASVOBLLNII-UHFFFAOYSA-N 2 1 356.558 2.650 20 10 FFCDMP Cc1cc(O)c(C[N@H+]2CCC[C@H](c3cc(N4CC[NH2+]CC4)n[nH]3)C2)cc1C ZINC000853248316 1006350318 /nfs/dbraw/zinc/35/03/18/1006350318.db2.gz DBWUDCSPAGXGKK-KRWDZBQOSA-N 2 1 369.513 2.521 20 10 FFCDMP CC[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555306 1007884506 /nfs/dbraw/zinc/88/45/06/1007884506.db2.gz ZLCONSAGUCNOAL-LJQANCHMSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555306 1007884513 /nfs/dbraw/zinc/88/45/13/1007884513.db2.gz ZLCONSAGUCNOAL-LJQANCHMSA-N 2 1 371.481 2.901 20 10 FFCDMP CC[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)ccn1 ZINC000856555306 1007884516 /nfs/dbraw/zinc/88/45/16/1007884516.db2.gz ZLCONSAGUCNOAL-LJQANCHMSA-N 2 1 371.481 2.901 20 10 FFCDMP CC(C)n1ncnc1C[NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1 ZINC000865517045 1010804364 /nfs/dbraw/zinc/80/43/64/1010804364.db2.gz LHGXRDSMKJWAIO-UHFFFAOYSA-N 2 1 368.529 2.681 20 10 FFCDMP CCOC(=O)[C@@H]1CC2(C[N@H+]1Cc1ccc3c(c1)CCCN3C)CC[NH2+]CC2 ZINC001222221565 1032832773 /nfs/dbraw/zinc/83/27/73/1032832773.db2.gz NZYWPWINGZCJTC-FQEVSTJZSA-N 2 1 371.525 2.576 20 10 FFCDMP COc1cc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)ccc1O ZINC001116437865 1021216081 /nfs/dbraw/zinc/21/60/81/1021216081.db2.gz WDVQSGAFECBOQL-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)ccc1O ZINC001116437865 1021216092 /nfs/dbraw/zinc/21/60/92/1021216092.db2.gz WDVQSGAFECBOQL-UHFFFAOYSA-N 2 1 373.472 2.924 20 10 FFCDMP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001116565355 1021287423 /nfs/dbraw/zinc/28/74/23/1021287423.db2.gz PWPHRPWJULUIRW-RDJZCZTQSA-N 2 1 359.514 2.781 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC4(CCOCC4)C3)cc2F)CC1 ZINC001116826426 1021439383 /nfs/dbraw/zinc/43/93/83/1021439383.db2.gz PFUQTOWTZQNFSP-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC4(CCOCC4)C3)cc2F)CC1 ZINC001116826426 1021439388 /nfs/dbraw/zinc/43/93/88/1021439388.db2.gz PFUQTOWTZQNFSP-UHFFFAOYSA-N 2 1 361.505 2.970 20 10 FFCDMP CC(C)(C)c1cc(O)c(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)cc1Cl ZINC001222515606 1033023146 /nfs/dbraw/zinc/02/31/46/1033023146.db2.gz WEDMYQDSMPTXSL-IRXDYDNUSA-N 2 1 351.922 2.869 20 10 FFCDMP CCN1CCN(c2ccc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)cc2F)CC1 ZINC000155321389 1022240870 /nfs/dbraw/zinc/24/08/70/1022240870.db2.gz TVLNOZVBUKECAA-KRWDZBQOSA-N 2 1 362.537 2.788 20 10 FFCDMP COc1cc(C[N@@H+](C)CCCC(=O)c2cccnc2)cc(C[NH+](C)C)c1O ZINC001139257427 1035030102 /nfs/dbraw/zinc/03/01/02/1035030102.db2.gz BFHQUQGSESRAHF-UHFFFAOYSA-N 2 1 371.481 2.952 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCN(c4ccccn4)CC3)cc2)CC1 ZINC001139404368 1035090988 /nfs/dbraw/zinc/09/09/88/1035090988.db2.gz CHARUWFIFNRFGQ-UHFFFAOYSA-N 2 1 365.525 2.546 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@]4(CCC(=O)O4)C3)cc2)CC1 ZINC001140305577 1035427413 /nfs/dbraw/zinc/42/74/13/1035427413.db2.gz CRCDAOWSIKOWSF-OAQYLSRUSA-N 2 1 357.498 2.500 20 10 FFCDMP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)C[N@@H+](C)C(C)C)cc1C ZINC001230284574 1037195302 /nfs/dbraw/zinc/19/53/02/1037195302.db2.gz LMJXXTYUCCLAIZ-RTBURBONSA-N 2 1 361.530 2.861 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155291 1037390073 /nfs/dbraw/zinc/39/00/73/1037390073.db2.gz OAGXRAZBRMDRDT-QFIPXVFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3CCCC[C@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155291 1037390090 /nfs/dbraw/zinc/39/00/90/1037390090.db2.gz OAGXRAZBRMDRDT-QFIPXVFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)cc2)CC1 ZINC001235155291 1037390096 /nfs/dbraw/zinc/39/00/96/1037390096.db2.gz OAGXRAZBRMDRDT-QFIPXVFZSA-N 2 1 356.558 2.793 20 10 FFCDMP CC[NH+]1CCN(c2ccc(C[N@H+]3CCN[C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855550 1037798320 /nfs/dbraw/zinc/79/83/20/1037798320.db2.gz UFROIRYLUIHPAF-QHCPKHFHSA-N 2 1 364.537 2.975 20 10 FFCDMP CC[NH+]1CCN(c2ccc(CN3CC[NH2+][C@H](c4ccccc4)C3)cc2)CC1 ZINC001235855550 1037798339 /nfs/dbraw/zinc/79/83/39/1037798339.db2.gz UFROIRYLUIHPAF-QHCPKHFHSA-N 2 1 364.537 2.975 20 10 FFCDMP CN1CCN(c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)c(F)c2)CC1 ZINC001235887654 1037819483 /nfs/dbraw/zinc/81/94/83/1037819483.db2.gz IDXDIKSQLOGDCA-OAQYLSRUSA-N 2 1 360.521 2.542 20 10 FFCDMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971778 1037869117 /nfs/dbraw/zinc/86/91/17/1037869117.db2.gz AGVQUZOCEWTKBY-VXKWHMMOSA-N 3 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971778 1037869121 /nfs/dbraw/zinc/86/91/21/1037869121.db2.gz AGVQUZOCEWTKBY-VXKWHMMOSA-N 3 1 356.558 2.935 20 10 FFCDMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235971778 1037869125 /nfs/dbraw/zinc/86/91/25/1037869125.db2.gz AGVQUZOCEWTKBY-VXKWHMMOSA-N 3 1 356.558 2.935 20 10 FFCDMP Cc1cccnc1O[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236535416 1038122086 /nfs/dbraw/zinc/12/20/86/1038122086.db2.gz HJHSENZJRORSGG-NRFANRHFSA-N 2 1 366.509 2.843 20 10 FFCDMP Cc1ccnc(O[C@@H]2CCC[N@@H+](Cc3cc4c(cc3O)OCC[NH2+]C4)C2)c1 ZINC001236533686 1038122988 /nfs/dbraw/zinc/12/29/88/1038122988.db2.gz YBLQIURFTUWBII-GOSISDBHSA-N 2 1 369.465 2.621 20 10 FFCDMP CC[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)Cc1ccc2c(c1)OCO2 ZINC001236662123 1038179260 /nfs/dbraw/zinc/17/92/60/1038179260.db2.gz IJLDUUCIZWQURU-UHFFFAOYSA-N 2 1 353.466 2.847 20 10 FFCDMP Cc1cccc(O[C@H]2CCC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)n1 ZINC001236847299 1038307387 /nfs/dbraw/zinc/30/73/87/1038307387.db2.gz IZIFXWGCDBSHAY-NRFANRHFSA-N 2 1 366.509 2.843 20 10 FFCDMP Oc1ccc([C@H](O)C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1O ZINC001255382896 1041311019 /nfs/dbraw/zinc/31/10/19/1041311019.db2.gz YDJYRHVAUKMVSE-WIYYLYMNSA-N 2 1 356.466 2.776 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC12C[NH2+]C2 ZINC001237432299 1043158323 /nfs/dbraw/zinc/15/83/23/1043158323.db2.gz XGCXLRXSEJQWIT-KRWDZBQOSA-N 2 1 360.498 2.664 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@H+](Cc1cccc(C(F)(F)F)c1O)C2 ZINC001279504394 1043198302 /nfs/dbraw/zinc/19/83/02/1043198302.db2.gz HTXDSJXUIZQPIP-UHFFFAOYSA-N 2 1 371.447 2.870 20 10 FFCDMP C[NH+](C)CCN1CC2(C1)CCC[N@@H+](Cc1cccc(C(F)(F)F)c1O)C2 ZINC001279504394 1043198309 /nfs/dbraw/zinc/19/83/09/1043198309.db2.gz HTXDSJXUIZQPIP-UHFFFAOYSA-N 2 1 371.447 2.870 20 10 FFCDMP CN(C)[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccco1 ZINC001318347117 1045276664 /nfs/dbraw/zinc/27/66/64/1045276664.db2.gz YIOPHLGEGRTOFM-IBGZPJMESA-N 2 1 360.477 2.563 20 10 FFCDMP C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001328086413 1048170796 /nfs/dbraw/zinc/17/07/96/1048170796.db2.gz SDVBVVKEEJTOSJ-HTAPYJJXSA-N 2 1 371.500 2.832 20 10 FFCDMP C[NH+]1CCN(c2ccc(CN3CCCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2F)CC1 ZINC001332340037 1048353445 /nfs/dbraw/zinc/35/34/45/1048353445.db2.gz UYXUBOWWYRWWMT-PZJWPPBQSA-N 2 1 360.521 2.684 20 10 FFCDMP CCc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000848898796 1055324688 /nfs/dbraw/zinc/32/46/88/1055324688.db2.gz YLAFFVFLBPOFDS-NHCUHLMSSA-N 2 1 354.494 2.927 20 10 FFCDMP CCc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000848898796 1055324705 /nfs/dbraw/zinc/32/47/05/1055324705.db2.gz YLAFFVFLBPOFDS-NHCUHLMSSA-N 2 1 354.494 2.927 20 10 FFCDMP CN(C)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CCCC1 ZINC001338448712 1055524237 /nfs/dbraw/zinc/52/42/37/1055524237.db2.gz PFPABICZLGHFDW-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP CN(C)CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CCCC1 ZINC001338448712 1055524251 /nfs/dbraw/zinc/52/42/51/1055524251.db2.gz PFPABICZLGHFDW-UHFFFAOYSA-N 2 1 362.537 2.884 20 10 FFCDMP CCc1nc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)cs1 ZINC001560305832 1076262344 /nfs/dbraw/zinc/26/23/44/1076262344.db2.gz CYZFMACYCFFWPV-UHFFFAOYSA-N 2 1 362.518 2.929 20 10 FFCDMP COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000273622779 511554074 /nfs/dbraw/zinc/55/40/74/511554074.db2.gz ZPHNJDUOLRIHSZ-HNNXBMFYSA-N 2 1 372.465 2.970 20 10 FFCDMP CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)N2CCC[NH+](C)CC2)C1 ZINC000443916699 514071641 /nfs/dbraw/zinc/07/16/41/514071641.db2.gz GHDFNKQLLHBIHV-UHFFFAOYSA-N 2 1 368.525 2.572 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CCC[N@H+](C)CC2)C1 ZINC000443916699 514071649 /nfs/dbraw/zinc/07/16/49/514071649.db2.gz GHDFNKQLLHBIHV-UHFFFAOYSA-N 2 1 368.525 2.572 20 10 FFCDMP CC(C)[NH+]1CCc2c(c3ccccc3n2CC(=O)N2CCC[N@@H+](C)CC2)C1 ZINC000443916699 514071653 /nfs/dbraw/zinc/07/16/53/514071653.db2.gz GHDFNKQLLHBIHV-UHFFFAOYSA-N 2 1 368.525 2.572 20 10 FFCDMP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)c(F)c1 ZINC000925781706 738529372 /nfs/dbraw/zinc/52/93/72/738529372.db2.gz ZTGNVJVZWFESPA-DZGCQCFKSA-N 2 1 357.420 2.558 20 10 FFCDMP Cc1cc(Br)c(O)c(C[NH+]2CCC(OCCC[NH3+])CC2)c1 ZINC000843056384 747757385 /nfs/dbraw/zinc/75/73/85/747757385.db2.gz IPYGERQORRZDAZ-UHFFFAOYSA-N 2 1 357.292 2.793 20 10 FFCDMP Cc1cc(Br)cc(C[N@@H+]2CCOC3(CC[NH+](C)CC3)C2)c1O ZINC000843431504 747835356 /nfs/dbraw/zinc/83/53/56/747835356.db2.gz FVRJSHDYDLHVOJ-UHFFFAOYSA-N 2 1 369.303 2.760 20 10 FFCDMP Cc1cc(Br)cc(C[N@H+]2CCOC3(CC[NH+](C)CC3)C2)c1O ZINC000843431504 747835360 /nfs/dbraw/zinc/83/53/60/747835360.db2.gz FVRJSHDYDLHVOJ-UHFFFAOYSA-N 2 1 369.303 2.760 20 10 FFCDMP CCCOc1ccc(C[NH2+]C2CC[NH+](CCC(=O)N(C)C)CC2)cc1C ZINC000873048324 1013363801 /nfs/dbraw/zinc/36/38/01/1013363801.db2.gz WYPGNRWXXAWRMC-UHFFFAOYSA-N 2 1 361.530 2.816 20 10 FFCDMP C[N@@H+]1CC[C@H]2C[NH+](Cc3cc(O)c(Br)cc3O)C[C@H]2CC1 ZINC001279663259 968010232 /nfs/dbraw/zinc/01/02/32/968010232.db2.gz IRULIFZJGWWWDN-TXEJJXNPSA-N 2 1 355.276 2.634 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@@H+](Cc3cc(O)c(Br)cc3O)C[C@H]2CC1 ZINC001279663259 968010242 /nfs/dbraw/zinc/01/02/42/968010242.db2.gz IRULIFZJGWWWDN-TXEJJXNPSA-N 2 1 355.276 2.634 20 10 FFCDMP C[NH+]1CC[C@H]2C[N@H+](Cc3cc(O)c(Br)cc3O)C[C@H]2CC1 ZINC001279663259 968010255 /nfs/dbraw/zinc/01/02/55/968010255.db2.gz IRULIFZJGWWWDN-TXEJJXNPSA-N 2 1 355.276 2.634 20 10 FFCDMP CN(C(=O)CC1([NH3+])CC[NH+](Cc2ccccc2)CC1)c1ccc(N)cc1 ZINC000877074860 1014469615 /nfs/dbraw/zinc/46/96/15/1014469615.db2.gz UJCVRCRTMOFXSZ-UHFFFAOYSA-N 2 1 352.482 2.615 20 10 FFCDMP C[C@H]1C[N@@H+](Cc2ccc(I)cc2O)CCC[C@H]1C[NH3+] ZINC001206014487 1032107367 /nfs/dbraw/zinc/10/73/67/1032107367.db2.gz WXHFNSGQAPMGPR-RYUDHWBXSA-N 2 1 374.266 2.804 20 10 FFCDMP O[C@@H]1CC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2)C1 ZINC000922240861 988235047 /nfs/dbraw/zinc/23/50/47/988235047.db2.gz SBESXTKSERYFON-OAQYLSRUSA-N 2 1 352.478 2.868 20 10 FFCDMP CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388493 988534911 /nfs/dbraw/zinc/53/49/11/988534911.db2.gz FGMYHSSWSVYOKW-RSPOEFSDSA-N 2 1 367.484 2.600 20 10 FFCDMP COc1ccc([C@@H](C[NH3+])C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000844220940 997711846 /nfs/dbraw/zinc/71/18/46/997711846.db2.gz RCNSXQGIOZMHED-FQEVSTJZSA-N 2 1 369.509 2.706 20 10 FFCDMP COc1ccc([C@@H](C[NH3+])C[NH+]2CCN(c3ccc(OC)c(F)c3)CC2)cc1 ZINC000844221292 997712046 /nfs/dbraw/zinc/71/20/46/997712046.db2.gz MGWVINMYQTVKKI-KRWDZBQOSA-N 2 1 373.472 2.707 20 10 FFCDMP C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775659059 1004974744 /nfs/dbraw/zinc/97/47/44/1004974744.db2.gz UNCODFSCEAXNJW-LJQANCHMSA-N 2 1 353.510 2.821 20 10 FFCDMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677367 1005003974 /nfs/dbraw/zinc/00/39/74/1005003974.db2.gz ALYUPMOOZROXIG-ZCNNSNEGSA-N 2 1 358.574 2.894 20 10 FFCDMP C[C@@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199677367 1005003981 /nfs/dbraw/zinc/00/39/81/1005003981.db2.gz ALYUPMOOZROXIG-ZCNNSNEGSA-N 2 1 358.574 2.894 20 10 FFCDMP Cc1cc(O)c(C[N@H+]2CCC[C@@H](c3cc(N4CC[NH2+]CC4)n[nH]3)C2)cc1C ZINC000853248321 1006349776 /nfs/dbraw/zinc/34/97/76/1006349776.db2.gz DBWUDCSPAGXGKK-QGZVFWFLSA-N 2 1 369.513 2.521 20 10 FFCDMP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2([NH3+])C3CC4CC(C3)CC2C4)c1 ZINC000817984136 1007837632 /nfs/dbraw/zinc/83/76/32/1007837632.db2.gz NYMZSVNZRPGQDG-JEWOCMGZSA-N 2 1 358.482 2.983 20 10 FFCDMP C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCN(C)CC2)cc1)c1c(O)cccc1F ZINC000886503736 1008705156 /nfs/dbraw/zinc/70/51/56/1008705156.db2.gz CBKWZABCLLPWRF-OAHLLOKOSA-N 2 1 371.456 2.770 20 10 FFCDMP CC1(C)[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925504080 1017770876 /nfs/dbraw/zinc/77/08/76/1017770876.db2.gz PGMDHGLFVIDOAA-UXPWSPDFSA-N 2 1 361.505 2.653 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3c(O)ccc4ccccc43)C[C@@H]1C[NH2+]CCC2 ZINC001222136034 1032780507 /nfs/dbraw/zinc/78/05/07/1032780507.db2.gz LKMPEFGOJRJHDW-JTSKRJEESA-N 2 1 368.477 2.910 20 10 FFCDMP c1cc(N2CCC[N@H+](Cc3ccc(N4CCOCC4)cc3)CC2)cc[nH+]1 ZINC000930806037 1020195717 /nfs/dbraw/zinc/19/57/17/1020195717.db2.gz MBTLZZPELLERRS-UHFFFAOYSA-N 2 1 352.482 2.631 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC34CC[NH+](C)CC4)cc2F)CC1 ZINC001116739990 1021387296 /nfs/dbraw/zinc/38/72/96/1021387296.db2.gz DAWXONXZGKYSJX-UHFFFAOYSA-N 2 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC34CC[NH+](C)CC4)cc2F)CC1 ZINC001116739990 1021387314 /nfs/dbraw/zinc/38/73/14/1021387314.db2.gz DAWXONXZGKYSJX-UHFFFAOYSA-N 3 1 360.521 2.638 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC34CC[NH+](C)CC4)cc2F)CC1 ZINC001116739990 1021387333 /nfs/dbraw/zinc/38/73/33/1021387333.db2.gz DAWXONXZGKYSJX-UHFFFAOYSA-N 3 1 360.521 2.638 20 10 FFCDMP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cc2c(cc1O)CCCC2 ZINC000756547797 1023727360 /nfs/dbraw/zinc/72/73/60/1023727360.db2.gz HPKIXVTXZCIKCG-CRAIPNDOSA-N 2 1 359.514 2.509 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)cc(C[NH+](C)C)c1O ZINC001139260412 1035031583 /nfs/dbraw/zinc/03/15/83/1035031583.db2.gz LOKKGMXJBRLJLD-GOSISDBHSA-N 2 1 371.481 2.819 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1O ZINC001233485816 1036653517 /nfs/dbraw/zinc/65/35/17/1036653517.db2.gz LJUZRVJIRSHOLQ-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1O ZINC001233485816 1036653524 /nfs/dbraw/zinc/65/35/24/1036653524.db2.gz LJUZRVJIRSHOLQ-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1O ZINC001233485816 1036653532 /nfs/dbraw/zinc/65/35/32/1036653532.db2.gz LJUZRVJIRSHOLQ-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1O ZINC001233485816 1036653539 /nfs/dbraw/zinc/65/35/39/1036653539.db2.gz LJUZRVJIRSHOLQ-OAQYLSRUSA-N 2 1 354.450 2.901 20 10 FFCDMP CCCCN(CCCC)c1ccc(C[N@@H+]2CCN[C@@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235060706 1037334913 /nfs/dbraw/zinc/33/49/13/1037334913.db2.gz GIFJHZVZRHVNLQ-JOCHJYFZSA-N 2 1 374.573 2.936 20 10 FFCDMP CCCCN(CCCC)c1ccc(C[N@H+]2CCN[C@@]3(CC[NH2+]C3)C2)c(O)c1 ZINC001235060706 1037334929 /nfs/dbraw/zinc/33/49/29/1037334929.db2.gz GIFJHZVZRHVNLQ-JOCHJYFZSA-N 2 1 374.573 2.936 20 10 FFCDMP CCOC(=O)[C@@]12C[N@@H+](Cc3ccc4ccccc4c3O)C[C@@H]1CC[NH2+]CC2 ZINC001235351121 1037497080 /nfs/dbraw/zinc/49/70/80/1037497080.db2.gz DNRAVIUBLVAAME-AVRDEDQJSA-N 2 1 368.477 2.910 20 10 FFCDMP CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001235694385 1037690331 /nfs/dbraw/zinc/69/03/31/1037690331.db2.gz DSAUNZLEAXDHDQ-SFHVURJKSA-N 2 1 359.514 2.650 20 10 FFCDMP COc1ccc(N2CC[NH+](C[C@H]3[C@@H](C)C[NH2+]CC3(F)F)CC2)c(C)c1 ZINC001236368930 1038061489 /nfs/dbraw/zinc/06/14/89/1038061489.db2.gz WMPZGWYYEYPGKT-RDJZCZTQSA-N 2 1 353.457 2.616 20 10 FFCDMP CN1CCN(c2ccc(CN(C[C@H]3CCC[NH2+]C3)C3CC3)c(F)c2)CC1 ZINC001236602483 1038149475 /nfs/dbraw/zinc/14/94/75/1038149475.db2.gz WHDRMYNKDRJVSB-KRWDZBQOSA-N 3 1 360.521 2.542 20 10 FFCDMP CN1CCN(c2ccc(C[NH2+]C3CCC4(CC[NH2+]CC4)CC3)cc2)CC1 ZINC001246182412 1039268897 /nfs/dbraw/zinc/26/88/97/1039268897.db2.gz BAYCTGPEVIJBSQ-UHFFFAOYSA-N 2 1 356.558 2.840 20 10 FFCDMP COc1ccc(N2CCOC[C@]3(CCC[N@H+]([C@H]4CC[NH2+][C@H](C)C4)C3)C2)cc1 ZINC001246701973 1039442105 /nfs/dbraw/zinc/44/21/05/1039442105.db2.gz JQPWEGGSBQMSNI-CBQOVEMMSA-N 2 1 373.541 2.755 20 10 FFCDMP FC(F)(F)Oc1ccc(N2CC[NH+]([C@@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC001246998492 1039569499 /nfs/dbraw/zinc/56/94/99/1039569499.db2.gz XPJRBCGYMQPNSS-MIFYACCESA-N 2 1 355.404 2.990 20 10 FFCDMP Cn1ncc2c1CCC[C@@H]2[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254018097 1040521114 /nfs/dbraw/zinc/52/11/14/1040521114.db2.gz DBSPLCMABASLJF-IBGZPJMESA-N 2 1 371.504 2.820 20 10 FFCDMP Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001254018097 1040521130 /nfs/dbraw/zinc/52/11/30/1040521130.db2.gz DBSPLCMABASLJF-IBGZPJMESA-N 2 1 371.504 2.820 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249237515 1040643856 /nfs/dbraw/zinc/64/38/56/1040643856.db2.gz GHTXXEXLVILORE-RBUKOAKNSA-N 2 1 371.525 2.787 20 10 FFCDMP CCOc1cccc(C[NH2+][C@@]23CC[C@@]([NH2+]CCN(C)C)(C2)CCC3)c1O ZINC001278576067 1041237606 /nfs/dbraw/zinc/23/76/06/1041237606.db2.gz DYJPZBHYHFKGOQ-RTWAWAEBSA-N 2 1 361.530 2.877 20 10 FFCDMP Oc1cccc(F)c1C[NH2+][C@@]12CC[C@@]([NH2+]CCn3ccnc3)(C1)CCC2 ZINC001279422139 1043095534 /nfs/dbraw/zinc/09/55/34/1043095534.db2.gz YLTOKXSQCHFRDV-UXHICEINSA-N 2 1 358.461 2.953 20 10 FFCDMP c1ccc2c(c1)C[NH2+]C21CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001237367320 1043123232 /nfs/dbraw/zinc/12/32/32/1043123232.db2.gz XZACBZSWORZEJA-UHFFFAOYSA-N 3 1 362.521 2.691 20 10 FFCDMP CCOC(=O)[C@@H]1C[N@@H+](Cc2cc3ccccc3cc2O)CCC12C[NH2+]C2 ZINC001237430131 1043156182 /nfs/dbraw/zinc/15/61/82/1043156182.db2.gz IXALVDVZDKLGGV-SFHVURJKSA-N 2 1 354.450 2.520 20 10 FFCDMP CC[C@@H]1[C@@H](C(=O)NCC[C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)CC[N@H+]1C ZINC001281713930 1045030875 /nfs/dbraw/zinc/03/08/75/1045030875.db2.gz JSHXOEYDTOHBRQ-YTQUADARSA-N 2 1 361.530 2.718 20 10 FFCDMP C[C@H](CO)[N@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319717023 1045251083 /nfs/dbraw/zinc/25/10/83/1045251083.db2.gz JNUHAQULBAGZMP-GOSISDBHSA-N 2 1 371.500 2.961 20 10 FFCDMP C[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319717023 1045251093 /nfs/dbraw/zinc/25/10/93/1045251093.db2.gz JNUHAQULBAGZMP-GOSISDBHSA-N 2 1 371.500 2.961 20 10 FFCDMP CN1CCCC(C)(C)[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001320990810 1045507958 /nfs/dbraw/zinc/50/79/58/1045507958.db2.gz LWQSBFILZQKJKI-HXUWFJFHSA-N 2 1 362.537 2.788 20 10 FFCDMP C[NH+]1CCN(c2ccc(CNc3ccc4c(c3)C[NH2+]CCO4)cc2F)CC1 ZINC001326076474 1046755136 /nfs/dbraw/zinc/75/51/36/1046755136.db2.gz ZNWNEJQYERHKJR-UHFFFAOYSA-N 2 1 370.472 2.672 20 10 FFCDMP C[C@@H](O)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)c1ccccc1 ZINC001330315402 1049130033 /nfs/dbraw/zinc/13/00/33/1049130033.db2.gz ISUIUMHVZJZQLZ-IERDGZPVSA-N 2 1 357.473 2.789 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)cc2F)CC1 ZINC001345104158 1052260053 /nfs/dbraw/zinc/26/00/53/1052260053.db2.gz KCGOBNANNGNAKD-QUCCMNQESA-N 2 1 360.521 2.542 20 10 FFCDMP Cc1cccc2c1OC[C@H]([NH2+]Cc1ccc(N3CC[NH+](C)CC3)c(F)c1)C2 ZINC001343504857 1052271784 /nfs/dbraw/zinc/27/17/84/1052271784.db2.gz ZLCXRPLZVQOXBU-LJQANCHMSA-N 2 1 369.484 2.979 20 10 FFCDMP CCc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCN(C)CC3)cc2)c1O ZINC000848892604 1055311672 /nfs/dbraw/zinc/31/16/72/1055311672.db2.gz BONHUYAOXSGCCR-UHFFFAOYSA-N 2 1 353.510 2.992 20 10 FFCDMP COCC[N@H+](Cc1cc(F)c(N(C)C)cc1F)CC1CC[NH+](C)CC1 ZINC001462493859 1061646657 /nfs/dbraw/zinc/64/66/57/1061646657.db2.gz XJDLROLPJLRUAB-UHFFFAOYSA-N 2 1 355.473 2.821 20 10 FFCDMP C[C@H]1C[C@H](C)C[NH+](CCCNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001473935381 1065424307 /nfs/dbraw/zinc/42/43/07/1065424307.db2.gz CLXGXMYOORLTQB-PMACEKPBSA-N 2 1 358.574 2.896 20 10 FFCDMP CCCN(CCC)c1ccc(C[NH2+]CCC(=O)N2CC[NH+](C)CC2)cc1 ZINC001473985585 1065433218 /nfs/dbraw/zinc/43/32/18/1065433218.db2.gz YMNVPBMJVAITNK-UHFFFAOYSA-N 2 1 360.546 2.567 20 10 FFCDMP CC(C)c1ccc(O)c(C[NH+]2CCC(CC(=O)N3CC[NH+](C)CC3)CC2)c1 ZINC001474336638 1065498190 /nfs/dbraw/zinc/49/81/90/1065498190.db2.gz IZFQTSZUJGOBIL-UHFFFAOYSA-N 2 1 373.541 2.892 20 10 FFCDMP CCC[NH2+]CCNC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC001577556920 1078375719 /nfs/dbraw/zinc/37/57/19/1078375719.db2.gz KRYGSKPTTHHVAF-UHFFFAOYSA-N 2 1 356.514 2.524 20 10 FFCDMP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cc(Br)ccc2O)CCCO1 ZINC000277711037 510970167 /nfs/dbraw/zinc/97/01/67/510970167.db2.gz IREOZYBIAHKKPC-CYBMUJFWSA-N 2 1 357.292 2.745 20 10 FFCDMP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2cc(Br)ccc2O)CCCO1 ZINC000277711037 510970176 /nfs/dbraw/zinc/97/01/76/510970176.db2.gz IREOZYBIAHKKPC-CYBMUJFWSA-N 2 1 357.292 2.745 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000375786512 512506415 /nfs/dbraw/zinc/50/64/15/512506415.db2.gz MSVKTZYLUJLQNL-HOJAQTOUSA-N 2 1 361.505 2.749 20 10 FFCDMP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1(C)C ZINC000858176271 730418765 /nfs/dbraw/zinc/41/87/65/730418765.db2.gz SJSJOLNXHXOLOE-HNNXBMFYSA-N 2 1 353.457 2.764 20 10 FFCDMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)CC1(C)C ZINC000858176271 730418766 /nfs/dbraw/zinc/41/87/66/730418766.db2.gz SJSJOLNXHXOLOE-HNNXBMFYSA-N 2 1 353.457 2.764 20 10 FFCDMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000761203846 736707391 /nfs/dbraw/zinc/70/73/91/736707391.db2.gz MSXZCJSRBRHNGH-INIZCTEOSA-N 2 1 356.894 2.987 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000894297908 964321353 /nfs/dbraw/zinc/32/13/53/964321353.db2.gz KEJGLISWTGMXPH-UXHICEINSA-N 2 1 370.493 2.682 20 10 FFCDMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1O ZINC000894297908 964321367 /nfs/dbraw/zinc/32/13/67/964321367.db2.gz KEJGLISWTGMXPH-UXHICEINSA-N 2 1 370.493 2.682 20 10 FFCDMP CC[C@@H]1[C@@H](C(=O)N(CC)CC[NH2+]Cc2ccc(OC)c(C)c2)CC[N@H+]1C ZINC001482924029 981590909 /nfs/dbraw/zinc/59/09/09/981590909.db2.gz CNWQGJHMUXFSKY-RBUKOAKNSA-N 2 1 361.530 2.672 20 10 FFCDMP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 ZINC000765973794 987923068 /nfs/dbraw/zinc/92/30/68/987923068.db2.gz FRLSUVXROBFPBN-XMSQKQJNSA-N 2 1 373.541 2.817 20 10 FFCDMP CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)C2 ZINC000922388481 988534315 /nfs/dbraw/zinc/53/43/15/988534315.db2.gz FGMYHSSWSVYOKW-AFYVEPGGSA-N 2 1 367.484 2.600 20 10 FFCDMP CCOc1cccc(C[NH2+][C@@H]2C[C@@]3(C[N@@H+](CC)[C@@H]3C(C)C)C[C@H]2O)c1O ZINC000922394144 988556777 /nfs/dbraw/zinc/55/67/77/988556777.db2.gz VNDSXXHFBSHVFO-DGQTTZFYSA-N 2 1 362.514 2.750 20 10 FFCDMP CCOc1cccc(C[NH2+][C@@H]2C[C@]3(C[N@@H+](CC)[C@H]3C(C)C)C[C@H]2O)c1O ZINC000922394345 988556841 /nfs/dbraw/zinc/55/68/41/988556841.db2.gz VNDSXXHFBSHVFO-SGLNWRHMSA-N 2 1 362.514 2.750 20 10 FFCDMP Cc1cc(C[N@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)ccc1N(C)C ZINC000923340459 991080595 /nfs/dbraw/zinc/08/05/95/991080595.db2.gz FAYGEADOYACJJD-FQEVSTJZSA-N 2 1 367.541 2.939 20 10 FFCDMP Cc1cc(C[N@@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)ccc1N(C)C ZINC000923340459 991080600 /nfs/dbraw/zinc/08/06/00/991080600.db2.gz FAYGEADOYACJJD-FQEVSTJZSA-N 2 1 367.541 2.939 20 10 FFCDMP C[N@@H+](CCN1CCN(Cc2ccccc2)CC1)Cc1cc(F)ccc1O ZINC000809695122 994570984 /nfs/dbraw/zinc/57/09/84/994570984.db2.gz ZHKFJTMTELYCPU-UHFFFAOYSA-N 2 1 357.473 2.781 20 10 FFCDMP C[N@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1cc(F)ccc1O ZINC000809695122 994570996 /nfs/dbraw/zinc/57/09/96/994570996.db2.gz ZHKFJTMTELYCPU-UHFFFAOYSA-N 2 1 357.473 2.781 20 10 FFCDMP C[N@@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1cc(F)ccc1O ZINC000809695122 994571002 /nfs/dbraw/zinc/57/10/02/994571002.db2.gz ZHKFJTMTELYCPU-UHFFFAOYSA-N 2 1 357.473 2.781 20 10 FFCDMP COc1ccc2ccc(O)c(C[NH+]3CCN([C@@H]4CCC[N@@H+](C)C4)CC3)c2c1 ZINC000738215046 999622750 /nfs/dbraw/zinc/62/27/50/999622750.db2.gz RRFYQHNMSKAFPP-GOSISDBHSA-N 2 1 369.509 2.766 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000741258905 999717162 /nfs/dbraw/zinc/71/71/62/999717162.db2.gz QWDWZHCEBKPJON-NRFANRHFSA-N 2 1 357.473 2.618 20 10 FFCDMP CN(C)c1ccc(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000741258905 999717164 /nfs/dbraw/zinc/71/71/64/999717164.db2.gz QWDWZHCEBKPJON-NRFANRHFSA-N 2 1 357.473 2.618 20 10 FFCDMP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CC[C@H](O)C2)c1O ZINC000846166541 1000214930 /nfs/dbraw/zinc/21/49/30/1000214930.db2.gz YZLRJICRDJIKTO-YJBOKZPZSA-N 2 1 356.466 2.818 20 10 FFCDMP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C(=O)C(F)(F)F)CC3)cc2)CC1 ZINC000776008961 1005004981 /nfs/dbraw/zinc/00/49/81/1005004981.db2.gz PVYQULANKLGCOG-UHFFFAOYSA-N 2 1 369.431 2.782 20 10 FFCDMP Oc1c(F)cc(F)cc1C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000883028283 1006605345 /nfs/dbraw/zinc/60/53/45/1006605345.db2.gz FORWYHACRFXKLG-UHFFFAOYSA-N 2 1 362.420 2.917 20 10 FFCDMP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940263 1007817999 /nfs/dbraw/zinc/81/79/99/1007817999.db2.gz FCBMLSRKQWZQFB-ZPMCFJSWSA-N 2 1 367.541 2.648 20 10 FFCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249904 1008915356 /nfs/dbraw/zinc/91/53/56/1008915356.db2.gz WJJXAMLBSFWWLD-NRFANRHFSA-N 3 1 358.574 2.896 20 10 FFCDMP CC(C)C[N@@H+]1CCC[C@@H](CNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249904 1008915372 /nfs/dbraw/zinc/91/53/72/1008915372.db2.gz WJJXAMLBSFWWLD-NRFANRHFSA-N 2 1 358.574 2.896 20 10 FFCDMP CC(C)C[N@H+]1CCC[C@@H](CNCc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001178249904 1008915388 /nfs/dbraw/zinc/91/53/88/1008915388.db2.gz WJJXAMLBSFWWLD-NRFANRHFSA-N 2 1 358.574 2.896 20 10 FFCDMP CN(Cc1ccccc1O)C(=O)CC1([NH3+])CC[NH+](Cc2ccccc2)CC1 ZINC000686819857 1022151727 /nfs/dbraw/zinc/15/17/27/1022151727.db2.gz ZIORAJHVCUDABK-UHFFFAOYSA-N 2 1 367.493 2.734 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@@H]2C1 ZINC001120070868 1023228810 /nfs/dbraw/zinc/22/88/10/1023228810.db2.gz CPVQVNSJMPUQAL-JAXLGGSGSA-N 3 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@@H]([NH+](C)C)C[C@H]4C3)cc2)CC1 ZINC001120070868 1023228820 /nfs/dbraw/zinc/22/88/20/1023228820.db2.gz CPVQVNSJMPUQAL-JAXLGGSGSA-N 2 1 356.558 2.601 20 10 FFCDMP CN1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@@H]([NH+](C)C)C[C@H]4C3)cc2)CC1 ZINC001120070868 1023228829 /nfs/dbraw/zinc/22/88/29/1023228829.db2.gz CPVQVNSJMPUQAL-JAXLGGSGSA-N 2 1 356.558 2.601 20 10 FFCDMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@H]2C1 ZINC001120072576 1023230506 /nfs/dbraw/zinc/23/05/06/1023230506.db2.gz XHBKQSKFQLHNEF-GUDVDZBRSA-N 2 1 361.505 2.824 20 10 FFCDMP [NH3+]Cc1cn([C@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)nn1 ZINC000841100081 1030036791 /nfs/dbraw/zinc/03/67/91/1030036791.db2.gz SYGGHHFETCLHKE-FQEVSTJZSA-N 2 1 354.502 2.564 20 10 FFCDMP CCOc1cccc(C[N@H+]2CC[C@@]3(C[NH+](CC4CC4)C[C@@H]3COC)C2)c1O ZINC001203608409 1030783773 /nfs/dbraw/zinc/78/37/73/1030783773.db2.gz OIHLTKXBUPVLDX-KNQAVFIVSA-N 2 1 374.525 2.971 20 10 FFCDMP Fc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)ccc1N1CCOCC1 ZINC000843128885 1031196592 /nfs/dbraw/zinc/19/65/92/1031196592.db2.gz YIXGTLZIKMJBAJ-RTBURBONSA-N 2 1 361.505 2.874 20 10 FFCDMP [NH3+]C[C@@]1(O)CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)CC1 ZINC001205240360 1031620990 /nfs/dbraw/zinc/62/09/90/1031620990.db2.gz JGRGHBMBXWOXTN-OAQYLSRUSA-N 2 1 356.466 2.647 20 10 FFCDMP COc1cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(O)cc1Br ZINC001205653038 1031906529 /nfs/dbraw/zinc/90/65/29/1031906529.db2.gz SFAHNZSWDHFGFM-NWDGAFQWSA-N 2 1 357.292 2.970 20 10 FFCDMP COCC[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C1CC[NH+](C)CC1 ZINC001138337289 1034167757 /nfs/dbraw/zinc/16/77/57/1034167757.db2.gz NCPSRWWGIMZBBJ-UHFFFAOYSA-N 2 1 373.541 2.634 20 10 FFCDMP COCC[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C1CC[NH+](C)CC1 ZINC001138337289 1034167764 /nfs/dbraw/zinc/16/77/64/1034167764.db2.gz NCPSRWWGIMZBBJ-UHFFFAOYSA-N 2 1 373.541 2.634 20 10 FFCDMP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H](c2cccc(Cl)c2)[NH+](C)C)cc1 ZINC000832273563 1034694108 /nfs/dbraw/zinc/69/41/08/1034694108.db2.gz OTMPAECTTGMCST-OALUTQOASA-N 2 1 374.916 2.825 20 10 FFCDMP COc1cc(C[N@H+]2CCC[C@H](Oc3cccnc3)C2)cc(C[NH+](C)C)c1O ZINC001139256457 1035029735 /nfs/dbraw/zinc/02/97/35/1035029735.db2.gz CFIPPKQLPXTETM-IBGZPJMESA-N 2 1 371.481 2.901 20 10 FFCDMP COc1cc(C[N@H+](C)Cc2cccc3c2OCO3)cc(C[NH+](C)C)c1O ZINC001139260244 1035032175 /nfs/dbraw/zinc/03/21/75/1035032175.db2.gz IWJIYVVGLAMIAN-UHFFFAOYSA-N 2 1 358.438 2.823 20 10 FFCDMP COc1cc(C[N@@H+](C)Cc2cccc3c2OCO3)cc(C[NH+](C)C)c1O ZINC001139260244 1035032182 /nfs/dbraw/zinc/03/21/82/1035032182.db2.gz IWJIYVVGLAMIAN-UHFFFAOYSA-N 2 1 358.438 2.823 20 10 FFCDMP CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139404471 1035091785 /nfs/dbraw/zinc/09/17/85/1035091785.db2.gz IVTIKBQOHMPVLX-FQEVSTJZSA-N 2 1 372.557 2.519 20 10 FFCDMP CCC[NH+]1C[C@@H]2CN(Cc3ccc(N4CC[NH+](CC)CC4)cc3)C[C@H]2C1 ZINC001140309874 1035429384 /nfs/dbraw/zinc/42/93/84/1035429384.db2.gz XZPADNBKTOLSGF-NHCUHLMSSA-N 2 1 356.558 2.602 20 10 FFCDMP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1ccc(C(F)(F)F)cc1O ZINC001233453906 1036633726 /nfs/dbraw/zinc/63/37/26/1036633726.db2.gz YIQKASBRYRUTHN-JKSUJKDBSA-N 2 1 357.420 2.621 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)cc1O ZINC001233484600 1036653568 /nfs/dbraw/zinc/65/35/68/1036653568.db2.gz QREOMUKQJKKSEQ-UHFFFAOYSA-N 2 1 369.465 2.687 20 10 FFCDMP Oc1cc(O)c(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487296 1036655683 /nfs/dbraw/zinc/65/56/83/1036655683.db2.gz XWAHNSRBHGLXHL-SJLPKXTDSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487296 1036655690 /nfs/dbraw/zinc/65/56/90/1036655690.db2.gz XWAHNSRBHGLXHL-SJLPKXTDSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487296 1036655703 /nfs/dbraw/zinc/65/57/03/1036655703.db2.gz XWAHNSRBHGLXHL-SJLPKXTDSA-N 2 1 354.450 2.757 20 10 FFCDMP Oc1cc(O)c(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1O ZINC001233487296 1036655711 /nfs/dbraw/zinc/65/57/11/1036655711.db2.gz XWAHNSRBHGLXHL-SJLPKXTDSA-N 2 1 354.450 2.757 20 10 FFCDMP CCOC(=O)[C@@]12CCC3(CC[NH2+]CC3)[C@@H]1C[N@@H+](Cc1c(C)cccc1O)C2 ZINC001235326197 1037478033 /nfs/dbraw/zinc/47/80/33/1037478033.db2.gz RJWMWFGAYFWYRT-SIKLNZKXSA-N 2 1 372.509 2.846 20 10 FFCDMP CN1CC[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1c1ccccc1 ZINC001235675512 1037677785 /nfs/dbraw/zinc/67/77/85/1037677785.db2.gz YURQAWQOOPHJHB-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1c1ccccc1 ZINC001235675512 1037677791 /nfs/dbraw/zinc/67/77/91/1037677791.db2.gz YURQAWQOOPHJHB-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP C[N@H+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C[C@H]1c1ccccc1 ZINC001235675512 1037677798 /nfs/dbraw/zinc/67/77/98/1037677798.db2.gz YURQAWQOOPHJHB-QFIPXVFZSA-N 2 1 350.510 2.585 20 10 FFCDMP Cc1cccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC2CC[NH+](C)CC2)c1O ZINC001231591351 1037707115 /nfs/dbraw/zinc/70/71/15/1037707115.db2.gz ASIKRVWPSSEXBN-WOJBJXKFSA-N 2 1 371.525 2.608 20 10 FFCDMP CCOC(=O)[C@]12C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]1C[NH2+]CC2 ZINC001236040869 1037902295 /nfs/dbraw/zinc/90/22/95/1037902295.db2.gz PGZCOIGOTMZEEI-DYESRHJHSA-N 2 1 360.498 2.664 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236213011 1037989161 /nfs/dbraw/zinc/98/91/61/1037989161.db2.gz ARPCUUVPIPKOCI-ZWKOTPCHSA-N 2 1 364.486 2.816 20 10 FFCDMP CCOC(=O)CCCOc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c(O)c1 ZINC001236213011 1037989172 /nfs/dbraw/zinc/98/91/72/1037989172.db2.gz ARPCUUVPIPKOCI-ZWKOTPCHSA-N 2 1 364.486 2.816 20 10 FFCDMP CCOc1ccc(C[N@H+]2CC[C@@]3(C[NH+](C)C[C@@H]3COCC3CC3)C2)c(O)c1 ZINC001237039670 1038417155 /nfs/dbraw/zinc/41/71/55/1038417155.db2.gz BOFWLCUUOUWJOZ-DENIHFKCSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001237039670 1038417157 /nfs/dbraw/zinc/41/71/57/1038417157.db2.gz BOFWLCUUOUWJOZ-DENIHFKCSA-N 2 1 374.525 2.971 20 10 FFCDMP CCOc1ccc(C[NH+]2CC[C@]3(C2)C[N@@H+](C)C[C@@H]3COCC2CC2)c(O)c1 ZINC001237039670 1038417163 /nfs/dbraw/zinc/41/71/63/1038417163.db2.gz BOFWLCUUOUWJOZ-DENIHFKCSA-N 2 1 374.525 2.971 20 10 FFCDMP Cc1cc(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)ccc1N(C)C ZINC001278686337 1039773734 /nfs/dbraw/zinc/77/37/34/1039773734.db2.gz LZDBBLKVXOKZBD-JOCHJYFZSA-N 2 1 358.574 2.911 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001279506589 1043202519 /nfs/dbraw/zinc/20/25/19/1043202519.db2.gz YQXPHQUVDFLOCP-HOTGVXAUSA-N 2 1 357.420 2.621 20 10 FFCDMP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001279506589 1043202531 /nfs/dbraw/zinc/20/25/31/1043202531.db2.gz YQXPHQUVDFLOCP-HOTGVXAUSA-N 2 1 357.420 2.621 20 10 FFCDMP Oc1cc(C[NH+]2CCC3(CC[N@@H+](Cc4ccc[nH]4)C3)CC2)cc(O)c1O ZINC001279681547 1043460379 /nfs/dbraw/zinc/46/03/79/1043460379.db2.gz BIXAPHOJAKUBPP-UHFFFAOYSA-N 2 1 357.454 2.620 20 10 FFCDMP COC(=O)c1c(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c2cc(F)ccc2n1C ZINC001578850319 1078534325 /nfs/dbraw/zinc/53/43/25/1078534325.db2.gz DNYXCWDNNLPLLS-NUTKFTJISA-N 2 1 359.445 2.663 20 10 FFCDMP COC(=O)c1c(C[N@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c2cc(F)ccc2n1C ZINC001578850319 1078534331 /nfs/dbraw/zinc/53/43/31/1078534331.db2.gz DNYXCWDNNLPLLS-NUTKFTJISA-N 2 1 359.445 2.663 20 10 FFCDMP CN(C)c1cc[nH+]c(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)n1 ZINC000091675442 508001250 /nfs/dbraw/zinc/00/12/50/508001250.db2.gz SZJWRYWDXSBTMW-UHFFFAOYSA-N 2 1 366.513 2.687 20 10 FFCDMP